A0A096MPU2_PAPAN Loading...

Importin-5

AlphaFold DB , UniProt , Accession A0A096MPU2, Species PAPAN (Papio anubis, Olive baboon), Gene IPO5, Length 1,115 aa.

						>A0A096MPU2_PAPAN|A0A096MPU2|IPO5
MPEDQVGKLEATENTVSAMAAAAAEQQQFYLLLGNLLSPDNVVRKQAEETYENIPGQSKITFLLQAIRNTTAAEEARQMAAVLLRRLLSSAFDEVYPTLPSDVQTAIKSELLMIIQMETQSSMRKKVCDIAAELARNLIDEDGNNQWPEGLKFLFDSVSSQNVGLREAALHIFWNFPGIFGNQQQHYLDVIKRMLVQCMQDQEHPSIRTLSARATAAFILANEHNVALFKHFADLLPGFLQAVNDSCYQNDDSVLKSLVEIADTVPKYLRPHLEATLQLSLKLCGDTSLNNMQRQLALEVIVTLSETAAAMLRKHTNIVAQTIPQMLAMMVDLEEDEDWANADELEDDDFDSNAVAGESALDRMACGLGGKLVLPMIKEHIMQMLQNPDWKYRHAGLMALSAIGEGCHQQMEGILNEIVNFVLLFLQDPHPRVRYAACNAVGQMATDFAPGFQKKFHEKVIAALLQTMEDQGNQRVQAHAAAALINFTEDCPKSLLIPYLDNLVKHLHSIMVLKLQELIQKGTKLVLEQVVTSIASVADTAEEKFVPYYDLFMPSLKHIVENAVQKELRLLRGKTIECISLIGLAVGKEKFMQDASDVMQLLLKTQTDFNDMEDDDPQISYMISAWARMCKILGKEFQQYLPVVMGPLMKTASIKPEVALLDTQDMENMSDDDGWEFVNLGDQQSFGIKTAGLEEKSTACQMLVCYAKELKEGFVEYTEQVVKLMVPLLKFYFHDGVRVAAAESMPLLLECARVRGPEYLTQMWHFMCDALIKAIGTEPDSDVLSEIMHSFAKCIEVMGDGCLNNEHFEELGGILKAKLEEHFKNQELRQVKRQDEDYDEQVEESLQDEDDNDVYILTKVSDILHSIFSSYKEKVLPWFEQLLPLIVNLICPHRPWPDRQWGLCIFDDVIEHCSPASFKYAEYFLRPMLQYVCDNSPEVRQAAAYGLGVMAQYGGDNYRPFCTEALPLLVRVIQSADSKTKENVNATENCISAVGKIMKFKPDCVNVEEVLPHWLSWLPLHEDKEEAVQTFNYLCDLIESNHPIVLGPNNTNLPKIFSIIAEGEMHEAIKHEDPCAKRLANVVRQVQTSGGLWTECIAQLSPEQQAAIQELLNSA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.3	Low	48.5	Very low	196 Å²	196	113.8 Å²	113.8	97%	0.966	61%	0.612	S	S	*	*				0	141	0	-77.1	165.2	65.6	0	0	107.4	Q5	M1-Q5 HydrophobicContact CE-CB 4.35Å
2	P	48.8	Very low	48.7	Very low	88 Å²	88	110.7 Å²	110.7	57%	0.571	60%	0.6	S	S	*	*			trans	-73.8	150.6	-175.2	-0.7	17.8	0	0	0	111.1	D4 Q5	P2-D4 PolarHBondContact O-N 2.98Å; P2-Q5 PolarHBondContact O-N 3.39Å
3	E	49.6	Very low	48.8	Very low	181 Å²	181	112.5 Å²	112.5	85%	0.846	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-18.7	-179.9	-74.3	169.5	149.4	0	0	114.1	Q5 V6	E3-Q5 VanDerWaalsContact C-N 3.25Å; E3-Q5 PolarHBondContact O-N 2.96Å; E3-V6 PolarHBondContact O-N 3.39Å
4	D	47.3	Very low	49	Very low	135 Å²	135	112.9 Å²	112.9	72%	0.722	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-15.8	173	-85.2	-23.9	0	0	0	115.2	P2	P2-D4 PolarHBondContact O-N 2.98Å
5	Q	45	Very low	49.1	Very low	91 Å²	91	110.7 Å²	110.7	43%	0.425	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-26	176.5	-82.6	-178.9	-30.8	0	0	113.4	M1 P2 E3 L9	M1-Q5 HydrophobicContact CE-CB 4.35Å; P2-Q5 PolarHBondContact O-N 3.39Å; E3-Q5 VanDerWaalsContact C-N 3.25Å; E3-Q5 PolarHBondContact O-N 2.96Å; Q5-L9 WeakPolarHBondContact O-CB 3.33Å; Q5-L9 WeakPolarHBondContact O-CD1 3.32Å; Q5-L9 PolarHBondContact O-N 2.7Å; Q5-L9 VanDerWaalsContact O-N 3.07Å
6	V	53.2	Low	49.4	Very low	87 Å²	87	109.6 Å²	109.6	53%	0.527	60%	0.595	S	S	.	*	H	α-helix	trans	-77.2	-42.9	179.9	-178.2	0	0	0	0	110.5	E3 K8 L9 E10	E3-V6 PolarHBondContact O-N 3.39Å; V6-K8 VanDerWaalsContact C-N 3.28Å; V6-K8 PolarHBondContact O-N 3.1Å; V6-L9 PolarHBondContact O-N 3.29Å; V6-E10 PolarHBondContact O-N 2.9Å
7	G	46	Very low	49.7	Very low	45 Å²	45	107.8 Å²	107.8	46%	0.464	59%	0.592	S	S	.	*	H	α-helix	trans	-65.8	-27.9	173.8	0	0	0	0	0	113.8	A11	G7-A11 WeakPolarHBondContact O-CB 3.39Å; G7-A11 PolarHBondContact O-N 3.36Å; G7-A11 VanDerWaalsContact O-N 3.17Å
8	K	47.6	Very low	49.9	Very low	155 Å²	155	105.1 Å²	105.1	67%	0.674	59%	0.587	S	S	*	*	H	α-helix	trans	-73.2	-41.5	171	-80.7	-178.5	178.5	177.8	0	112	V6 A11 T12	V6-K8 VanDerWaalsContact C-N 3.28Å; V6-K8 PolarHBondContact O-N 3.1Å; K8-A11 PolarHBondContact O-N 3.36Å; K8-T12 PolarHBondContact O-N 3.23Å; K8-T12 PolarHBondContact O-OG1 2.91Å
9	L	48.1	Very low	50.1	Low	101 Å²	101	107 Å²	107	53%	0.529	59%	0.592	S	S	.	*	H	α-helix	trans	-66	-43.3	177.2	-91.6	152.2	0	0	0	112.7	Q5 V6 T12 E13	Q5-L9 WeakPolarHBondContact O-CB 3.33Å; Q5-L9 WeakPolarHBondContact O-CD1 3.32Å; Q5-L9 PolarHBondContact O-N 2.7Å; Q5-L9 VanDerWaalsContact O-N 3.07Å; V6-L9 PolarHBondContact O-N 3.29Å; L9-T12 WeakPolarHBondContact CA-OG1 3.5Å; L9-T12 PolarHBondContact O-N 3.25Å; L9-T12 PolarHBondContact O-OG1 3.43Å; L9-E13 PolarHBondContact O-N 3.36Å
10	E	48.9	Very low	50.6	Low	116 Å²	116	104.8 Å²	104.8	54%	0.542	59%	0.589	S	S	.	*	H	α-helix	trans	-66.3	-37.7	174	-79.9	-179.6	156.4	0	0	112.2	V6 T12 E13 N14	V6-E10 PolarHBondContact O-N 2.9Å; E10-T12 VanDerWaalsContact C-N 3.31Å; E10-T12 PolarHBondContact O-N 3.08Å; E10-E13 PolarHBondContact O-N 3.28Å; E10-N14 VanDerWaalsContact O-CB 3.31Å; E10-N14 WeakPolarHBondContact O-CB 3.48Å; E10-N14 PolarHBondContact O-N 3.43Å; E10-N14 PolarHBondContact O-ND2 2.73Å
11	A	47	Very low	51.4	Low	57 Å²	57	102.1 Å²	102.1	47%	0.471	58%	0.58	S	S	.	*	H	α-helix	trans	-66.5	-33.1	172.5	0	0	0	0	0	112.2	G7 K8 T15	G7-A11 WeakPolarHBondContact O-CB 3.39Å; G7-A11 PolarHBondContact O-N 3.36Å; G7-A11 VanDerWaalsContact O-N 3.17Å; K8-A11 PolarHBondContact O-N 3.36Å; A11-T15 PolarHBondContact O-N 3.14Å; A11-T15 VanDerWaalsContact O-N 3.17Å; A11-T15 PolarHBondContact O-OG1 2.92Å
12	T	50.3	Low	52.2	Low	76 Å²	76	95.3 Å²	95.3	47%	0.466	56%	0.555	S	S	.	*	H	α-helix	trans	-75	-39.5	174.8	-2.8	0	0	0	0	112.1	K8 L9 E10 T15 V16	K8-T12 PolarHBondContact O-N 3.23Å; K8-T12 PolarHBondContact O-OG1 2.91Å; L9-T12 WeakPolarHBondContact CA-OG1 3.5Å; L9-T12 PolarHBondContact O-N 3.25Å; L9-T12 PolarHBondContact O-OG1 3.43Å; E10-T12 VanDerWaalsContact C-N 3.31Å; E10-T12 PolarHBondContact O-N 3.08Å; T12-T15 WeakPolarHBondContact CA-OG1 3.49Å; T12-T15 PolarHBondContact O-N 3.47Å; T12-T15 PolarHBondContact O-OG1 2.97Å; T12-T15 VanDerWaalsContact O-OG1 3.1Å; T12-V16 WeakPolarHBondContact O-CB 3.3Å; T12-V16 WeakPolarHBondContact O-CG2 3.42Å; T12-V16 PolarHBondContact O-N 3.08Å
13	E	50.8	Low	53.4	Low	135 Å²	135	94.1 Å²	94.1	63%	0.631	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-40.2	176	-82.7	-176.3	155.6	0	0	112.1	L9 E10 V16 S17	L9-E13 PolarHBondContact O-N 3.36Å; E10-E13 PolarHBondContact O-N 3.28Å; E13-V16 PolarHBondContact O-N 2.86Å; E13-S17 WeakPolarHBondContact O-CB 3.47Å; E13-S17 PolarHBondContact O-N 3.27Å
14	N	50.6	Low	54.9	Low	118 Å²	118	87.9 Å²	87.9	63%	0.631	53%	0.531	S	S	*	.	H	α-helix	trans	-67.3	-36.8	175.4	-76.2	-25.9	0	0	0	112.5	E10 A18	E10-N14 VanDerWaalsContact O-CB 3.31Å; E10-N14 WeakPolarHBondContact O-CB 3.48Å; E10-N14 PolarHBondContact O-N 3.43Å; E10-N14 PolarHBondContact O-ND2 2.73Å; N14-A18 WeakPolarHBondContact O-CB 3.41Å; N14-A18 PolarHBondContact O-N 2.95Å
15	T	51.4	Low	56.7	Low	79 Å²	79	86.3 Å²	86.3	49%	0.485	52%	0.52	S	S	.	.	H	α-helix	trans	-69.8	-40	173.1	30.1	0	0	0	0	112	A11 T12 A18 M19	A11-T15 PolarHBondContact O-N 3.14Å; A11-T15 VanDerWaalsContact O-N 3.17Å; A11-T15 PolarHBondContact O-OG1 2.92Å; T12-T15 WeakPolarHBondContact CA-OG1 3.49Å; T12-T15 PolarHBondContact O-N 3.47Å; T12-T15 PolarHBondContact O-OG1 2.97Å; T12-T15 VanDerWaalsContact O-OG1 3.1Å; T15-A18 PolarHBondContact O-N 3.17Å; T15-M19 WeakPolarHBondContact O-CB 3.27Å; T15-M19 WeakPolarHBondContact O-CG 3.47Å; T15-M19 PolarHBondContact O-N 3.26Å
16	V	54	Low	58.6	Low	94 Å²	94	83.4 Å²	83.4	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-65	-39.5	176	171.6	0	0	0	0	111.5	T12 E13 M19 A20	T12-V16 WeakPolarHBondContact O-CB 3.3Å; T12-V16 WeakPolarHBondContact O-CG2 3.42Å; T12-V16 PolarHBondContact O-N 3.08Å; E13-V16 PolarHBondContact O-N 2.86Å; V16-M19 PolarHBondContact O-N 3.02Å; V16-A20 WeakPolarHBondContact O-CB 3.48Å; V16-A20 PolarHBondContact O-N 3.03Å
17	S	53.3	Low	60.1	Low	79 Å²	79	84.9 Å²	84.9	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-66.9	-40.1	175.4	-171.1	0	0	0	0	112.5	E13 A20 A21	E13-S17 WeakPolarHBondContact O-CB 3.47Å; E13-S17 PolarHBondContact O-N 3.27Å; S17-A20 PolarHBondContact O-N 3.44Å; S17-A21 PolarHBondContact O-N 3.44Å; S17-A21 VanDerWaalsContact O-N 3.1Å
18	A	54.7	Low	62.2	Low	59 Å²	59	89.3 Å²	89.3	49%	0.488	52%	0.516	S	S	.	.	H	α-helix	trans	-67.8	-39.9	176.2	0	0	0	0	0	112	N14 T15 A20 A21 A22	N14-A18 WeakPolarHBondContact O-CB 3.41Å; N14-A18 PolarHBondContact O-N 2.95Å; T15-A18 PolarHBondContact O-N 3.17Å; A18-A20 VanDerWaalsContact C-N 3.32Å; A18-A20 PolarHBondContact O-N 3.2Å; A18-A21 PolarHBondContact O-N 2.83Å; A18-A22 WeakPolarHBondContact O-CB 3.48Å; A18-A22 PolarHBondContact O-N 3.4Å
19	M	53.8	Low	64.3	Low	141 Å²	141	82.3 Å²	82.3	70%	0.695	49%	0.486	S	S	*	.	H	α-helix	trans	-64.6	-35.4	174.3	-71.9	178.9	82.5	0	0	112.3	T15 V16 A23	T15-M19 WeakPolarHBondContact O-CB 3.27Å; T15-M19 WeakPolarHBondContact O-CG 3.47Å; T15-M19 PolarHBondContact O-N 3.26Å; V16-M19 PolarHBondContact O-N 3.02Å; M19-A23 WeakPolarHBondContact O-CB 3.42Å; M19-A23 PolarHBondContact O-N 3.35Å
20	A	58.7	Low	66.3	Low	63 Å²	63	79.4 Å²	79.4	52%	0.521	47%	0.468	S	S	.	.	H	α-helix	trans	-69.3	-38.2	175.7	0	0	0	0	0	112.7	V16 S17 A18 A24	V16-A20 WeakPolarHBondContact O-CB 3.48Å; V16-A20 PolarHBondContact O-N 3.03Å; S17-A20 PolarHBondContact O-N 3.44Å; A18-A20 VanDerWaalsContact C-N 3.32Å; A18-A20 PolarHBondContact O-N 3.2Å; A20-A24 WeakPolarHBondContact O-CB 3.24Å; A20-A24 PolarHBondContact O-N 3.39Å
21	A	67.6	Low	68.3	Low	48 Å²	48	79.1 Å²	79.1	40%	0.397	47%	0.469	S	S	.	.	H	α-helix	trans	-66.4	-46.7	174.8	0	0	0	0	0	111.7	S17 A18 A23 A24 E25	S17-A21 PolarHBondContact O-N 3.44Å; S17-A21 VanDerWaalsContact O-N 3.1Å; A18-A21 PolarHBondContact O-N 2.83Å; A21-A23 VanDerWaalsContact C-N 3.31Å; A21-A23 PolarHBondContact O-N 3.4Å; A21-A24 WeakPolarHBondContact O-CB 3.46Å; A21-A24 PolarHBondContact O-N 2.95Å; A21-A24 VanDerWaalsContact O-N 3.07Å; A21-E25 WeakPolarHBondContact O-CG 3.18Å; A21-E25 PolarHBondContact O-N 3.17Å
22	A	69.6	Low	70.5	Confident	54 Å²	54	77.3 Å²	77.3	45%	0.446	45%	0.452	S	S	.	.	H	α-helix	trans	-60.2	-39.3	176.2	0	0	0	0	0	112.6	A18 Q26	A18-A22 WeakPolarHBondContact O-CB 3.48Å; A18-A22 PolarHBondContact O-N 3.4Å; A22-Q26 PolarHBondContact O-N 3.13Å; A22-Q26 VanDerWaalsContact O-N 3.12Å
23	A	74.7	Confident	72.5	Confident	62 Å²	62	73.7 Å²	73.7	51%	0.512	43%	0.43	S	S	.	.	H	α-helix	trans	-67.3	-34.7	174.6	0	0	0	0	0	112.8	M19 A21 Q27	M19-A23 WeakPolarHBondContact O-CB 3.42Å; M19-A23 PolarHBondContact O-N 3.35Å; A21-A23 VanDerWaalsContact C-N 3.31Å; A21-A23 PolarHBondContact O-N 3.4Å; A23-Q27 PolarHBondContact O-N 2.78Å; A23-Q27 VanDerWaalsContact O-N 3.13Å
24	A	80.6	Confident	74.3	Confident	50 Å²	50	69.1 Å²	69.1	41%	0.413	42%	0.418	S	S	.	.	H	α-helix	trans	-70.1	-40.1	177.2	0	0	0	0	0	112.3	A20 A21 Q27 Q28	A20-A24 WeakPolarHBondContact O-CB 3.24Å; A20-A24 PolarHBondContact O-N 3.39Å; A21-A24 WeakPolarHBondContact O-CB 3.46Å; A21-A24 PolarHBondContact O-N 2.95Å; A21-A24 VanDerWaalsContact O-N 3.07Å; A24-Q27 PolarHBondContact O-N 2.98Å; A24-Q28 PolarHBondContact O-N 3.36Å
25	E	85.6	Confident	76.3	Confident	103 Å²	103	67 Å²	67	48%	0.481	41%	0.407	S	S	.	.	H	α-helix	trans	-63.5	-44.2	174.8	-71.5	171.8	-175.5	0	0	111.4	A21 Q27 Q28 F29 F62	A21-E25 WeakPolarHBondContact O-CG 3.18Å; A21-E25 PolarHBondContact O-N 3.17Å; E25-Q27 VanDerWaalsContact C-N 3.3Å; E25-Q27 PolarHBondContact O-N 3.07Å; E25-Q28 PolarHBondContact O-N 3.04Å; E25-F29 PolarHBondContact O-N 3.33Å; E25-F62 HydrophobicContact CB-CE1 4.2Å; E25-F62 HydrophobicContact CB-CZ 4.07Å
26	Q	84.9	Confident	78.1	Confident	30 Å²	30	64 Å²	64	14%	0.14	39%	0.388	C	S	.	.	H	α-helix	trans	-61.1	-39.1	175.3	-170.7	67.2	39.8	0	0	112.1	A22 F29 Y30 F62	A22-Q26 PolarHBondContact O-N 3.13Å; A22-Q26 VanDerWaalsContact O-N 3.12Å; Q26-F29 WeakPolarHBondContact O-CB 3.28Å; Q26-F29 PolarHBondContact O-N 3.1Å; Q26-Y30 HydrophobicContact CG-CD2 4.38Å; Q26-Y30 HydrophobicContact CG-CE2 3.78Å; Q26-Y30 WeakPolarHBondContact O-CD2 3.41Å; Q26-Y30 PolarHBondContact O-N 3.03Å; Q26-F62 PolarHBondContact NE2-O 2.82Å; Q26-F62 VanDerWaalsContact NE2-O 3.11Å
27	Q	84.6	Confident	79.8	Confident	118 Å²	118	63.2 Å²	63.2	55%	0.551	38%	0.38	S	S	*	.	H	α-helix	trans	-65.9	-38.5	176.9	-173.2	63	28.6	0	0	112.3	A23 A24 E25 F29 Y30	A23-Q27 PolarHBondContact O-N 2.78Å; A23-Q27 VanDerWaalsContact O-N 3.13Å; A24-Q27 PolarHBondContact O-N 2.98Å; E25-Q27 VanDerWaalsContact C-N 3.3Å; E25-Q27 PolarHBondContact O-N 3.07Å; Q27-F29 VanDerWaalsContact C-N 3.32Å; Q27-Y30 PolarHBondContact O-N 3.13Å
28	Q	88.6	Confident	81.5	Confident	138 Å²	138	60.8 Å²	60.8	65%	0.645	36%	0.363	S	S	*	.	H	α-helix	trans	-66.5	-36.1	173.8	-72.9	-179	1.3	0	0	111.7	A24 E25 Y30 L31 L32	A24-Q28 PolarHBondContact O-N 3.36Å; E25-Q28 PolarHBondContact O-N 3.04Å; Q28-Y30 PolarHBondContact O-N 3.07Å; Q28-L31 WeakPolarHBondContact O-CB 3.42Å; Q28-L31 PolarHBondContact O-N 3.06Å; Q28-L31 VanDerWaalsContact O-N 3.16Å; Q28-L32 PolarHBondContact O-N 3.03Å
29	F	92.4	Very high	83.1	Confident	7 Å²	7	64.4 Å²	64.4	3%	0.031	38%	0.382	C	S	.	.	H	α-helix	trans	-64.1	-37.1	177.3	-167	-102.4	0	0	0	112.9	E25 Q26 Q27 L31 L32 L33 Y51 I54 F62 L63	E25-F29 PolarHBondContact O-N 3.33Å; Q26-F29 WeakPolarHBondContact O-CB 3.28Å; Q26-F29 PolarHBondContact O-N 3.1Å; Q27-F29 VanDerWaalsContact C-N 3.32Å; F29-L31 VanDerWaalsContact C-N 3.31Å; F29-L31 PolarHBondContact O-N 2.75Å; F29-L32 HydrophobicContact CD2-CD2 4.24Å; F29-L32 HydrophobicContact CE2-CD2 4.33Å; F29-L32 WeakPolarHBondContact O-CB 3.26Å; F29-L32 PolarHBondContact O-N 3.12Å; F29-L33 HydrophobicContact CD1-CD1 3.92Å; F29-L33 HydrophobicContact CD1-CG 4.18Å; F29-L33 HydrophobicContact CE1-CD1 3.75Å; F29-L33 HydrophobicContact CE1-CD2 4.16Å; F29-L33 HydrophobicContact CE1-CG 3.93Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 HydrophobicContact CZ-CG 4.47Å; F29-L33 PolarHBondContact O-N 3.21Å; F29-Y51 HydrophobicContact CE2-CD2 4.27Å; F29-Y51 HydrophobicContact CE2-CE2 4.4Å; F29-Y51 HydrophobicContact CZ-CD2 4.49Å; F29-Y51 HydrophobicContact CZ-CE2 4.26Å; F29-I54 HydrophobicContact CD2-CD1 4.23Å; F29-I54 HydrophobicContact CE2-CD1 4.07Å; F29-F62 HydrophobicContact CD1-CB 3.68Å; F29-F62 HydrophobicContact CD2-CB 3.94Å; F29-F62 HydrophobicContact CD2-CD2 4.06Å; F29-F62 HydrophobicContact CD2-CG 4.25Å; F29-F62 HydrophobicContact CE1-CB 3.72Å; F29-F62 HydrophobicContact CE2-CB 4Å; F29-F62 HydrophobicContact CE2-CD2 4.36Å; F29-F62 HydrophobicContact CG-CB 3.78Å; F29-F62 HydrophobicContact CG-CD2 4.47Å; F29-F62 HydrophobicContact CG-CG 4.23Å; F29-F62 HydrophobicContact CZ-CB 3.88Å; F29-L63 HydrophobicContact CE1-CD2 3.85Å; F29-L63 HydrophobicContact CE1-CG 4.16Å; F29-L63 HydrophobicContact CZ-CD2 3.64Å; F29-L63 HydrophobicContact CZ-CG 3.87Å
30	Y	89.9	Confident	84.8	Confident	40 Å²	40	61.4 Å²	61.4	16%	0.157	37%	0.369	C	S	.	.	H	α-helix	trans	-62.2	-36.5	172.7	-74.5	-67.4	0	0	0	113.1	Q26 Q27 Q28 G34 Q65 A66 N69 A72	Q26-Y30 HydrophobicContact CG-CD2 4.38Å; Q26-Y30 HydrophobicContact CG-CE2 3.78Å; Q26-Y30 WeakPolarHBondContact O-CD2 3.41Å; Q26-Y30 PolarHBondContact O-N 3.03Å; Q27-Y30 PolarHBondContact O-N 3.13Å; Q28-Y30 PolarHBondContact O-N 3.07Å; Y30-G34 PolarHBondContact O-N 3.14Å; Y30-G34 VanDerWaalsContact O-N 3.12Å; Y30-Q65 PolarHBondContact OH-O 3.13Å; Y30-A66 HydrophobicContact CD1-CB 4.43Å; Y30-A66 HydrophobicContact CE1-CB 3.8Å; Y30-N69 WeakPolarHBondContact OH-CB 3.28Å; Y30-N69 PolarHBondContact OH-ND2 3.26Å; Y30-N69 VanDerWaalsContact OH-ND2 3.14Å; Y30-A72 HydrophobicContact CD1-CB 4.42Å; Y30-A72 HydrophobicContact CE1-CB 3.97Å
31	L	90.3	Very high	86.1	Confident	110 Å²	110	63.3 Å²	63.3	58%	0.576	37%	0.37	S	S	*	.	H	α-helix	trans	-67.7	-39.2	174.8	-64.7	171.9	0	0	0	111	Q28 F29 G34 N35	Q28-L31 WeakPolarHBondContact O-CB 3.42Å; Q28-L31 PolarHBondContact O-N 3.06Å; Q28-L31 VanDerWaalsContact O-N 3.16Å; F29-L31 VanDerWaalsContact C-N 3.31Å; F29-L31 PolarHBondContact O-N 2.75Å; L31-G34 PolarHBondContact O-N 3.45Å; L31-N35 VanDerWaalsContact O-CG 3.24Å; L31-N35 PolarHBondContact O-N 3.06Å; L31-N35 PolarHBondContact O-ND2 3.39Å; L31-N35 PolarHBondContact O-OD1 2.64Å
32	L	93.3	Very high	87.2	Confident	20 Å²	20	66.2 Å²	66.2	11%	0.105	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-46.4	175.4	-175.9	64.8	0	0	0	111.5	Q28 F29 G34 N35 L36 A47 T50 I54	Q28-L32 PolarHBondContact O-N 3.03Å; F29-L32 HydrophobicContact CD2-CD2 4.24Å; F29-L32 HydrophobicContact CE2-CD2 4.33Å; F29-L32 WeakPolarHBondContact O-CB 3.26Å; F29-L32 PolarHBondContact O-N 3.12Å; L32-G34 VanDerWaalsContact C-N 3.3Å; L32-G34 PolarHBondContact O-N 3.04Å; L32-N35 WeakPolarHBondContact O-CB 3.32Å; L32-N35 PolarHBondContact O-N 3.4Å; L32-N35 VanDerWaalsContact O-N 3.09Å; L32-L36 WeakPolarHBondContact O-CG 3.5Å; L32-L36 PolarHBondContact O-N 2.68Å; L32-A47 HydrophobicContact CD1-CB 3.86Å; L32-T50 HydrophobicContact CD1-CG2 4.05Å; L32-T50 HydrophobicContact CD2-CG2 4.44Å; L32-I54 HydrophobicContact CD2-CD1 3.72Å
33	L	92.2	Very high	88.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-59.2	-39.5	175	-71.2	172.5	0	0	0	112.4	F29 N35 L36 L63 A66 A76 M79 A80 L83	F29-L33 HydrophobicContact CD1-CD1 3.92Å; F29-L33 HydrophobicContact CD1-CG 4.18Å; F29-L33 HydrophobicContact CE1-CD1 3.75Å; F29-L33 HydrophobicContact CE1-CD2 4.16Å; F29-L33 HydrophobicContact CE1-CG 3.93Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 HydrophobicContact CZ-CG 4.47Å; F29-L33 PolarHBondContact O-N 3.21Å; L33-N35 VanDerWaalsContact C-N 3.35Å; L33-L36 HydrophobicContact CD2-CD1 4.35Å; L33-L36 PolarHBondContact O-N 3.07Å; L33-L63 HydrophobicContact CD2-CD2 4.4Å; L33-A66 HydrophobicContact CD1-CB 3.7Å; L33-A76 HydrophobicContact CB-CB 4.43Å; L33-M79 HydrophobicContact CD2-CG 4.14Å; L33-A80 HydrophobicContact CD1-CB 4.01Å; L33-A80 HydrophobicContact CD2-CB 4.42Å; L33-L83 HydrophobicContact CD2-CD1 3.87Å
34	G	90.3	Very high	88.9	Confident	38 Å²	38	68.1 Å²	68.1	39%	0.392	37%	0.371	S	S	.	.	H	α-helix	trans	-64.2	-38.4	173.9	0	0	0	0	0	112.9	Y30 L31 L32 L37	Y30-G34 PolarHBondContact O-N 3.14Å; Y30-G34 VanDerWaalsContact O-N 3.12Å; L31-G34 PolarHBondContact O-N 3.45Å; L32-G34 VanDerWaalsContact C-N 3.3Å; L32-G34 PolarHBondContact O-N 3.04Å; G34-L37 PolarHBondContact O-N 3.16Å
35	N	91.4	Very high	89	Confident	75 Å²	75	72 Å²	72	40%	0.401	38%	0.378	S	S	.	.	H	α-helix	trans	-69.8	-32.1	178.6	-67	-17	0	0	0	112.8	L31 L32 L33 L37 S38 V43 A47	L31-N35 VanDerWaalsContact O-CG 3.24Å; L31-N35 PolarHBondContact O-N 3.06Å; L31-N35 PolarHBondContact O-ND2 3.39Å; L31-N35 PolarHBondContact O-OD1 2.64Å; L32-N35 WeakPolarHBondContact O-CB 3.32Å; L32-N35 PolarHBondContact O-N 3.4Å; L32-N35 VanDerWaalsContact O-N 3.09Å; L33-N35 VanDerWaalsContact C-N 3.35Å; N35-L37 PolarHBondContact O-N 3.29Å; N35-S38 WeakPolarHBondContact O-CB 3.45Å; N35-S38 PolarHBondContact O-N 2.96Å; N35-S38 VanDerWaalsContact O-N 3.09Å; N35-V43 HydrophobicContact CB-CG1 3.93Å; N35-A47 HydrophobicContact CB-CB 3.67Å
36	L	89.8	Confident	89.3	Confident	14 Å²	14	72.4 Å²	72.4	7%	0.073	38%	0.38	C	S	.	.	H	α-helix	trans	-62.7	-25.6	173	-69.7	172.9	0	0	0	112.6	L32 L33 R44 A47 E48 L83	L32-L36 WeakPolarHBondContact O-CG 3.5Å; L32-L36 PolarHBondContact O-N 2.68Å; L33-L36 HydrophobicContact CD2-CD1 4.35Å; L33-L36 PolarHBondContact O-N 3.07Å; L36-R44 WeakPolarHBondContact O-CD 3.3Å; L36-R44 WeakPolarHBondContact O-CG 3.5Å; L36-A47 HydrophobicContact CD2-CB 3.76Å; L36-A47 HydrophobicContact CG-CB 4.08Å; L36-E48 HydrophobicContact CD2-CB 4.23Å; L36-E48 HydrophobicContact CD2-CG 3.58Å; L36-L83 HydrophobicContact CD1-CD1 3.9Å
37	L	88.8	Confident	89.5	Confident	79 Å²	79	71.1 Å²	71.1	41%	0.414	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	7.2	177	-67.1	168.8	0	0	0	113	G34 N35 E75 M79	G34-L37 PolarHBondContact O-N 3.16Å; N35-L37 PolarHBondContact O-N 3.29Å; L37-E75 HydrophobicContact CD1-CB 3.95Å; L37-M79 HydrophobicContact CD1-CB 4.22Å; L37-M79 HydrophobicContact CD2-CB 4.44Å; L37-M79 HydrophobicContact CD2-CE 3.38Å; L37-M79 HydrophobicContact CG-CB 4.45Å; L37-M79 HydrophobicContact CG-CE 4.08Å
38	S	90.3	Very high	89.7	Confident	28 Å²	28	69.6 Å²	69.6	20%	0.196	37%	0.368	C	S	.	.			trans	-67.3	136.3	-179.7	-178	0	0	0	0	111.2	N35 D40	N35-S38 WeakPolarHBondContact O-CB 3.45Å; N35-S38 PolarHBondContact O-N 2.96Å; N35-S38 VanDerWaalsContact O-N 3.09Å; S38-D40 PolarHBondContact O-N 3.29Å; S38-D40 PolarHBondContact OG-N 3.03Å
39	P	87.8	Confident	89.8	Confident	134 Å²	134	67.5 Å²	67.5	87%	0.87	36%	0.358	S	S	*	.	S	Bend	trans	-70.4	-15	171.3	30.3	-35.4	0	0	0	112.8
40	D	90.1	Very high	89.8	Confident	79 Å²	79	70.2 Å²	70.2	42%	0.422	38%	0.375	S	S	.	.	S	Bend	trans	-83.5	113.4	174.3	-177.5	-4.1	0	0	0	110.7	S38 V42 V43 R44	S38-D40 PolarHBondContact O-N 3.29Å; S38-D40 PolarHBondContact OG-N 3.03Å; D40-V42 PolarHBondContact O-N 2.97Å; D40-V42 WeakPolarHBondContact OD1-CB 3.45Å; D40-V42 PolarHBondContact OD1-N 3.2Å; D40-V43 HydrophobicContact CB-CB 4.41Å; D40-V43 HydrophobicContact CB-CG2 4.24Å; D40-V43 PolarHBondContact O-N 3.46Å; D40-V43 VanDerWaalsContact O-N 3.13Å; D40-R44 PolarHBondContact O-N 3.19Å
41	N	86.3	Confident	90	Very high	103 Å²	103	69.1 Å²	69.1	55%	0.551	37%	0.371	S	S	*	.	H	α-helix	trans	-54.3	-32	177.8	-80.4	-21.4	0	0	0	113.7	R44 K45	N41-R44 PolarHBondContact OD1-NH2 3.16Å; N41-K45 WeakPolarHBondContact O-CB 3.4Å; N41-K45 PolarHBondContact O-N 3.37Å
42	V	90.7	Very high	90	Very high	109 Å²	109	70.1 Å²	70.1	66%	0.661	37%	0.373	S	S	*	.	H	α-helix	trans	-67.1	-46.1	179.5	179.6	0	0	0	0	110.3	D40 Q46	D40-V42 PolarHBondContact O-N 2.97Å; D40-V42 WeakPolarHBondContact OD1-CB 3.45Å; D40-V42 PolarHBondContact OD1-N 3.2Å; V42-Q46 WeakPolarHBondContact O-CB 3.33Å; V42-Q46 PolarHBondContact O-N 3.22Å
43	V	89.4	Confident	89.9	Confident	52 Å²	52	75.8 Å²	75.8	32%	0.315	40%	0.403	S	S	.	.	H	α-helix	trans	-69.1	-43.1	179.1	177.9	0	0	0	0	110.7	N35 D40 A47	N35-V43 HydrophobicContact CB-CG1 3.93Å; D40-V43 HydrophobicContact CB-CB 4.41Å; D40-V43 HydrophobicContact CB-CG2 4.24Å; D40-V43 PolarHBondContact O-N 3.46Å; D40-V43 VanDerWaalsContact O-N 3.13Å; V43-A47 WeakPolarHBondContact O-CB 3.37Å; V43-A47 PolarHBondContact O-N 3.18Å
44	R	89.4	Confident	89.9	Confident	104 Å²	104	77.4 Å²	77.4	39%	0.392	41%	0.411	S	S	.	.	H	α-helix	trans	-62.5	-51.7	179.9	-178.2	170.5	65.2	150.4	1.6	111.8	L36 D40 N41 Q46 A47 E48	L36-R44 WeakPolarHBondContact O-CD 3.3Å; L36-R44 WeakPolarHBondContact O-CG 3.5Å; D40-R44 PolarHBondContact O-N 3.19Å; N41-R44 PolarHBondContact OD1-NH2 3.16Å; R44-Q46 VanDerWaalsContact C-N 3.35Å; R44-Q46 PolarHBondContact O-N 2.93Å; R44-A47 WeakPolarHBondContact O-CB 3.22Å; R44-A47 PolarHBondContact O-N 3.4Å; R44-A47 VanDerWaalsContact O-N 3.08Å; R44-E48 WeakPolarHBondContact CG-OE1 3.43Å; R44-E48 WeakPolarHBondContact O-CG 3.21Å; R44-E48 PolarHBondContact O-N 3.16Å
45	K	83.9	Confident	90	Very high	130 Å²	130	79.3 Å²	79.3	57%	0.565	42%	0.417	S	S	*	.	H	α-helix	trans	-62.6	-40.4	-179.8	-169.5	171.9	-175.1	170.9	0	112.5	N41 A47 E48 E49	N41-K45 WeakPolarHBondContact O-CB 3.4Å; N41-K45 PolarHBondContact O-N 3.37Å; K45-A47 VanDerWaalsContact C-N 3.3Å; K45-A47 PolarHBondContact O-N 3.01Å; K45-E48 PolarHBondContact O-N 3.32Å; K45-E49 WeakPolarHBondContact O-CG 3.31Å; K45-E49 PolarHBondContact O-N 2.86Å
46	Q	90.7	Very high	89.8	Confident	112 Å²	112	76.4 Å²	76.4	52%	0.523	40%	0.404	S	S	.	.	H	α-helix	trans	-64.4	-36.3	175.4	-172.2	62.8	73.9	0	0	112.2	V42 R44 T50	V42-Q46 WeakPolarHBondContact O-CB 3.33Å; V42-Q46 PolarHBondContact O-N 3.22Å; R44-Q46 VanDerWaalsContact C-N 3.35Å; R44-Q46 PolarHBondContact O-N 2.93Å; Q46-T50 WeakPolarHBondContact O-CB 3.38Å; Q46-T50 PolarHBondContact O-N 3.09Å; Q46-T50 VanDerWaalsContact O-N 3.07Å; Q46-T50 PolarHBondContact O-OG1 2.99Å
47	A	90.3	Very high	89.8	Confident	3 Å²	3	80.2 Å²	80.2	3%	0.025	42%	0.422	C	S	.	.	H	α-helix	trans	-70.6	-38.8	176	0	0	0	0	0	112	L32 N35 L36 V43 R44 K45 T50 Y51	L32-A47 HydrophobicContact CD1-CB 3.86Å; N35-A47 HydrophobicContact CB-CB 3.67Å; L36-A47 HydrophobicContact CD2-CB 3.76Å; L36-A47 HydrophobicContact CG-CB 4.08Å; V43-A47 WeakPolarHBondContact O-CB 3.37Å; V43-A47 PolarHBondContact O-N 3.18Å; R44-A47 WeakPolarHBondContact O-CB 3.22Å; R44-A47 PolarHBondContact O-N 3.4Å; R44-A47 VanDerWaalsContact O-N 3.08Å; K45-A47 VanDerWaalsContact C-N 3.3Å; K45-A47 PolarHBondContact O-N 3.01Å; A47-T50 PolarHBondContact O-N 2.92Å; A47-Y51 WeakPolarHBondContact O-CB 3.45Å; A47-Y51 PolarHBondContact O-N 3.34Å
48	E	88.7	Confident	89.8	Confident	87 Å²	87	78.6 Å²	78.6	41%	0.407	42%	0.417	S	S	.	.	H	α-helix	trans	-60	-50.8	173.8	-71.8	165.1	179.7	0	0	110.9	L36 R44 K45 T50 Y51 E52	L36-E48 HydrophobicContact CD2-CB 4.23Å; L36-E48 HydrophobicContact CD2-CG 3.58Å; R44-E48 WeakPolarHBondContact CG-OE1 3.43Å; R44-E48 WeakPolarHBondContact O-CG 3.21Å; R44-E48 PolarHBondContact O-N 3.16Å; K45-E48 PolarHBondContact O-N 3.32Å; E48-T50 VanDerWaalsContact C-N 3.27Å; E48-T50 PolarHBondContact O-N 3.37Å; E48-Y51 PolarHBondContact O-N 3.46Å; E48-Y51 VanDerWaalsContact O-N 3.14Å; E48-E52 WeakPolarHBondContact O-CG 3.34Å; E48-E52 PolarHBondContact O-N 2.99Å
49	E	90.4	Very high	90	Very high	93 Å²	93	78 Å²	78	44%	0.435	41%	0.411	S	S	.	.	H	α-helix	trans	-58.5	-40	175.4	-72.9	174.6	-172.5	0	0	111.9	K45 N53	K45-E49 WeakPolarHBondContact O-CG 3.31Å; K45-E49 PolarHBondContact O-N 2.86Å; E49-N53 PolarHBondContact O-N 2.94Å; E49-N53 PolarHBondContact O-ND2 3.4Å
50	T	92.4	Very high	90.2	Very high	65 Å²	65	71.7 Å²	71.7	40%	0.399	37%	0.37	S	S	.	.	H	α-helix	trans	-66.4	-42.9	177.8	-56.3	0	0	0	0	110.9	L32 Q46 A47 E48 I54	L32-T50 HydrophobicContact CD1-CG2 4.05Å; L32-T50 HydrophobicContact CD2-CG2 4.44Å; Q46-T50 WeakPolarHBondContact O-CB 3.38Å; Q46-T50 PolarHBondContact O-N 3.09Å; Q46-T50 VanDerWaalsContact O-N 3.07Å; Q46-T50 PolarHBondContact O-OG1 2.99Å; A47-T50 PolarHBondContact O-N 2.92Å; E48-T50 VanDerWaalsContact C-N 3.27Å; E48-T50 PolarHBondContact O-N 3.37Å; T50-I54 WeakPolarHBondContact O-CG1 3.1Å
51	Y	93.4	Very high	90.1	Very high	17 Å²	17	70.3 Å²	70.3	7%	0.067	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-46.6	177.1	173	-98.9	0	0	0	111.4	F29 A47 E48 N53 I54 K59 L63 L83	F29-Y51 HydrophobicContact CE2-CD2 4.27Å; F29-Y51 HydrophobicContact CE2-CE2 4.4Å; F29-Y51 HydrophobicContact CZ-CD2 4.49Å; F29-Y51 HydrophobicContact CZ-CE2 4.26Å; A47-Y51 WeakPolarHBondContact O-CB 3.45Å; A47-Y51 PolarHBondContact O-N 3.34Å; E48-Y51 PolarHBondContact O-N 3.46Å; E48-Y51 VanDerWaalsContact O-N 3.14Å; Y51-N53 VanDerWaalsContact C-N 3.27Å; Y51-N53 PolarHBondContact O-N 3.12Å; Y51-I54 WeakPolarHBondContact O-CB 3.39Å; Y51-I54 PolarHBondContact O-N 3.08Å; Y51-K59 HydrophobicContact CE1-CD 4.48Å; Y51-K59 HydrophobicContact CE2-CD 4.24Å; Y51-K59 HydrophobicContact CE2-CG 4.28Å; Y51-K59 WeakPolarHBondContact O-CE 3.3Å; Y51-K59 PolarHBondContact O-NZ 2.94Å; Y51-L63 HydrophobicContact CE2-CD1 4.5Å; Y51-L63 HydrophobicContact CE2-CD2 4.4Å; Y51-L83 HydrophobicContact CE1-CD2 4.05Å; Y51-L83 HydrophobicContact CE2-CD1 4.13Å
52	E	89.7	Confident	90.4	Very high	131 Å²	131	66.9 Å²	66.9	61%	0.612	34%	0.344	S	S	*	.	H	α-helix	trans	-54.2	-43	179.7	-79.9	-62.7	161.1	0	0	112.2	E48 I54 K59	E48-E52 WeakPolarHBondContact O-CG 3.34Å; E48-E52 PolarHBondContact O-N 2.99Å; E52-I54 VanDerWaalsContact C-N 3.25Å; E52-I54 PolarHBondContact O-N 3.47Å; E52-K59 PolarHBondContact O-NZ 3.37Å
53	N	91.5	Very high	90.7	Very high	139 Å²	139	61.7 Å²	61.7	74%	0.743	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-7.6	-179.6	-73.3	-62.8	0	0	0	115.1	E49 Y51	E49-N53 PolarHBondContact O-N 2.94Å; E49-N53 PolarHBondContact O-ND2 3.4Å; Y51-N53 VanDerWaalsContact C-N 3.27Å; Y51-N53 PolarHBondContact O-N 3.12Å
54	I	92.9	Very high	90.8	Very high	34 Å²	34	59.4 Å²	59.4	17%	0.174	30%	0.299	C	S	.	.	S	Bend	trans	-73.7	131.9	175.2	-59.4	173.5	0	0	0	109	F29 L32 T50 Y51 E52 G56 K59	F29-I54 HydrophobicContact CD2-CD1 4.23Å; F29-I54 HydrophobicContact CE2-CD1 4.07Å; L32-I54 HydrophobicContact CD2-CD1 3.72Å; T50-I54 WeakPolarHBondContact O-CG1 3.1Å; Y51-I54 WeakPolarHBondContact O-CB 3.39Å; Y51-I54 PolarHBondContact O-N 3.08Å; E52-I54 VanDerWaalsContact C-N 3.25Å; E52-I54 PolarHBondContact O-N 3.47Å; I54-G56 PolarHBondContact O-N 3.16Å; I54-K59 HydrophobicContact CB-CG 3.94Å; I54-K59 HydrophobicContact CG2-CG 3.77Å; I54-K59 WeakPolarHBondContact O-CE 3.49Å; I54-K59 PolarHBondContact O-NZ 3.34Å
55	P	92.1	Very high	90.9	Very high	78 Å²	78	57.7 Å²	57.7	51%	0.506	30%	0.295	S	S	.	.			trans	-56.3	136	176.5	-25.1	34.1	0	0	0	112.2	Q57 S58 K59	P55-Q57 PolarHBondContact O-N 3.09Å; P55-S58 PolarHBondContact O-N 2.87Å; P55-K59 PolarHBondContact O-N 3.46Å
56	G	88.4	Confident	91.4	Very high	13 Å²	13	51.5 Å²	51.5	13%	0.134	27%	0.268	C	S	.	.	H	α-helix	trans	-56.9	-35.5	-177.7	0	0	0	0	0	113.9	I54 S58 K59 I60 V95	I54-G56 PolarHBondContact O-N 3.16Å; G56-S58 VanDerWaalsContact C-N 3.25Å; G56-S58 PolarHBondContact O-N 3.27Å; G56-K59 PolarHBondContact O-N 3.43Å; G56-I60 PolarHBondContact O-N 3.35Å; G56-V95 WeakPolarHBondContact O-CG1 3.49Å
57	Q	88.9	Confident	91.6	Very high	95 Å²	95	46.2 Å²	46.2	44%	0.444	24%	0.244	S	C	.	.	H	α-helix	trans	-58.9	-32.9	174	-64.8	164.3	-8.7	0	0	113.4	P55 I60 T98 L99	P55-Q57 PolarHBondContact O-N 3.09Å; Q57-I60 VanDerWaalsContact O-CG2 3.3Å; Q57-I60 WeakPolarHBondContact O-CG2 3.49Å; Q57-T98 PolarHBondContact NE2-OG1 3.44Å; Q57-L99 HydrophobicContact CB-CD2 3.98Å; Q57-L99 HydrophobicContact CG-CD2 4.22Å
58	S	89.6	Confident	91.7	Very high	44 Å²	44	51.1 Å²	51.1	31%	0.308	26%	0.262	S	S	.	.	H	α-helix	trans	-85.1	-41	176.3	-58.7	0	0	0	0	111.1	P55 G56 I60 T61 F62	P55-S58 PolarHBondContact O-N 2.87Å; G56-S58 VanDerWaalsContact C-N 3.25Å; G56-S58 PolarHBondContact O-N 3.27Å; S58-I60 VanDerWaalsContact C-N 3.31Å; S58-I60 PolarHBondContact O-N 3.11Å; S58-T61 PolarHBondContact O-N 3.27Å; S58-T61 PolarHBondContact O-OG1 3.25Å; S58-F62 WeakPolarHBondContact O-CD2 3.27Å; S58-F62 WeakPolarHBondContact O-CG 3.44Å; S58-F62 PolarHBondContact O-N 3.01Å; S58-F62 VanDerWaalsContact O-N 3.08Å
59	K	92.4	Very high	91.8	Very high	16 Å²	16	49.5 Å²	49.5	7%	0.07	26%	0.256	C	S	.	.	H	α-helix	trans	-50.3	-49	178.3	-74.1	178.1	172.7	155.8	0	111.8	Y51 E52 I54 P55 G56 T61 F62 L63 L87	Y51-K59 HydrophobicContact CE1-CD 4.48Å; Y51-K59 HydrophobicContact CE2-CD 4.24Å; Y51-K59 HydrophobicContact CE2-CG 4.28Å; Y51-K59 WeakPolarHBondContact O-CE 3.3Å; Y51-K59 PolarHBondContact O-NZ 2.94Å; E52-K59 PolarHBondContact O-NZ 3.37Å; I54-K59 HydrophobicContact CB-CG 3.94Å; I54-K59 HydrophobicContact CG2-CG 3.77Å; I54-K59 WeakPolarHBondContact O-CE 3.49Å; I54-K59 PolarHBondContact O-NZ 3.34Å; P55-K59 PolarHBondContact O-N 3.46Å; G56-K59 PolarHBondContact O-N 3.43Å; K59-T61 VanDerWaalsContact C-N 3.31Å; K59-T61 PolarHBondContact O-N 3.25Å; K59-F62 PolarHBondContact O-N 3.1Å; K59-L63 HydrophobicContact CB-CD1 4.27Å; K59-L63 WeakPolarHBondContact O-CB 3.36Å; K59-L63 WeakPolarHBondContact O-CD1 3.4Å; K59-L63 WeakPolarHBondContact O-CG 3.49Å; K59-L63 PolarHBondContact O-N 3.4Å; K59-L87 HydrophobicContact CB-CD2 3.72Å; K59-L87 HydrophobicContact CD-CD1 4.21Å
60	I	92.3	Very high	91.8	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-57.3	-42.4	-177	-165.6	169.3	0	0	0	112.5	G56 Q57 S58 L64 L84 L87 L88 V95 Y96 L99 I107	G56-I60 PolarHBondContact O-N 3.35Å; Q57-I60 VanDerWaalsContact O-CG2 3.3Å; Q57-I60 WeakPolarHBondContact O-CG2 3.49Å; S58-I60 VanDerWaalsContact C-N 3.31Å; S58-I60 PolarHBondContact O-N 3.11Å; I60-L64 VanDerWaalsContact O-CB 3.3Å; I60-L64 WeakPolarHBondContact O-CB 3.39Å; I60-L64 PolarHBondContact O-N 2.96Å; I60-L64 VanDerWaalsContact O-N 3.15Å; I60-L84 HydrophobicContact CB-CD1 4.5Å; I60-L84 HydrophobicContact CG1-CD1 3.87Å; I60-L87 HydrophobicContact CB-CD2 4.16Å; I60-L88 HydrophobicContact CD1-CD2 3.99Å; I60-V95 HydrophobicContact CB-CG1 4.25Å; I60-V95 HydrophobicContact CD1-CG1 4.24Å; I60-V95 HydrophobicContact CG2-CG1 4.31Å; I60-Y96 HydrophobicContact CD1-CD2 4.13Å; I60-L99 HydrophobicContact CD1-CD1 4.17Å; I60-L99 HydrophobicContact CG2-CD1 3.95Å; I60-L99 HydrophobicContact CG2-CD2 4.47Å; I60-I107 HydrophobicContact CD1-CD1 3.83Å; I60-I107 HydrophobicContact CG1-CD1 4.09Å; I60-I107 HydrophobicContact CG2-CD1 4.29Å
61	T	89.3	Confident	91.6	Very high	49 Å²	49	52.4 Å²	52.4	30%	0.301	28%	0.28	S	S	.	.	H	α-helix	trans	-72	-44.3	178.7	61.3	0	0	0	0	112.2	S58 K59 L64 Q65 V103	S58-T61 PolarHBondContact O-N 3.27Å; S58-T61 PolarHBondContact O-OG1 3.25Å; K59-T61 VanDerWaalsContact C-N 3.31Å; K59-T61 PolarHBondContact O-N 3.25Å; T61-L64 PolarHBondContact O-N 2.86Å; T61-Q65 WeakPolarHBondContact O-CG 3.01Å; T61-Q65 PolarHBondContact O-N 3.05Å; T61-V103 HydrophobicContact CG2-CG1 4.37Å
62	F	92.9	Very high	91.4	Very high	32 Å²	32	53 Å²	53	14%	0.14	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-42.5	-179.3	-68	-34.9	0	0	0	112.5	E25 Q26 F29 S58 K59 A66	E25-F62 HydrophobicContact CB-CE1 4.2Å; E25-F62 HydrophobicContact CB-CZ 4.07Å; Q26-F62 PolarHBondContact NE2-O 2.82Å; Q26-F62 VanDerWaalsContact NE2-O 3.11Å; F29-F62 HydrophobicContact CD1-CB 3.68Å; F29-F62 HydrophobicContact CD2-CB 3.94Å; F29-F62 HydrophobicContact CD2-CD2 4.06Å; F29-F62 HydrophobicContact CD2-CG 4.25Å; F29-F62 HydrophobicContact CE1-CB 3.72Å; F29-F62 HydrophobicContact CE2-CB 4Å; F29-F62 HydrophobicContact CE2-CD2 4.36Å; F29-F62 HydrophobicContact CG-CB 3.78Å; F29-F62 HydrophobicContact CG-CD2 4.47Å; F29-F62 HydrophobicContact CG-CG 4.23Å; F29-F62 HydrophobicContact CZ-CB 3.88Å; S58-F62 WeakPolarHBondContact O-CD2 3.27Å; S58-F62 WeakPolarHBondContact O-CG 3.44Å; S58-F62 PolarHBondContact O-N 3.01Å; S58-F62 VanDerWaalsContact O-N 3.08Å; K59-F62 PolarHBondContact O-N 3.1Å; F62-A66 WeakPolarHBondContact O-CB 3.43Å; F62-A66 PolarHBondContact O-N 3.39Å
63	L	95	Very high	91.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-45.8	176.6	-68.3	164.9	0	0	0	111.1	F29 L33 Y51 K59 Q65 A66 I67 A80 L83 L84 L87	F29-L63 HydrophobicContact CE1-CD2 3.85Å; F29-L63 HydrophobicContact CE1-CG 4.16Å; F29-L63 HydrophobicContact CZ-CD2 3.64Å; F29-L63 HydrophobicContact CZ-CG 3.87Å; L33-L63 HydrophobicContact CD2-CD2 4.4Å; Y51-L63 HydrophobicContact CE2-CD1 4.5Å; Y51-L63 HydrophobicContact CE2-CD2 4.4Å; K59-L63 HydrophobicContact CB-CD1 4.27Å; K59-L63 WeakPolarHBondContact O-CB 3.36Å; K59-L63 WeakPolarHBondContact O-CD1 3.4Å; K59-L63 WeakPolarHBondContact O-CG 3.49Å; K59-L63 PolarHBondContact O-N 3.4Å; L63-Q65 VanDerWaalsContact C-N 3.35Å; L63-Q65 PolarHBondContact O-N 3.01Å; L63-A66 WeakPolarHBondContact O-CB 3.39Å; L63-A66 PolarHBondContact O-N 3.26Å; L63-A66 VanDerWaalsContact O-N 3.12Å; L63-I67 VanDerWaalsContact O-CG1 3.3Å; L63-I67 WeakPolarHBondContact O-CG1 3.4Å; L63-I67 PolarHBondContact O-N 3.1Å; L63-A80 HydrophobicContact CD2-CB 4.13Å; L63-L83 HydrophobicContact CD1-CB 4.29Å; L63-L83 HydrophobicContact CD2-CB 3.78Å; L63-L83 HydrophobicContact CD2-CD1 4.19Å; L63-L84 HydrophobicContact CB-CB 4.02Å; L63-L84 HydrophobicContact CB-CD1 4.23Å; L63-L84 HydrophobicContact CB-CD2 4.48Å; L63-L84 HydrophobicContact CB-CG 4.48Å; L63-L84 HydrophobicContact CD1-CB 4.15Å; L63-L84 HydrophobicContact CD1-CD1 4.26Å; L63-L87 HydrophobicContact CD1-CD2 4.27Å
64	L	93.1	Very high	91.3	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-42	179.2	-172.4	63.9	0	0	0	112.2	I60 T61 A66 I67 R68 L84 I107 E110 L111 I114	I60-L64 VanDerWaalsContact O-CB 3.3Å; I60-L64 WeakPolarHBondContact O-CB 3.39Å; I60-L64 PolarHBondContact O-N 2.96Å; I60-L64 VanDerWaalsContact O-N 3.15Å; T61-L64 PolarHBondContact O-N 2.86Å; L64-A66 VanDerWaalsContact C-N 3.34Å; L64-I67 PolarHBondContact O-N 3.42Å; L64-R68 WeakPolarHBondContact O-CB 3.21Å; L64-R68 PolarHBondContact O-N 3.08Å; L64-L84 HydrophobicContact CB-CD2 4.35Å; L64-L84 HydrophobicContact CD1-CD2 4.19Å; L64-I107 HydrophobicContact CD2-CB 4.31Å; L64-I107 HydrophobicContact CD2-CG1 4.08Å; L64-I107 HydrophobicContact CD2-CG2 4.23Å; L64-E110 HydrophobicContact CD2-CB 4.06Å; L64-L111 HydrophobicContact CD1-CD2 3.53Å; L64-L111 HydrophobicContact CD1-CG 3.88Å; L64-I114 HydrophobicContact CD1-CD1 3.54Å; L64-I114 HydrophobicContact CG-CD1 4.32Å
65	Q	91.6	Very high	91.2	Very high	68 Å²	68	49.8 Å²	49.8	32%	0.318	28%	0.278	S	S	.	.	H	α-helix	trans	-67.2	-34.5	175	-66.7	-53.2	-32.3	0	0	112.5	Y30 T61 L63 R68 N69 E110	Y30-Q65 PolarHBondContact OH-O 3.13Å; T61-Q65 WeakPolarHBondContact O-CG 3.01Å; T61-Q65 PolarHBondContact O-N 3.05Å; L63-Q65 VanDerWaalsContact C-N 3.35Å; L63-Q65 PolarHBondContact O-N 3.01Å; Q65-R68 PolarHBondContact O-N 3.42Å; Q65-N69 PolarHBondContact O-N 3.26Å; Q65-N69 VanDerWaalsContact O-N 3.15Å; Q65-E110 PolarHBondContact NE2-OE2 2.95Å
66	A	93.4	Very high	91.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-44.9	174.7	0	0	0	0	0	111.8	Y30 L33 F62 L63 L64 N69 A80	Y30-A66 HydrophobicContact CD1-CB 4.43Å; Y30-A66 HydrophobicContact CE1-CB 3.8Å; L33-A66 HydrophobicContact CD1-CB 3.7Å; F62-A66 WeakPolarHBondContact O-CB 3.43Å; F62-A66 PolarHBondContact O-N 3.39Å; L63-A66 WeakPolarHBondContact O-CB 3.39Å; L63-A66 PolarHBondContact O-N 3.26Å; L63-A66 VanDerWaalsContact O-N 3.12Å; L64-A66 VanDerWaalsContact C-N 3.34Å; A66-N69 PolarHBondContact O-N 2.92Å; A66-A80 HydrophobicContact CB-CB 3.74Å
67	I	94.4	Very high	91.3	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-43.7	177.1	-62.3	162.8	0	0	0	111.2	L63 L64 N69 R77 A80 A81 L84 I114 M123 V127 I130	L63-I67 VanDerWaalsContact O-CG1 3.3Å; L63-I67 WeakPolarHBondContact O-CG1 3.4Å; L63-I67 PolarHBondContact O-N 3.1Å; L64-I67 PolarHBondContact O-N 3.42Å; I67-N69 VanDerWaalsContact C-N 3.29Å; I67-N69 PolarHBondContact O-N 3.17Å; I67-R77 PolarHBondContact O-NE 2.74Å; I67-R77 PolarHBondContact O-NH2 3.25Å; I67-A80 HydrophobicContact CG1-CB 3.86Å; I67-A81 HydrophobicContact CD1-CB 4.05Å; I67-A81 HydrophobicContact CG1-CB 4.13Å; I67-L84 HydrophobicContact CD1-CB 4.25Å; I67-L84 HydrophobicContact CD1-CD2 3.6Å; I67-I114 HydrophobicContact CG2-CD1 4.29Å; I67-I114 HydrophobicContact CG2-CG2 3.98Å; I67-M123 HydrophobicContact CG2-SD 4.36Å; I67-V127 HydrophobicContact CG2-CG2 3.64Å; I67-I130 HydrophobicContact CD1-CD1 3.84Å
68	R	93.1	Very high	91.3	Very high	106 Å²	106	44.9 Å²	44.9	40%	0.4	25%	0.246	S	C	.	.	H	α-helix	trans	-66.7	-27	-176.8	-176	171.2	155.5	179.2	-6.2	113.6	L64 Q65 T70 E110 I114	L64-R68 WeakPolarHBondContact O-CB 3.21Å; L64-R68 PolarHBondContact O-N 3.08Å; Q65-R68 PolarHBondContact O-N 3.42Å; R68-T70 PolarHBondContact O-N 2.99Å; R68-E110 IonicContact CZ-OE1 2.77Å; R68-E110 IonicContact NH1-OE1 3.78Å; R68-E110 PolarHBondContact NH1-OE1 2.64Å; R68-E110 IonicContact NH1-OE2 3.24Å; R68-E110 PolarHBondContact NH1-OE2 2.98Å; R68-I114 HydrophobicContact CB-CD1 4.04Å; R68-I114 HydrophobicContact CB-CG1 4.2Å; R68-I114 HydrophobicContact CG-CG1 4.33Å
69	N	91.6	Very high	91.4	Very high	53 Å²	53	45.1 Å²	45.1	28%	0.283	24%	0.243	S	C	.	.			trans	-78.7	86.7	178.5	-173.7	-0.9	0	0	0	111.5	Y30 Q65 A66 I67 T71 A72 R77	Y30-N69 WeakPolarHBondContact OH-CB 3.28Å; Y30-N69 PolarHBondContact OH-ND2 3.26Å; Y30-N69 VanDerWaalsContact OH-ND2 3.14Å; Q65-N69 PolarHBondContact O-N 3.26Å; Q65-N69 VanDerWaalsContact O-N 3.15Å; A66-N69 PolarHBondContact O-N 2.92Å; I67-N69 VanDerWaalsContact C-N 3.29Å; I67-N69 PolarHBondContact O-N 3.17Å; N69-T71 PolarHBondContact O-N 2.99Å; N69-T71 VanDerWaalsContact O-N 3.07Å; N69-T71 PolarHBondContact OD1-N 3.28Å; N69-T71 PolarHBondContact OD1-OG1 3.07Å; N69-A72 HydrophobicContact CB-CB 4.36Å; N69-A72 WeakPolarHBondContact O-CB 3.46Å; N69-A72 PolarHBondContact O-N 3.12Å; N69-A72 VanDerWaalsContact O-N 3.1Å; N69-R77 WeakPolarHBondContact O-CD 3.36Å
70	T	89.5	Confident	91.4	Very high	94 Å²	94	44.3 Å²	44.3	58%	0.577	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-7.1	179.2	59.5	0	0	0	0	114.5	R68	R68-T70 PolarHBondContact O-N 2.99Å
71	T	88.5	Confident	91.4	Very high	125 Å²	125	44.3 Å²	44.3	77%	0.767	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-9.4	174.8	67.3	0	0	0	0	113.6	N69	N69-T71 PolarHBondContact O-N 2.99Å; N69-T71 VanDerWaalsContact O-N 3.07Å; N69-T71 PolarHBondContact OD1-N 3.28Å; N69-T71 PolarHBondContact OD1-OG1 3.07Å
72	A	88.9	Confident	91.4	Very high	28 Å²	28	43.3 Å²	43.3	23%	0.231	23%	0.234	C	C	.	.	S	Bend	trans	-74.6	168.8	173.6	0	0	0	0	0	111.6	Y30 N69 E74 R77	Y30-A72 HydrophobicContact CD1-CB 4.42Å; Y30-A72 HydrophobicContact CE1-CB 3.97Å; N69-A72 HydrophobicContact CB-CB 4.36Å; N69-A72 WeakPolarHBondContact O-CB 3.46Å; N69-A72 PolarHBondContact O-N 3.12Å; N69-A72 VanDerWaalsContact O-N 3.1Å; A72-E74 PolarHBondContact O-N 3.09Å; A72-R77 HydrophobicContact CB-CG 4.45Å
73	A	89.8	Confident	91.3	Very high	59 Å²	59	42.8 Å²	42.8	49%	0.488	23%	0.232	S	C	.	.			trans	-60	134.9	175.4	0	0	0	0	0	110.9	E75 A76 R77	A73-E75 VanDerWaalsContact C-N 3.31Å; A73-E75 PolarHBondContact O-N 2.73Å; A73-A76 HydrophobicContact CB-CB 4.29Å; A73-A76 PolarHBondContact O-N 2.94Å; A73-R77 WeakPolarHBondContact O-CG 3.14Å; A73-R77 PolarHBondContact O-N 3.26Å; A73-R77 VanDerWaalsContact O-N 3.13Å
74	E	89.7	Confident	91.2	Very high	53 Å²	53	43 Å²	43	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-37.8	-174.7	179.5	61.4	-169.2	0	0	111.6	A72 A76 R77 Q78 M123	A72-E74 PolarHBondContact O-N 3.09Å; E74-A76 VanDerWaalsContact C-N 3.31Å; E74-A76 PolarHBondContact O-N 3.45Å; E74-R77 WeakPolarHBondContact O-CB 3.33Å; E74-R77 PolarHBondContact O-N 3.29Å; E74-R77 VanDerWaalsContact O-N 3.12Å; E74-R77 IonicContact OE2-CZ 3.48Å; E74-R77 IonicContact OE2-NH1 3.24Å; E74-R77 PolarHBondContact OE2-NH1 2.88Å; E74-Q78 WeakPolarHBondContact O-CG 3.42Å; E74-Q78 PolarHBondContact O-N 3.11Å; E74-M123 VanDerWaalsContact OE1-CE 3.23Å; E74-M123 WeakPolarHBondContact OE1-CE 3.47Å
75	E	89.8	Confident	91	Very high	125 Å²	125	44.2 Å²	44.2	58%	0.584	24%	0.238	S	C	*	.	H	α-helix	trans	-61.8	-40.3	177.7	-56.6	79.3	-176.3	0	0	111.2	L37 A73 Q78 M79	L37-E75 HydrophobicContact CD1-CB 3.95Å; A73-E75 VanDerWaalsContact C-N 3.31Å; A73-E75 PolarHBondContact O-N 2.73Å; E75-Q78 PolarHBondContact O-N 2.88Å; E75-M79 WeakPolarHBondContact O-CB 3.18Å; E75-M79 PolarHBondContact O-N 3.4Å
76	A	89.9	Confident	90.8	Very high	12 Å²	12	46.1 Å²	46.1	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-36.2	175.8	0	0	0	0	0	111.9	L33 A73 E74 A80	L33-A76 HydrophobicContact CB-CB 4.43Å; A73-A76 HydrophobicContact CB-CB 4.29Å; A73-A76 PolarHBondContact O-N 2.94Å; E74-A76 VanDerWaalsContact C-N 3.31Å; E74-A76 PolarHBondContact O-N 3.45Å; A76-A80 WeakPolarHBondContact O-CB 3.32Å; A76-A80 PolarHBondContact O-N 2.91Å
77	R	93.6	Very high	90.6	Very high	7 Å²	7	46.9 Å²	46.9	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-66.2	-40.6	173.7	-63.5	175.5	69	-138.1	-0.8	111.2	I67 N69 A72 A73 E74 A80 A81 E118 M123	I67-R77 PolarHBondContact O-NE 2.74Å; I67-R77 PolarHBondContact O-NH2 3.25Å; N69-R77 WeakPolarHBondContact O-CD 3.36Å; A72-R77 HydrophobicContact CB-CG 4.45Å; A73-R77 WeakPolarHBondContact O-CG 3.14Å; A73-R77 PolarHBondContact O-N 3.26Å; A73-R77 VanDerWaalsContact O-N 3.13Å; E74-R77 WeakPolarHBondContact O-CB 3.33Å; E74-R77 PolarHBondContact O-N 3.29Å; E74-R77 VanDerWaalsContact O-N 3.12Å; E74-R77 IonicContact OE2-CZ 3.48Å; E74-R77 IonicContact OE2-NH1 3.24Å; E74-R77 PolarHBondContact OE2-NH1 2.88Å; R77-A80 PolarHBondContact O-N 3.26Å; R77-A81 PolarHBondContact O-N 3.09Å; R77-E118 IonicContact CZ-OE2 3.46Å; R77-E118 IonicContact NH1-OE2 2.7Å; R77-E118 IonicContact NH2-OE2 3.96Å; R77-E118 PolarHBondContact NH2-OE2 3.27Å; R77-M123 HydrophobicContact CB-CE 3.44Å; R77-M123 VanDerWaalsContact CB-CE 3.44Å; R77-M123 HydrophobicContact CB-SD 4.3Å
78	Q	89.4	Confident	90.4	Very high	64 Å²	64	47 Å²	47	30%	0.299	25%	0.247	S	C	.	.	H	α-helix	trans	-66.3	-45.1	179.2	-73.6	-169.5	12.6	0	0	110.9	E74 E75 A80 A81 V82 M123 K126	E74-Q78 WeakPolarHBondContact O-CG 3.42Å; E74-Q78 PolarHBondContact O-N 3.11Å; E75-Q78 PolarHBondContact O-N 2.88Å; Q78-A80 VanDerWaalsContact C-N 3.34Å; Q78-A80 PolarHBondContact O-N 3.49Å; Q78-A81 PolarHBondContact O-N 2.62Å; Q78-V82 WeakPolarHBondContact O-CG2 3.4Å; Q78-V82 PolarHBondContact O-N 3.31Å; Q78-M123 HydrophobicContact CB-CE 4.31Å; Q78-M123 HydrophobicContact CG-CE 3.52Å; Q78-K126 HydrophobicContact CB-CD 4.38Å; Q78-K126 HydrophobicContact CG-CD 4.38Å
79	M	90.4	Very high	89.9	Confident	49 Å²	49	43.7 Å²	43.7	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-58.2	-46.3	173.4	179.5	56	73	0	0	111.3	L33 L37 E75 A81 V82 L83	L33-M79 HydrophobicContact CD2-CG 4.14Å; L37-M79 HydrophobicContact CD1-CB 4.22Å; L37-M79 HydrophobicContact CD2-CB 4.44Å; L37-M79 HydrophobicContact CD2-CE 3.38Å; L37-M79 HydrophobicContact CG-CB 4.45Å; L37-M79 HydrophobicContact CG-CE 4.08Å; E75-M79 WeakPolarHBondContact O-CB 3.18Å; E75-M79 PolarHBondContact O-N 3.4Å; M79-A81 VanDerWaalsContact C-N 3.32Å; M79-A81 PolarHBondContact O-N 3.29Å; M79-V82 PolarHBondContact O-N 2.84Å; M79-L83 HydrophobicContact CG-CD1 3.87Å; M79-L83 HydrophobicContact CG-CG 4.36Å; M79-L83 WeakPolarHBondContact O-CB 3.37Å; M79-L83 VanDerWaalsContact O-CG 3.31Å; M79-L83 WeakPolarHBondContact O-CG 3.4Å; M79-L83 PolarHBondContact O-N 2.93Å; M79-L83 HydrophobicContact SD-CD1 3.88Å; M79-L83 HydrophobicContact SD-CD2 4.38Å; M79-L83 HydrophobicContact SD-CG 3.87Å
80	A	94.2	Very high	89.4	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-39.4	177.5	0	0	0	0	0	112.9	L33 L63 A66 I67 A76 R77 Q78 L84	L33-A80 HydrophobicContact CD1-CB 4.01Å; L33-A80 HydrophobicContact CD2-CB 4.42Å; L63-A80 HydrophobicContact CD2-CB 4.13Å; A66-A80 HydrophobicContact CB-CB 3.74Å; I67-A80 HydrophobicContact CG1-CB 3.86Å; A76-A80 WeakPolarHBondContact O-CB 3.32Å; A76-A80 PolarHBondContact O-N 2.91Å; R77-A80 PolarHBondContact O-N 3.26Å; Q78-A80 VanDerWaalsContact C-N 3.34Å; Q78-A80 PolarHBondContact O-N 3.49Å; A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.49Å; A80-L84 PolarHBondContact O-N 3.13Å
81	A	92.1	Very high	89.3	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-43.4	177.5	0	0	0	0	0	112.4	I67 R77 Q78 M79 L84 R85 M123 K126 I130	I67-A81 HydrophobicContact CD1-CB 4.05Å; I67-A81 HydrophobicContact CG1-CB 4.13Å; R77-A81 PolarHBondContact O-N 3.09Å; Q78-A81 PolarHBondContact O-N 2.62Å; M79-A81 VanDerWaalsContact C-N 3.32Å; M79-A81 PolarHBondContact O-N 3.29Å; A81-L84 PolarHBondContact O-N 3.31Å; A81-R85 PolarHBondContact O-N 3.47Å; A81-M123 HydrophobicContact CB-SD 4.17Å; A81-K126 HydrophobicContact CB-CB 3.78Å; A81-K126 HydrophobicContact CB-CD 4.28Å; A81-I130 HydrophobicContact CB-CD1 4.03Å; A81-I130 WeakPolarHBondContact O-CD1 3.45Å
82	V	88.4	Confident	89.3	Confident	28 Å²	28	37.7 Å²	37.7	17%	0.17	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-47.3	176.3	173.2	0	0	0	0	111.1	Q78 M79 L84 R85 R86 K126	Q78-V82 WeakPolarHBondContact O-CG2 3.4Å; Q78-V82 PolarHBondContact O-N 3.31Å; M79-V82 PolarHBondContact O-N 2.84Å; V82-L84 VanDerWaalsContact C-N 3.32Å; V82-L84 PolarHBondContact O-N 3.33Å; V82-R85 PolarHBondContact O-N 3.3Å; V82-R86 WeakPolarHBondContact O-CG 3.28Å; V82-R86 PolarHBondContact O-N 2.98Å; V82-K126 HydrophobicContact CG2-CD 4.2Å
83	L	90.4	Very high	89.2	Confident	21 Å²	21	42.7 Å²	42.7	11%	0.11	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-37.5	178.6	-72	174.6	0	0	0	112.6	L33 L36 Y51 L63 M79 R86 L87	L33-L83 HydrophobicContact CD2-CD1 3.87Å; L36-L83 HydrophobicContact CD1-CD1 3.9Å; Y51-L83 HydrophobicContact CE1-CD2 4.05Å; Y51-L83 HydrophobicContact CE2-CD1 4.13Å; L63-L83 HydrophobicContact CD1-CB 4.29Å; L63-L83 HydrophobicContact CD2-CB 3.78Å; L63-L83 HydrophobicContact CD2-CD1 4.19Å; M79-L83 HydrophobicContact CG-CD1 3.87Å; M79-L83 HydrophobicContact CG-CG 4.36Å; M79-L83 WeakPolarHBondContact O-CB 3.37Å; M79-L83 VanDerWaalsContact O-CG 3.31Å; M79-L83 WeakPolarHBondContact O-CG 3.4Å; M79-L83 PolarHBondContact O-N 2.93Å; M79-L83 HydrophobicContact SD-CD1 3.88Å; M79-L83 HydrophobicContact SD-CD2 4.38Å; M79-L83 HydrophobicContact SD-CG 3.87Å; L83-R86 PolarHBondContact O-N 2.93Å; L83-L87 WeakPolarHBondContact O-CB 3.24Å; L83-L87 PolarHBondContact O-N 3.45Å
84	L	93.8	Very high	89.2	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-41.5	177.5	-177.9	56.7	0	0	0	111.8	I60 L63 L64 I67 A80 A81 V82 L87 L88 I130	I60-L84 HydrophobicContact CB-CD1 4.5Å; I60-L84 HydrophobicContact CG1-CD1 3.87Å; L63-L84 HydrophobicContact CB-CB 4.02Å; L63-L84 HydrophobicContact CB-CD1 4.23Å; L63-L84 HydrophobicContact CB-CD2 4.48Å; L63-L84 HydrophobicContact CB-CG 4.48Å; L63-L84 HydrophobicContact CD1-CB 4.15Å; L63-L84 HydrophobicContact CD1-CD1 4.26Å; L64-L84 HydrophobicContact CB-CD2 4.35Å; L64-L84 HydrophobicContact CD1-CD2 4.19Å; I67-L84 HydrophobicContact CD1-CB 4.25Å; I67-L84 HydrophobicContact CD1-CD2 3.6Å; A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.49Å; A80-L84 PolarHBondContact O-N 3.13Å; A81-L84 PolarHBondContact O-N 3.31Å; V82-L84 VanDerWaalsContact C-N 3.32Å; V82-L84 PolarHBondContact O-N 3.33Å; L84-L87 PolarHBondContact O-N 3Å; L84-L88 WeakPolarHBondContact O-CG 3.42Å; L84-L88 PolarHBondContact O-N 3.41Å; L84-I130 HydrophobicContact CB-CD1 4.08Å; L84-I130 HydrophobicContact CB-CG1 4.41Å; L84-I130 HydrophobicContact CD2-CD1 3.93Å; L84-I130 HydrophobicContact CD2-CG2 3.89Å; L84-I130 HydrophobicContact CG-CD1 4.16Å; L84-I130 HydrophobicContact CG-CG1 4.34Å; L84-I130 HydrophobicContact CG-CG2 3.94Å
85	R	89.5	Confident	89.3	Confident	30 Å²	30	44.4 Å²	44.4	11%	0.113	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-53.2	173.3	-173.1	-174.5	67.9	78.9	1.7	110.3	A81 V82 L87 L88 S89 D129 I130 D662	A81-R85 PolarHBondContact O-N 3.47Å; V82-R85 PolarHBondContact O-N 3.3Å; R85-L87 VanDerWaalsContact C-N 3.3Å; R85-L87 PolarHBondContact O-N 3.1Å; R85-L88 PolarHBondContact O-N 3.16Å; R85-S89 PolarHBondContact O-N 3.23Å; R85-S89 PolarHBondContact O-OG 3.04Å; R85-S89 VanDerWaalsContact O-OG 3.1Å; R85-D129 HydrophobicContact CG-CB 4.45Å; R85-I130 HydrophobicContact CB-CG1 3.95Å; R85-D662 IonicContact CZ-OD2 2.74Å; R85-D662 IonicContact NH2-OD2 3.11Å; R85-D662 PolarHBondContact NH2-OD2 3.4Å
86	R	86.1	Confident	89.5	Confident	108 Å²	108	38.8 Å²	38.8	41%	0.408	20%	0.204	S	C	.	.	H	α-helix	trans	-56.5	-41.3	179.5	-71.5	-176.9	177.9	-173.8	0.6	112.6	V82 L83 L88 S89 S90 D665	V82-R86 WeakPolarHBondContact O-CG 3.28Å; V82-R86 PolarHBondContact O-N 2.98Å; L83-R86 PolarHBondContact O-N 2.93Å; R86-L88 VanDerWaalsContact C-N 3.34Å; R86-L88 PolarHBondContact O-N 2.96Å; R86-S89 PolarHBondContact O-N 3.28Å; R86-S90 PolarHBondContact O-N 3.01Å; R86-S90 PolarHBondContact O-OG 3.27Å; R86-D665 IonicContact CZ-OD2 2.63Å; R86-D665 IonicContact NH2-OD1 3.02Å; R86-D665 IonicContact NH2-OD2 3.09Å; R86-D665 PolarHBondContact NH2-OD2 3.2Å
87	L	89.4	Confident	89.6	Confident	16 Å²	16	41.6 Å²	41.6	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-41.2	177	-177.9	68	0	0	0	112.5	K59 I60 L63 L83 L84 R85 A91 V95	K59-L87 HydrophobicContact CB-CD2 3.72Å; K59-L87 HydrophobicContact CD-CD1 4.21Å; I60-L87 HydrophobicContact CB-CD2 4.16Å; L63-L87 HydrophobicContact CD1-CD2 4.27Å; L83-L87 WeakPolarHBondContact O-CB 3.24Å; L83-L87 PolarHBondContact O-N 3.45Å; L84-L87 PolarHBondContact O-N 3Å; R85-L87 VanDerWaalsContact C-N 3.3Å; R85-L87 PolarHBondContact O-N 3.1Å; L87-A91 HydrophobicContact CD1-CB 4.48Å; L87-A91 PolarHBondContact O-N 3.49Å; L87-A91 VanDerWaalsContact O-N 3.14Å; L87-V95 HydrophobicContact CD1-CG2 4.12Å; L87-V95 HydrophobicContact CG-CG2 4.48Å
88	L	89.4	Confident	89.4	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-72.1	-37.4	178.1	-65.7	-179.7	0	0	0	111.8	I60 L84 R85 R86 F92 I130 E133 L134	I60-L88 HydrophobicContact CD1-CD2 3.99Å; L84-L88 WeakPolarHBondContact O-CG 3.42Å; L84-L88 PolarHBondContact O-N 3.41Å; R85-L88 PolarHBondContact O-N 3.16Å; R86-L88 VanDerWaalsContact C-N 3.34Å; R86-L88 PolarHBondContact O-N 2.96Å; L88-F92 WeakPolarHBondContact O-CB 3.44Å; L88-I130 HydrophobicContact CD1-CG2 3.78Å; L88-E133 HydrophobicContact CB-CB 4.42Å; L88-E133 HydrophobicContact CB-CG 3.76Å; L88-L134 HydrophobicContact CD1-CB 4.11Å
89	S	83.9	Confident	89.5	Confident	37 Å²	37	42.6 Å²	42.6	26%	0.259	23%	0.232	S	C	.	.	H	α-helix	trans	-68.5	-40.4	178.3	-52.1	0	0	0	0	112.8	R85 R86 E133 Q684	R85-S89 PolarHBondContact O-N 3.23Å; R85-S89 PolarHBondContact O-OG 3.04Å; R85-S89 VanDerWaalsContact O-OG 3.1Å; R86-S89 PolarHBondContact O-N 3.28Å; S89-E133 WeakPolarHBondContact OG-CG 3.43Å; S89-E133 PolarHBondContact OG-OE2 3.49Å; S89-Q684 PolarHBondContact OG-NE2 3.34Å
90	S	81.3	Confident	89.6	Confident	102 Å²	102	43.6 Å²	43.6	71%	0.713	24%	0.242	S	C	*	.	H	α-helix	trans	-95.8	-23.7	-171.6	67.5	0	0	0	0	115.3	R86	R86-S90 PolarHBondContact O-N 3.01Å; R86-S90 PolarHBondContact O-OG 3.27Å
91	A	86.6	Confident	89.5	Confident	22 Å²	22	47.5 Å²	47.5	18%	0.182	27%	0.269	C	S	.	.	H	α-helix	trans	-140.6	31.7	-168.9	0	0	0	0	0	113.6	L87 D93 E94 V95	L87-A91 HydrophobicContact CD1-CB 4.48Å; L87-A91 PolarHBondContact O-N 3.49Å; L87-A91 VanDerWaalsContact O-N 3.14Å; A91-D93 PolarHBondContact O-N 3.01Å; A91-E94 PolarHBondContact O-N 3.46Å; A91-V95 HydrophobicContact CB-CG2 4.23Å; A91-V95 WeakPolarHBondContact O-CB 3.48Å; A91-V95 VanDerWaalsContact O-CG2 3.27Å; A91-V95 WeakPolarHBondContact O-CG2 3.34Å; A91-V95 PolarHBondContact O-N 3.4Å; A91-V95 VanDerWaalsContact O-N 3.14Å
92	F	89.1	Confident	89.4	Confident	21 Å²	21	53 Å²	53	9%	0.092	30%	0.298	C	S	.	.	H	α-helix	trans	-53.1	-53.5	-178.9	-179.8	-98.1	0	0	0	112.6	L88 E94 V95 Y96 P97 L134 N137 L138	L88-F92 WeakPolarHBondContact O-CB 3.44Å; F92-E94 VanDerWaalsContact C-N 3.27Å; F92-E94 PolarHBondContact O-N 2.81Å; F92-V95 PolarHBondContact O-N 3.34Å; F92-V95 VanDerWaalsContact O-N 3.08Å; F92-Y96 HydrophobicContact CD2-CG 4.44Å; F92-Y96 AromaticContact CE2-CD1 3.83Å; F92-Y96 HydrophobicContact CE2-CD1 3.83Å; F92-Y96 HydrophobicContact CE2-CD2 4.44Å; F92-Y96 AromaticContact CE2-CG 3.68Å; F92-Y96 HydrophobicContact CE2-CG 3.68Å; F92-Y96 AromaticContact CZ-CD1 3.77Å; F92-Y96 HydrophobicContact CZ-CD1 3.77Å; F92-Y96 HydrophobicContact CZ-CG 4.08Å; F92-Y96 PolarHBondContact O-N 2.99Å; F92-P97 HydrophobicContact CE1-CG 4.24Å; F92-P97 WeakPolarHBondContact O-CD 3.37Å; F92-L134 HydrophobicContact CE2-CD1 4.12Å; F92-N137 HydrophobicContact CB-CB 4.37Å; F92-N137 HydrophobicContact CD1-CB 3.68Å; F92-N137 HydrophobicContact CD2-CB 3.38Å; F92-N137 HydrophobicContact CE1-CB 3.68Å; F92-N137 WeakPolarHBondContact CE1-O 3.5Å; F92-N137 HydrophobicContact CE2-CB 3.39Å; F92-N137 HydrophobicContact CG-CB 3.53Å; F92-N137 HydrophobicContact CZ-CB 3.53Å; F92-N137 WeakPolarHBondContact CZ-O 3.39Å; F92-L138 HydrophobicContact CZ-CD2 4.14Å
93	D	87.4	Confident	89.5	Confident	134 Å²	134	53.6 Å²	53.6	72%	0.717	30%	0.302	S	S	*	.	H	α-helix	trans	-63.3	-30.8	-173	-68.3	-39.5	0	0	0	113.7	A91	A91-D93 PolarHBondContact O-N 3.01Å
94	E	89.1	Confident	89.6	Confident	144 Å²	144	54.5 Å²	54.5	67%	0.673	31%	0.306	S	S	*	.	H	α-helix	trans	-76.8	-37.3	176.1	-169	-173.7	156.5	0	0	111.4	A91 F92 T98	A91-E94 PolarHBondContact O-N 3.46Å; F92-E94 VanDerWaalsContact C-N 3.27Å; F92-E94 PolarHBondContact O-N 2.81Å; E94-T98 VanDerWaalsContact O-CG2 3.3Å; E94-T98 WeakPolarHBondContact O-CG2 3.4Å; E94-T98 PolarHBondContact O-OG1 3.18Å
95	V	92.1	Very high	89.6	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.018	32%	0.324	C	S	.	.	H	α-helix	trans	-93	-62.8	-168.1	178.4	0	0	0	0	112.6	G56 I60 L87 A91 F92 T98 L99	G56-V95 WeakPolarHBondContact O-CG1 3.49Å; I60-V95 HydrophobicContact CB-CG1 4.25Å; I60-V95 HydrophobicContact CD1-CG1 4.24Å; I60-V95 HydrophobicContact CG2-CG1 4.31Å; L87-V95 HydrophobicContact CD1-CG2 4.12Å; L87-V95 HydrophobicContact CG-CG2 4.48Å; A91-V95 HydrophobicContact CB-CG2 4.23Å; A91-V95 WeakPolarHBondContact O-CB 3.48Å; A91-V95 VanDerWaalsContact O-CG2 3.27Å; A91-V95 WeakPolarHBondContact O-CG2 3.34Å; A91-V95 PolarHBondContact O-N 3.4Å; A91-V95 VanDerWaalsContact O-N 3.14Å; F92-V95 PolarHBondContact O-N 3.34Å; F92-V95 VanDerWaalsContact O-N 3.08Å; V95-T98 PolarHBondContact O-OG1 2.64Å; V95-L99 WeakPolarHBondContact O-CG 3.14Å
96	Y	92.7	Very high	89.7	Confident	8 Å²	8	57.9 Å²	57.9	3%	0.031	33%	0.334	C	S	.	.	S	Bend	trans	-74.3	-44.8	-165.5	-169.5	-87.8	0	0	0	113.4	I60 F92 T98 L99 Q104 I107 K108 L134 L138	I60-Y96 HydrophobicContact CD1-CD2 4.13Å; F92-Y96 HydrophobicContact CD2-CG 4.44Å; F92-Y96 AromaticContact CE2-CD1 3.83Å; F92-Y96 HydrophobicContact CE2-CD1 3.83Å; F92-Y96 HydrophobicContact CE2-CD2 4.44Å; F92-Y96 AromaticContact CE2-CG 3.68Å; F92-Y96 HydrophobicContact CE2-CG 3.68Å; F92-Y96 AromaticContact CZ-CD1 3.77Å; F92-Y96 HydrophobicContact CZ-CD1 3.77Å; F92-Y96 HydrophobicContact CZ-CG 4.08Å; F92-Y96 PolarHBondContact O-N 2.99Å; Y96-T98 PolarHBondContact O-N 3.49Å; Y96-L99 HydrophobicContact CD2-CD1 4.36Å; Y96-L99 WeakPolarHBondContact O-CB 3.47Å; Y96-L99 PolarHBondContact O-N 2.85Å; Y96-Q104 HydrophobicContact CD1-CG 4.3Å; Y96-Q104 HydrophobicContact CE1-CB 4.14Å; Y96-Q104 HydrophobicContact CE1-CG 3.79Å; Y96-Q104 HydrophobicContact CE2-CB 4.42Å; Y96-Q104 HydrophobicContact CE2-CG 4.3Å; Y96-Q104 PolarHBondContact O-NE2 3.25Å; Y96-Q104 WeakPolarHBondContact OH-CB 3.42Å; Y96-Q104 PolarHBondContact OH-O 3.18Å; Y96-I107 HydrophobicContact CE2-CG2 4.44Å; Y96-K108 WeakPolarHBondContact OH-CG 3.48Å; Y96-L134 HydrophobicContact CD2-CD1 3.9Å; Y96-L134 HydrophobicContact CE2-CD1 3.67Å; Y96-L134 HydrophobicContact CG-CD1 4.46Å; Y96-L138 HydrophobicContact CD1-CD2 4.38Å; Y96-L138 HydrophobicContact CE1-CD2 3.83Å
97	P	92.3	Very high	90	Very high	71 Å²	71	53.2 Å²	53.2	46%	0.461	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.3	178.4	-25.4	35.9	0	0	0	114.1	F92	F92-P97 HydrophobicContact CE1-CG 4.24Å; F92-P97 WeakPolarHBondContact O-CD 3.37Å
98	T	90.8	Very high	90.3	Very high	73 Å²	73	53.9 Å²	53.9	45%	0.448	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-9.9	-178.7	65.1	0	0	0	0	113.6	Q57 E94 V95 Y96	Q57-T98 PolarHBondContact NE2-OG1 3.44Å; E94-T98 VanDerWaalsContact O-CG2 3.3Å; E94-T98 WeakPolarHBondContact O-CG2 3.4Å; E94-T98 PolarHBondContact O-OG1 3.18Å; V95-T98 PolarHBondContact O-OG1 2.64Å; Y96-T98 PolarHBondContact O-N 3.49Å
99	L	91.4	Very high	90.5	Very high	18 Å²	18	57.1 Å²	57.1	9%	0.094	34%	0.342	C	S	.	.	S	Bend	trans	-75.3	151.2	177.8	-66.6	172	0	0	0	112.8	Q57 I60 V95 Y96 V103 Q104 I107	Q57-L99 HydrophobicContact CB-CD2 3.98Å; Q57-L99 HydrophobicContact CG-CD2 4.22Å; I60-L99 HydrophobicContact CD1-CD1 4.17Å; I60-L99 HydrophobicContact CG2-CD1 3.95Å; I60-L99 HydrophobicContact CG2-CD2 4.47Å; V95-L99 WeakPolarHBondContact O-CG 3.14Å; Y96-L99 HydrophobicContact CD2-CD1 4.36Å; Y96-L99 WeakPolarHBondContact O-CB 3.47Å; Y96-L99 PolarHBondContact O-N 2.85Å; L99-V103 HydrophobicContact CD1-CG1 4.44Å; L99-V103 HydrophobicContact CD2-CG1 4.49Å; L99-Q104 HydrophobicContact CB-CG 3.92Å; L99-Q104 PolarHBondContact O-NE2 2.89Å; L99-I107 HydrophobicContact CD1-CD1 3.7Å
100	P	92.6	Very high	91	Very high	71 Å²	71	57.6 Å²	57.6	46%	0.461	34%	0.34	S	S	.	.			trans	-58.9	143.3	168.7	-23.8	35.1	0	0	0	112.7	D102 V103 Q104	P100-D102 VanDerWaalsContact C-N 3.27Å; P100-D102 WeakPolarHBondContact CB-OD1 3.32Å; P100-D102 PolarHBondContact O-N 3.32Å; P100-V103 HydrophobicContact CB-CB 4.43Å; P100-V103 HydrophobicContact CB-CG2 4.1Å; P100-V103 HydrophobicContact CG-CG2 4.21Å; P100-V103 WeakPolarHBondContact O-CA 3.32Å; P100-V103 WeakPolarHBondContact O-CB 3.35Å; P100-V103 PolarHBondContact O-N 3.33Å; P100-Q104 PolarHBondContact O-N 3.06Å
101	S	90.8	Very high	91.7	Very high	81 Å²	81	52.8 Å²	52.8	57%	0.566	31%	0.307	S	S	*	.	H	α-helix	trans	-61	-31.2	-176.4	-176.1	0	0	0	0	114	T105	S101-T105 WeakPolarHBondContact O-CB 3.44Å; S101-T105 PolarHBondContact O-N 3.45Å; S101-T105 PolarHBondContact O-OG1 3.05Å
102	D	91.4	Very high	92.2	Very high	117 Å²	117	52.6 Å²	52.6	63%	0.626	30%	0.303	S	S	*	.	H	α-helix	trans	-66.5	-39.5	172.9	59.4	-53.7	0	0	0	111.7	P100 T105 A106	P100-D102 VanDerWaalsContact C-N 3.27Å; P100-D102 WeakPolarHBondContact CB-OD1 3.32Å; P100-D102 PolarHBondContact O-N 3.32Å; D102-T105 PolarHBondContact O-N 3.46Å; D102-A106 WeakPolarHBondContact O-CB 3.42Å; D102-A106 PolarHBondContact O-N 3.23Å
103	V	89.8	Confident	92.4	Very high	41 Å²	41	56.2 Å²	56.2	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-69.5	-43.4	175.2	179.4	0	0	0	0	111	T61 L99 P100 T105 A106 I107	T61-V103 HydrophobicContact CG2-CG1 4.37Å; L99-V103 HydrophobicContact CD1-CG1 4.44Å; L99-V103 HydrophobicContact CD2-CG1 4.49Å; P100-V103 HydrophobicContact CB-CB 4.43Å; P100-V103 HydrophobicContact CB-CG2 4.1Å; P100-V103 HydrophobicContact CG-CG2 4.21Å; P100-V103 WeakPolarHBondContact O-CA 3.32Å; P100-V103 WeakPolarHBondContact O-CB 3.35Å; P100-V103 PolarHBondContact O-N 3.33Å; V103-T105 VanDerWaalsContact C-N 3.29Å; V103-T105 PolarHBondContact O-N 3.41Å; V103-A106 PolarHBondContact O-N 2.94Å; V103-I107 HydrophobicContact CG1-CD1 3.89Å; V103-I107 HydrophobicContact CG1-CG1 4.38Å; V103-I107 VanDerWaalsContact O-CG1 3.31Å; V103-I107 WeakPolarHBondContact O-CG1 3.36Å; V103-I107 PolarHBondContact O-N 3.31Å
104	Q	92.1	Very high	92.8	Very high	39 Å²	39	50.2 Å²	50.2	18%	0.182	29%	0.289	C	S	.	.	H	α-helix	trans	-56.3	-44.4	174	-71.7	177.3	-7.6	0	0	111.6	Y96 L99 P100 K108	Y96-Q104 HydrophobicContact CD1-CG 4.3Å; Y96-Q104 HydrophobicContact CE1-CB 4.14Å; Y96-Q104 HydrophobicContact CE1-CG 3.79Å; Y96-Q104 HydrophobicContact CE2-CB 4.42Å; Y96-Q104 HydrophobicContact CE2-CG 4.3Å; Y96-Q104 PolarHBondContact O-NE2 3.25Å; Y96-Q104 WeakPolarHBondContact OH-CB 3.42Å; Y96-Q104 PolarHBondContact OH-O 3.18Å; L99-Q104 HydrophobicContact CB-CG 3.92Å; L99-Q104 PolarHBondContact O-NE2 2.89Å; P100-Q104 PolarHBondContact O-N 3.06Å; Q104-K108 WeakPolarHBondContact O-CG 3.27Å; Q104-K108 PolarHBondContact O-N 3.22Å
105	T	93.6	Very high	93.2	Very high	66 Å²	66	43.3 Å²	43.3	41%	0.405	26%	0.257	S	S	.	.	H	α-helix	trans	-68.1	-38.5	177.8	-55.3	0	0	0	0	112.1	S101 D102 V103 S109	S101-T105 WeakPolarHBondContact O-CB 3.44Å; S101-T105 PolarHBondContact O-N 3.45Å; S101-T105 PolarHBondContact O-OG1 3.05Å; D102-T105 PolarHBondContact O-N 3.46Å; V103-T105 VanDerWaalsContact C-N 3.29Å; V103-T105 PolarHBondContact O-N 3.41Å; T105-S109 PolarHBondContact O-N 3.12Å; T105-S109 VanDerWaalsContact O-N 3.07Å; T105-S109 PolarHBondContact O-OG 3.45Å
106	A	91.8	Very high	93.3	Very high	40 Å²	40	48 Å²	48	33%	0.331	28%	0.278	S	S	.	.	H	α-helix	trans	-63.3	-47.4	175.7	0	0	0	0	0	111.4	D102 V103 K108 S109 E110	D102-A106 WeakPolarHBondContact O-CB 3.42Å; D102-A106 PolarHBondContact O-N 3.23Å; V103-A106 PolarHBondContact O-N 2.94Å; A106-K108 VanDerWaalsContact C-N 3.34Å; A106-K108 PolarHBondContact O-N 3.04Å; A106-S109 PolarHBondContact O-N 3.4Å; A106-E110 VanDerWaalsContact O-CB 3.3Å; A106-E110 WeakPolarHBondContact O-CB 3.5Å; A106-E110 VanDerWaalsContact O-CG 3.26Å; A106-E110 WeakPolarHBondContact O-CG 3.48Å; A106-E110 PolarHBondContact O-N 3.02Å
107	I	93.5	Very high	93.3	Very high	9 Å²	9	52.7 Å²	52.7	5%	0.046	30%	0.302	C	S	.	.	H	α-helix	trans	-56.3	-48.9	177.8	-69.9	165.4	0	0	0	110.8	I60 L64 Y96 L99 V103 S109 E110 L111 L134	I60-I107 HydrophobicContact CD1-CD1 3.83Å; I60-I107 HydrophobicContact CG1-CD1 4.09Å; I60-I107 HydrophobicContact CG2-CD1 4.29Å; L64-I107 HydrophobicContact CD2-CB 4.31Å; L64-I107 HydrophobicContact CD2-CG1 4.08Å; L64-I107 HydrophobicContact CD2-CG2 4.23Å; Y96-I107 HydrophobicContact CE2-CG2 4.44Å; L99-I107 HydrophobicContact CD1-CD1 3.7Å; V103-I107 HydrophobicContact CG1-CD1 3.89Å; V103-I107 HydrophobicContact CG1-CG1 4.38Å; V103-I107 VanDerWaalsContact O-CG1 3.31Å; V103-I107 WeakPolarHBondContact O-CG1 3.36Å; V103-I107 PolarHBondContact O-N 3.31Å; I107-S109 PolarHBondContact O-N 2.99Å; I107-E110 PolarHBondContact O-N 3.45Å; I107-L111 HydrophobicContact CG2-CD1 3.98Å; I107-L111 WeakPolarHBondContact O-CB 3.45Å; I107-L111 WeakPolarHBondContact O-CG 3.15Å; I107-L111 PolarHBondContact O-N 3.16Å; I107-L134 HydrophobicContact CG2-CD2 4.31Å
108	K	94.9	Very high	93.5	Very high	31 Å²	31	49.8 Å²	49.8	14%	0.135	28%	0.282	C	S	.	.	H	α-helix	trans	-56	-49.4	176.9	-73.5	-174.8	-58.5	178.7	0	111.8	Y96 Q104 A106 L112 L134 L138 W147	Y96-K108 WeakPolarHBondContact OH-CG 3.48Å; Q104-K108 WeakPolarHBondContact O-CG 3.27Å; Q104-K108 PolarHBondContact O-N 3.22Å; A106-K108 VanDerWaalsContact C-N 3.34Å; A106-K108 PolarHBondContact O-N 3.04Å; K108-L112 WeakPolarHBondContact O-CG 3.35Å; K108-L112 PolarHBondContact O-N 3.32Å; K108-L134 HydrophobicContact CG-CD2 4.08Å; K108-L138 HydrophobicContact CD-CD1 3.99Å; K108-W147 HydrophobicContact CB-CZ2 3.96Å; K108-W147 HydrophobicContact CD-CB 4.4Å; K108-W147 HydrophobicContact CD-CD2 4.14Å; K108-W147 HydrophobicContact CD-CG 3.82Å; K108-W147 HydrophobicContact CG-CD2 4.26Å; K108-W147 HydrophobicContact CG-CG 4.43Å; K108-W147 HydrophobicContact CG-CZ2 4.26Å; K108-W147 WeakPolarHBondContact O-CZ2 3.33Å
109	S	94.3	Very high	93.4	Very high	71 Å²	71	51.7 Å²	51.7	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-68.6	-39.8	-177.6	-55.3	0	0	0	0	112.5	T105 A106 I107 M113	T105-S109 PolarHBondContact O-N 3.12Å; T105-S109 VanDerWaalsContact O-N 3.07Å; T105-S109 PolarHBondContact O-OG 3.45Å; A106-S109 PolarHBondContact O-N 3.4Å; I107-S109 PolarHBondContact O-N 2.99Å; S109-M113 WeakPolarHBondContact O-CB 3.33Å; S109-M113 PolarHBondContact O-N 3.47Å; S109-M113 VanDerWaalsContact O-N 3.1Å
110	E	94.3	Very high	93.4	Very high	48 Å²	48	56 Å²	56	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-68.8	-39.9	-179.5	-73.6	-172.4	-178.1	0	0	112.2	L64 Q65 R68 A106 I107 L112 M113 I114	L64-E110 HydrophobicContact CD2-CB 4.06Å; Q65-E110 PolarHBondContact NE2-OE2 2.95Å; R68-E110 IonicContact CZ-OE1 2.77Å; R68-E110 IonicContact NH1-OE1 3.78Å; R68-E110 PolarHBondContact NH1-OE1 2.64Å; R68-E110 IonicContact NH1-OE2 3.24Å; R68-E110 PolarHBondContact NH1-OE2 2.98Å; A106-E110 VanDerWaalsContact O-CB 3.3Å; A106-E110 WeakPolarHBondContact O-CB 3.5Å; A106-E110 VanDerWaalsContact O-CG 3.26Å; A106-E110 WeakPolarHBondContact O-CG 3.48Å; A106-E110 PolarHBondContact O-N 3.02Å; I107-E110 PolarHBondContact O-N 3.45Å; E110-L112 PolarHBondContact O-N 3.36Å; E110-M113 WeakPolarHBondContact O-CB 3.31Å; E110-M113 PolarHBondContact O-N 2.96Å; E110-I114 VanDerWaalsContact O-CG1 3.27Å; E110-I114 WeakPolarHBondContact O-CG1 3.42Å; E110-I114 PolarHBondContact O-N 2.67Å
111	L	95.5	Very high	93.2	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-48.4	174.8	-80.7	169.9	0	0	0	111.8	L64 I107 M113 I114 I115 V127 I130 L134	L64-L111 HydrophobicContact CD1-CD2 3.53Å; L64-L111 HydrophobicContact CD1-CG 3.88Å; I107-L111 HydrophobicContact CG2-CD1 3.98Å; I107-L111 WeakPolarHBondContact O-CB 3.45Å; I107-L111 WeakPolarHBondContact O-CG 3.15Å; I107-L111 PolarHBondContact O-N 3.16Å; L111-M113 VanDerWaalsContact C-N 3.29Å; L111-M113 PolarHBondContact O-N 3.08Å; L111-I114 PolarHBondContact O-N 3.1Å; L111-I115 WeakPolarHBondContact O-CG1 3.4Å; L111-I115 PolarHBondContact O-N 3.49Å; L111-I115 VanDerWaalsContact O-N 3.16Å; L111-V127 HydrophobicContact CD2-CG1 4.14Å; L111-I130 HydrophobicContact CD1-CG2 4.08Å; L111-I130 HydrophobicContact CD2-CB 4.35Å; L111-I130 HydrophobicContact CD2-CG2 3.65Å; L111-L134 HydrophobicContact CD1-CD2 3.56Å
112	L	95.9	Very high	93.2	Very high	18 Å²	18	53.5 Å²	53.5	9%	0.094	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-38.3	177.3	-58.7	178.4	0	0	0	111.7	K108 E110 I115 Q116 W147 E149 F153	K108-L112 WeakPolarHBondContact O-CG 3.35Å; K108-L112 PolarHBondContact O-N 3.32Å; E110-L112 PolarHBondContact O-N 3.36Å; L112-I115 PolarHBondContact O-N 3.18Å; L112-Q116 WeakPolarHBondContact O-CG 3.37Å; L112-Q116 PolarHBondContact O-N 3.42Å; L112-Q116 VanDerWaalsContact O-N 3.07Å; L112-W147 HydrophobicContact CD1-CZ2 3.83Å; L112-W147 HydrophobicContact CD2-CH2 3.92Å; L112-W147 HydrophobicContact CD2-CZ2 3.73Å; L112-W147 HydrophobicContact CG-CH2 4.31Å; L112-W147 HydrophobicContact CG-CZ2 3.68Å; L112-E149 HydrophobicContact CD1-CB 4.38Å; L112-F153 HydrophobicContact CB-CD2 4.34Å; L112-F153 HydrophobicContact CD1-CB 4.07Å; L112-F153 HydrophobicContact CD1-CG 4.46Å; L112-F153 HydrophobicContact CD2-CB 4.04Å; L112-F153 HydrophobicContact CD2-CD1 3.77Å; L112-F153 HydrophobicContact CD2-CD2 4.31Å; L112-F153 HydrophobicContact CD2-CE1 4.34Å; L112-F153 HydrophobicContact CD2-CG 3.76Å; L112-F153 HydrophobicContact CG-CG 4.47Å
113	M	95.1	Very high	93.2	Very high	97 Å²	97	47.9 Å²	47.9	48%	0.478	27%	0.268	S	S	.	.	H	α-helix	trans	-65.4	-39.9	177.2	-170.9	66.6	137.4	0	0	112.1	S109 E110 L111 I115 Q116 M117	S109-M113 WeakPolarHBondContact O-CB 3.33Å; S109-M113 PolarHBondContact O-N 3.47Å; S109-M113 VanDerWaalsContact O-N 3.1Å; E110-M113 WeakPolarHBondContact O-CB 3.31Å; E110-M113 PolarHBondContact O-N 2.96Å; L111-M113 VanDerWaalsContact C-N 3.29Å; L111-M113 PolarHBondContact O-N 3.08Å; M113-I115 VanDerWaalsContact C-N 3.34Å; M113-Q116 PolarHBondContact O-N 3.15Å; M113-M117 HydrophobicContact CE-SD 4.48Å; M113-M117 HydrophobicContact CG-CE 3.76Å; M113-M117 HydrophobicContact CG-CG 4.49Å; M113-M117 HydrophobicContact CG-SD 4.08Å; M113-M117 WeakPolarHBondContact O-CG 3.33Å; M113-M117 PolarHBondContact O-N 2.96Å; M113-M117 HydrophobicContact SD-CG 4.45Å; M113-M117 HydrophobicContact SD-SD 4.31Å
114	I	95.8	Very high	93.4	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.036	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-48	175.4	-67.3	163.7	0	0	0	109.4	L64 I67 R68 E110 L111 Q116 M117 E118 V127	L64-I114 HydrophobicContact CD1-CD1 3.54Å; L64-I114 HydrophobicContact CG-CD1 4.32Å; I67-I114 HydrophobicContact CG2-CD1 4.29Å; I67-I114 HydrophobicContact CG2-CG2 3.98Å; R68-I114 HydrophobicContact CB-CD1 4.04Å; R68-I114 HydrophobicContact CB-CG1 4.2Å; R68-I114 HydrophobicContact CG-CG1 4.33Å; E110-I114 VanDerWaalsContact O-CG1 3.27Å; E110-I114 WeakPolarHBondContact O-CG1 3.42Å; E110-I114 PolarHBondContact O-N 2.67Å; L111-I114 PolarHBondContact O-N 3.1Å; I114-Q116 VanDerWaalsContact C-N 3.27Å; I114-Q116 PolarHBondContact O-N 3.44Å; I114-M117 PolarHBondContact O-N 3.4Å; I114-E118 WeakPolarHBondContact O-CB 3.45Å; I114-E118 PolarHBondContact O-N 2.89Å; I114-V127 HydrophobicContact CB-CG1 4.19Å; I114-V127 HydrophobicContact CG2-CB 4.36Å; I114-V127 HydrophobicContact CG2-CG1 3.83Å; I114-V127 HydrophobicContact CG2-CG2 3.9Å
115	I	95.9	Very high	93.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-40.3	177.8	-60.8	168.6	0	0	0	111.4	L111 L112 M113 V127 A131 F153 A168 I172	L111-I115 WeakPolarHBondContact O-CG1 3.4Å; L111-I115 PolarHBondContact O-N 3.49Å; L111-I115 VanDerWaalsContact O-N 3.16Å; L112-I115 PolarHBondContact O-N 3.18Å; M113-I115 VanDerWaalsContact C-N 3.34Å; I115-V127 HydrophobicContact CD1-CG1 4.3Å; I115-V127 HydrophobicContact CG1-CB 4.21Å; I115-V127 HydrophobicContact CG1-CG1 3.63Å; I115-A131 HydrophobicContact CD1-CB 3.91Å; I115-F153 HydrophobicContact CB-CZ 4.12Å; I115-F153 HydrophobicContact CD1-CE1 4.41Å; I115-F153 HydrophobicContact CG2-CE1 4.17Å; I115-F153 HydrophobicContact CG2-CZ 3.64Å; I115-A168 HydrophobicContact CG2-CB 3.52Å; I115-I172 HydrophobicContact CD1-CD1 4Å
116	Q	94.8	Very high	93.3	Very high	100 Å²	100	47.5 Å²	47.5	47%	0.467	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-38.4	179.7	-73.1	178.8	-3.8	0	0	113.9	L112 M113 I114 F153 L165	L112-Q116 WeakPolarHBondContact O-CG 3.37Å; L112-Q116 PolarHBondContact O-N 3.42Å; L112-Q116 VanDerWaalsContact O-N 3.07Å; M113-Q116 PolarHBondContact O-N 3.15Å; I114-Q116 VanDerWaalsContact C-N 3.27Å; I114-Q116 PolarHBondContact O-N 3.44Å; Q116-F153 HydrophobicContact CG-CD2 4.5Å; Q116-F153 HydrophobicContact CG-CE2 3.65Å; Q116-F153 HydrophobicContact CG-CZ 4.49Å; Q116-L165 HydrophobicContact CG-CD2 4.18Å
117	M	93.6	Very high	93.4	Very high	108 Å²	108	45.6 Å²	45.6	53%	0.532	24%	0.24	S	C	.	.	H	α-helix	trans	-86.9	-14.9	-177.4	-63.2	-174.4	-53.8	0	0	113	M113 I114	M113-M117 HydrophobicContact CE-SD 4.48Å; M113-M117 HydrophobicContact CG-CE 3.76Å; M113-M117 HydrophobicContact CG-CG 4.49Å; M113-M117 HydrophobicContact CG-SD 4.08Å; M113-M117 WeakPolarHBondContact O-CG 3.33Å; M113-M117 PolarHBondContact O-N 2.96Å; M113-M117 HydrophobicContact SD-CG 4.45Å; M113-M117 HydrophobicContact SD-SD 4.31Å; I114-M117 PolarHBondContact O-N 3.4Å
118	E	94.9	Very high	93.5	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.047	24%	0.238	C	C	.	.			trans	-67.4	138.2	-173.3	-167.8	53.1	-99.1	0	0	112.4	R77 I114 Q120 M123 R124	R77-E118 IonicContact CZ-OE2 3.46Å; R77-E118 IonicContact NH1-OE2 2.7Å; R77-E118 IonicContact NH2-OE2 3.96Å; R77-E118 PolarHBondContact NH2-OE2 3.27Å; I114-E118 WeakPolarHBondContact O-CB 3.45Å; I114-E118 PolarHBondContact O-N 2.89Å; E118-Q120 WeakPolarHBondContact CG-O 3.48Å; E118-Q120 PolarHBondContact OE1-N 2.66Å; E118-M123 HydrophobicContact CG-CB 3.93Å; E118-M123 HydrophobicContact CG-CG 4.15Å; E118-M123 WeakPolarHBondContact OE2-CG 3.45Å; E118-R124 HydrophobicContact CB-CB 4.41Å; E118-R124 HydrophobicContact CG-CB 4.01Å; E118-R124 PolarHBondContact O-NH2 2.82Å
119	T	89.7	Confident	93.3	Very high	113 Å²	113	44.7 Å²	44.7	69%	0.693	24%	0.237	S	C	*	.			trans	-109.1	-32.6	-179.4	56.9	0	0	0	0	111.7
120	Q	91.5	Very high	93.3	Very high	107 Å²	107	41.3 Å²	41.3	50%	0.5	21%	0.213	S	C	.	.			trans	-81.8	123	179.7	-62.5	-62	-29.5	0	0	110.6	E118 S122 M123 R124	E118-Q120 WeakPolarHBondContact CG-O 3.48Å; E118-Q120 PolarHBondContact OE1-N 2.66Å; Q120-S122 VanDerWaalsContact C-N 3.32Å; Q120-S122 PolarHBondContact O-N 3.47Å; Q120-M123 HydrophobicContact CB-CB 4.16Å; Q120-M123 PolarHBondContact O-N 3.36Å; Q120-R124 WeakPolarHBondContact O-CB 3.24Å; Q120-R124 PolarHBondContact O-N 2.96Å
121	S	88.8	Confident	93.3	Very high	45 Å²	45	39.1 Å²	39.1	32%	0.315	20%	0.203	S	C	.	.	H	α-helix	trans	-60.7	-39.6	179	172.2	0	0	0	0	111.9	M123 R124 K125 E167	S121-M123 PolarHBondContact O-N 3.4Å; S121-R124 WeakPolarHBondContact O-CB 3.29Å; S121-R124 PolarHBondContact O-N 3.13Å; S121-K125 WeakPolarHBondContact O-CG 3.3Å; S121-K125 PolarHBondContact O-N 3.37Å; S121-E167 PolarHBondContact OG-OE1 2.85Å
122	S	89.6	Confident	93.2	Very high	55 Å²	55	39.1 Å²	39.1	39%	0.385	20%	0.203	S	C	.	.	H	α-helix	trans	-58	-50.7	177.4	-179.8	0	0	0	0	112.5	Q120 R124 K125 K126	Q120-S122 VanDerWaalsContact C-N 3.32Å; Q120-S122 PolarHBondContact O-N 3.47Å; S122-R124 VanDerWaalsContact C-N 3.35Å; S122-R124 PolarHBondContact O-N 3.37Å; S122-K125 PolarHBondContact O-N 3.36Å; S122-K126 PolarHBondContact O-N 3.06Å
123	M	92.6	Very high	92.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-40.7	176.8	-168.9	59.5	56.9	0	0	112	I67 E74 R77 Q78 A81 E118 Q120 S121 K125 K126 V127	I67-M123 HydrophobicContact CG2-SD 4.36Å; E74-M123 VanDerWaalsContact OE1-CE 3.23Å; E74-M123 WeakPolarHBondContact OE1-CE 3.47Å; R77-M123 HydrophobicContact CB-CE 3.44Å; R77-M123 VanDerWaalsContact CB-CE 3.44Å; R77-M123 HydrophobicContact CB-SD 4.3Å; Q78-M123 HydrophobicContact CB-CE 4.31Å; Q78-M123 HydrophobicContact CG-CE 3.52Å; A81-M123 HydrophobicContact CB-SD 4.17Å; E118-M123 HydrophobicContact CG-CB 3.93Å; E118-M123 HydrophobicContact CG-CG 4.15Å; E118-M123 WeakPolarHBondContact OE2-CG 3.45Å; Q120-M123 HydrophobicContact CB-CB 4.16Å; Q120-M123 PolarHBondContact O-N 3.36Å; S121-M123 PolarHBondContact O-N 3.4Å; M123-K125 VanDerWaalsContact C-N 3.3Å; M123-K125 PolarHBondContact O-N 3.28Å; M123-K126 PolarHBondContact O-N 3.13Å; M123-V127 HydrophobicContact CG-CG2 4.32Å; M123-V127 WeakPolarHBondContact O-CG2 3.44Å; M123-V127 PolarHBondContact O-N 3.46Å; M123-V127 HydrophobicContact SD-CG2 4.35Å
124	R	94	Very high	92.9	Very high	20 Å²	20	34 Å²	34	8%	0.075	18%	0.178	C	C	.	.	H	α-helix	trans	-56.4	-45.2	178.2	-170.6	-164.5	-51	-94.3	-12.6	111.2	E118 Q120 S121 S122 V127 C128 G164 A168	E118-R124 HydrophobicContact CB-CB 4.41Å; E118-R124 HydrophobicContact CG-CB 4.01Å; E118-R124 PolarHBondContact O-NH2 2.82Å; Q120-R124 WeakPolarHBondContact O-CB 3.24Å; Q120-R124 PolarHBondContact O-N 2.96Å; S121-R124 WeakPolarHBondContact O-CB 3.29Å; S121-R124 PolarHBondContact O-N 3.13Å; S122-R124 VanDerWaalsContact C-N 3.35Å; S122-R124 PolarHBondContact O-N 3.37Å; R124-V127 PolarHBondContact O-N 3.01Å; R124-C128 WeakPolarHBondContact O-CB 3.19Å; R124-C128 PolarHBondContact O-N 3.26Å; R124-C128 PolarHBondContact O-SG 3.03Å; R124-G164 VanDerWaalsContact CD-O 3.25Å; R124-G164 WeakPolarHBondContact CD-O 3.32Å; R124-G164 VanDerWaalsContact NH1-CA 3.33Å; R124-G164 PolarHBondContact NH1-O 2.8Å; R124-G164 VanDerWaalsContact NH1-O 3.1Å; R124-A168 HydrophobicContact CG-CB 4.21Å
125	K	90.8	Very high	92.7	Very high	86 Å²	86	33.7 Å²	33.7	37%	0.374	18%	0.176	S	C	.	.	H	α-helix	trans	-59.8	-53.4	176.1	-69.8	177.2	-176.5	-177.1	0	111.3	S121 S122 M123 V127 C128 D129 E167	S121-K125 WeakPolarHBondContact O-CG 3.3Å; S121-K125 PolarHBondContact O-N 3.37Å; S122-K125 PolarHBondContact O-N 3.36Å; M123-K125 VanDerWaalsContact C-N 3.3Å; M123-K125 PolarHBondContact O-N 3.28Å; K125-V127 VanDerWaalsContact C-N 3.29Å; K125-V127 PolarHBondContact O-N 2.91Å; K125-C128 CarbonylContact O-C 3.54Å; K125-C128 WeakPolarHBondContact O-CA 3.49Å; K125-C128 VanDerWaalsContact O-CB 3.27Å; K125-C128 WeakPolarHBondContact O-CB 3.48Å; K125-C128 PolarHBondContact O-N 3.2Å; K125-D129 PolarHBondContact O-N 3.44Å; K125-E167 WeakPolarHBondContact CE-OE1 3.35Å
126	K	91.4	Very high	92.4	Very high	31 Å²	31	35.4 Å²	35.4	14%	0.135	18%	0.183	C	C	.	.	H	α-helix	trans	-56.8	-39	179.3	-66.5	-176.8	-179.8	-67.7	0	113.4	Q78 A81 V82 S122 M123 D129 I130	Q78-K126 HydrophobicContact CB-CD 4.38Å; Q78-K126 HydrophobicContact CG-CD 4.38Å; A81-K126 HydrophobicContact CB-CB 3.78Å; A81-K126 HydrophobicContact CB-CD 4.28Å; V82-K126 HydrophobicContact CG2-CD 4.2Å; S122-K126 PolarHBondContact O-N 3.06Å; M123-K126 PolarHBondContact O-N 3.13Å; K126-D129 WeakPolarHBondContact CA-OD2 3.4Å; K126-D129 PolarHBondContact O-N 2.87Å; K126-I130 WeakPolarHBondContact O-CG1 3.32Å; K126-I130 PolarHBondContact O-N 2.95Å
127	V	95.1	Very high	92.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-75	-31.6	176.5	-175.9	0	0	0	0	111.9	I67 L111 I114 I115 M123 R124 K125 D129 I130 A131	I67-V127 HydrophobicContact CG2-CG2 3.64Å; L111-V127 HydrophobicContact CD2-CG1 4.14Å; I114-V127 HydrophobicContact CB-CG1 4.19Å; I114-V127 HydrophobicContact CG2-CB 4.36Å; I114-V127 HydrophobicContact CG2-CG1 3.83Å; I114-V127 HydrophobicContact CG2-CG2 3.9Å; I115-V127 HydrophobicContact CD1-CG1 4.3Å; I115-V127 HydrophobicContact CG1-CB 4.21Å; I115-V127 HydrophobicContact CG1-CG1 3.63Å; M123-V127 HydrophobicContact CG-CG2 4.32Å; M123-V127 WeakPolarHBondContact O-CG2 3.44Å; M123-V127 PolarHBondContact O-N 3.46Å; M123-V127 HydrophobicContact SD-CG2 4.35Å; R124-V127 PolarHBondContact O-N 3.01Å; K125-V127 VanDerWaalsContact C-N 3.29Å; K125-V127 PolarHBondContact O-N 2.91Å; V127-D129 VanDerWaalsContact C-N 3.31Å; V127-I130 PolarHBondContact O-N 2.99Å; V127-A131 PolarHBondContact O-N 3.18Å
128	C	94.8	Very high	92.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-38	169.8	-69.8	0	0	0	0	111.6	R124 K125 A131 A132 A168 H171 I172	R124-C128 WeakPolarHBondContact O-CB 3.19Å; R124-C128 PolarHBondContact O-N 3.26Å; R124-C128 PolarHBondContact O-SG 3.03Å; K125-C128 CarbonylContact O-C 3.54Å; K125-C128 WeakPolarHBondContact O-CA 3.49Å; K125-C128 VanDerWaalsContact O-CB 3.27Å; K125-C128 WeakPolarHBondContact O-CB 3.48Å; K125-C128 PolarHBondContact O-N 3.2Å; C128-A131 PolarHBondContact O-N 3.45Å; C128-A132 PolarHBondContact O-N 3.13Å; C128-A168 VanDerWaalsContact SG-CB 3.56Å; C128-H171 HydrophobicContact CB-CB 4.12Å; C128-I172 HydrophobicContact CB-CD1 4.44Å; C128-I172 HydrophobicContact CB-CG1 3.7Å
129	D	91.3	Very high	91.9	Very high	22 Å²	22	30 Å²	30	12%	0.118	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-43.4	175	-57.7	-38.3	0	0	0	111.5	R85 K125 K126 V127 A131 A132 E133 H171 N175	R85-D129 HydrophobicContact CG-CB 4.45Å; K125-D129 PolarHBondContact O-N 3.44Å; K126-D129 WeakPolarHBondContact CA-OD2 3.4Å; K126-D129 PolarHBondContact O-N 2.87Å; V127-D129 VanDerWaalsContact C-N 3.31Å; D129-A131 VanDerWaalsContact C-N 3.31Å; D129-A131 PolarHBondContact O-N 2.97Å; D129-A132 PolarHBondContact O-N 3.03Å; D129-E133 WeakPolarHBondContact O-CB 3.49Å; D129-E133 PolarHBondContact O-N 3.35Å; D129-H171 IonicContact OD1-CD2 2.62Å; D129-H171 PolarHBondContact OD1-CD2 3.08Å; D129-H171 IonicContact OD1-NE2 3.63Å; D129-H171 PolarHBondContact OD1-NE2 2.99Å; D129-N175 PolarHBondContact OD1-ND2 2.94Å
130	I	94.1	Very high	91.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-42.7	173.6	-63	158.4	0	0	0	110.9	I67 A81 L84 R85 L88 L111 K126 V127 E133 L134	I67-I130 HydrophobicContact CD1-CD1 3.84Å; A81-I130 HydrophobicContact CB-CD1 4.03Å; A81-I130 WeakPolarHBondContact O-CD1 3.45Å; L84-I130 HydrophobicContact CB-CD1 4.08Å; L84-I130 HydrophobicContact CB-CG1 4.41Å; L84-I130 HydrophobicContact CD2-CD1 3.93Å; L84-I130 HydrophobicContact CD2-CG2 3.89Å; L84-I130 HydrophobicContact CG-CD1 4.16Å; L84-I130 HydrophobicContact CG-CG1 4.34Å; L84-I130 HydrophobicContact CG-CG2 3.94Å; R85-I130 HydrophobicContact CB-CG1 3.95Å; L88-I130 HydrophobicContact CD1-CG2 3.78Å; L111-I130 HydrophobicContact CD1-CG2 4.08Å; L111-I130 HydrophobicContact CD2-CB 4.35Å; L111-I130 HydrophobicContact CD2-CG2 3.65Å; K126-I130 WeakPolarHBondContact O-CG1 3.32Å; K126-I130 PolarHBondContact O-N 2.95Å; V127-I130 PolarHBondContact O-N 2.99Å; I130-E133 PolarHBondContact O-N 2.84Å; I130-L134 WeakPolarHBondContact O-CB 3.4Å; I130-L134 PolarHBondContact O-N 3.24Å
131	A	95.1	Very high	91	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-66	-38	178.6	0	0	0	0	0	112.1	I115 V127 C128 D129 A135 W147 I172	I115-A131 HydrophobicContact CD1-CB 3.91Å; V127-A131 PolarHBondContact O-N 3.18Å; C128-A131 PolarHBondContact O-N 3.45Å; D129-A131 VanDerWaalsContact C-N 3.31Å; D129-A131 PolarHBondContact O-N 2.97Å; A131-A135 WeakPolarHBondContact O-CB 3.3Å; A131-A135 PolarHBondContact O-N 2.95Å; A131-W147 HydrophobicContact CB-CH2 4.39Å; A131-W147 WeakPolarHBondContact O-CZ3 3.39Å; A131-I172 HydrophobicContact CB-CD1 4.22Å; A131-I172 HydrophobicContact CB-CG1 4.41Å
132	A	92.3	Very high	90.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-47.2	175	0	0	0	0	0	111.6	C128 D129 L134 A135 R136 I172 N175 F176	C128-A132 PolarHBondContact O-N 3.13Å; D129-A132 PolarHBondContact O-N 3.03Å; A132-L134 VanDerWaalsContact C-N 3.34Å; A132-L134 PolarHBondContact O-N 3.2Å; A132-A135 WeakPolarHBondContact O-CB 3.46Å; A132-A135 PolarHBondContact O-N 3.43Å; A132-A135 VanDerWaalsContact O-N 3.1Å; A132-R136 PolarHBondContact O-N 3.03Å; A132-I172 HydrophobicContact CB-CG2 4.38Å; A132-N175 HydrophobicContact CB-CB 3.66Å; A132-F176 HydrophobicContact CB-CB 4.1Å
133	E	90.9	Very high	90.4	Very high	9 Å²	9	33.8 Å²	33.8	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-41.4	177.8	-166	67.7	-112.5	0	0	112.1	L88 S89 D129 I130 R136 N137	L88-E133 HydrophobicContact CB-CB 4.42Å; L88-E133 HydrophobicContact CB-CG 3.76Å; S89-E133 WeakPolarHBondContact OG-CG 3.43Å; S89-E133 PolarHBondContact OG-OE2 3.49Å; D129-E133 WeakPolarHBondContact O-CB 3.49Å; D129-E133 PolarHBondContact O-N 3.35Å; I130-E133 PolarHBondContact O-N 2.84Å; E133-R136 PolarHBondContact O-N 2.97Å; E133-R136 IonicContact OE1-CZ 2.7Å; E133-R136 IonicContact OE1-NH1 3.79Å; E133-R136 PolarHBondContact OE1-NH1 3.48Å; E133-R136 IonicContact OE2-NH1 3.49Å; E133-R136 PolarHBondContact OE2-NH1 3.41Å; E133-N137 PolarHBondContact O-N 3.5Å; E133-N137 PolarHBondContact O-ND2 3.35Å
134	L	93.9	Very high	90.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-41.4	174	-177.2	59.7	0	0	0	111.5	L88 F92 Y96 I107 K108 L111 I130 A132 R136 L138 W147	L88-L134 HydrophobicContact CD1-CB 4.11Å; F92-L134 HydrophobicContact CE2-CD1 4.12Å; Y96-L134 HydrophobicContact CD2-CD1 3.9Å; Y96-L134 HydrophobicContact CE2-CD1 3.67Å; Y96-L134 HydrophobicContact CG-CD1 4.46Å; I107-L134 HydrophobicContact CG2-CD2 4.31Å; K108-L134 HydrophobicContact CG-CD2 4.08Å; L111-L134 HydrophobicContact CD1-CD2 3.56Å; I130-L134 WeakPolarHBondContact O-CB 3.4Å; I130-L134 PolarHBondContact O-N 3.24Å; A132-L134 VanDerWaalsContact C-N 3.34Å; A132-L134 PolarHBondContact O-N 3.2Å; L134-R136 VanDerWaalsContact C-N 3.33Å; L134-L138 HydrophobicContact CD1-CD1 3.96Å; L134-L138 HydrophobicContact CD1-CG 4.32Å; L134-L138 HydrophobicContact CG-CD1 3.88Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.17Å; L134-W147 HydrophobicContact CB-CZ3 4.33Å; L134-W147 HydrophobicContact CD2-CH2 4.3Å; L134-W147 HydrophobicContact CD2-CZ3 4.18Å; L134-W147 HydrophobicContact CG-CZ3 4.28Å
135	A	92.6	Very high	89.8	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-37.1	179	0	0	0	0	0	112.4	A131 A132 L138 W147 F176 I179	A131-A135 WeakPolarHBondContact O-CB 3.3Å; A131-A135 PolarHBondContact O-N 2.95Å; A132-A135 WeakPolarHBondContact O-CB 3.46Å; A132-A135 PolarHBondContact O-N 3.43Å; A132-A135 VanDerWaalsContact O-N 3.1Å; A135-L138 PolarHBondContact O-N 2.91Å; A135-W147 HydrophobicContact CB-CE3 3.93Å; A135-W147 HydrophobicContact CB-CZ3 4.12Å; A135-F176 HydrophobicContact CB-CD1 4.06Å; A135-F176 HydrophobicContact CB-CE1 4.41Å; A135-I179 HydrophobicContact CB-CD1 3.83Å; A135-I179 HydrophobicContact CB-CG1 4.11Å
136	R	89.7	Confident	89.9	Confident	36 Å²	36	37.8 Å²	37.8	14%	0.136	19%	0.191	C	C	.	.	H	α-helix	trans	-57.5	-51.2	176.6	-176.2	-177.6	-66.6	112.8	6.6	111.6	A132 E133 L134 L138 I139 N175 F176 D682	A132-R136 PolarHBondContact O-N 3.03Å; E133-R136 PolarHBondContact O-N 2.97Å; E133-R136 IonicContact OE1-CZ 2.7Å; E133-R136 IonicContact OE1-NH1 3.79Å; E133-R136 PolarHBondContact OE1-NH1 3.48Å; E133-R136 IonicContact OE2-NH1 3.49Å; E133-R136 PolarHBondContact OE2-NH1 3.41Å; L134-R136 VanDerWaalsContact C-N 3.33Å; R136-L138 PolarHBondContact O-N 2.98Å; R136-I139 PolarHBondContact O-N 3.07Å; R136-N175 PolarHBondContact NH2-O 2.82Å; R136-N175 PolarHBondContact NH2-OD1 3.29Å; R136-N175 VanDerWaalsContact NH2-OD1 3.11Å; R136-F176 VanDerWaalsContact CA-CE1 3.49Å; R136-F176 HydrophobicContact CB-CD1 4.22Å; R136-F176 HydrophobicContact CB-CD2 4.24Å; R136-F176 HydrophobicContact CB-CE1 4.23Å; R136-F176 HydrophobicContact CB-CE2 4.3Å; R136-F176 HydrophobicContact CB-CG 4.23Å; R136-F176 HydrophobicContact CB-CZ 4.3Å; R136-F176 HydrophobicContact CG-CD2 4.27Å; R136-F176 HydrophobicContact CG-CE2 4.12Å; R136-F176 HydrophobicContact CG-CZ 4.42Å; R136-D682 IonicContact CZ-OD1 3.38Å; R136-D682 IonicContact CZ-OD2 2.97Å; R136-D682 IonicContact NE-OD1 3.13Å; R136-D682 PolarHBondContact NE-OD1 3.27Å; R136-D682 IonicContact NE-OD2 3.66Å; R136-D682 PolarHBondContact NE-OD2 3.2Å; R136-D682 IonicContact NH2-OD1 3.41Å; R136-D682 PolarHBondContact NH2-OD1 2.99Å; R136-D682 IonicContact NH2-OD2 2.88Å
137	N	90.6	Very high	90	Very high	52 Å²	52	36.5 Å²	36.5	28%	0.278	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-4.3	-179.3	-67	-66.6	0	0	0	114.1	F92 E133	F92-N137 HydrophobicContact CB-CB 4.37Å; F92-N137 HydrophobicContact CD1-CB 3.68Å; F92-N137 HydrophobicContact CD2-CB 3.38Å; F92-N137 HydrophobicContact CE1-CB 3.68Å; F92-N137 WeakPolarHBondContact CE1-O 3.5Å; F92-N137 HydrophobicContact CE2-CB 3.39Å; F92-N137 HydrophobicContact CG-CB 3.53Å; F92-N137 HydrophobicContact CZ-CB 3.53Å; F92-N137 WeakPolarHBondContact CZ-O 3.39Å; E133-N137 PolarHBondContact O-N 3.5Å; E133-N137 PolarHBondContact O-ND2 3.35Å
138	L	92.7	Very high	89.8	Confident	7 Å²	7	40.1 Å²	40.1	4%	0.037	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	23.4	176.2	-68.9	177.5	0	0	0	112.6	F92 Y96 K108 L134 A135 R136 Q146 W147	F92-L138 HydrophobicContact CZ-CD2 4.14Å; Y96-L138 HydrophobicContact CD1-CD2 4.38Å; Y96-L138 HydrophobicContact CE1-CD2 3.83Å; K108-L138 HydrophobicContact CD-CD1 3.99Å; L134-L138 HydrophobicContact CD1-CD1 3.96Å; L134-L138 HydrophobicContact CD1-CG 4.32Å; L134-L138 HydrophobicContact CG-CD1 3.88Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.17Å; A135-L138 PolarHBondContact O-N 2.91Å; R136-L138 PolarHBondContact O-N 2.98Å; L138-Q146 HydrophobicContact CB-CB 4.38Å; L138-Q146 WeakPolarHBondContact O-CB 3.15Å; L138-Q146 WeakPolarHBondContact O-CG 3.32Å; L138-Q146 PolarHBondContact O-N 3.34Å; L138-W147 HydrophobicContact CD1-CB 3.99Å; L138-W147 HydrophobicContact CD1-CE3 4.39Å; L138-W147 HydrophobicContact CD1-CG 4.42Å
139	I	87.7	Confident	89.7	Confident	45 Å²	45	45 Å²	45	23%	0.231	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-94.8	126.8	163.3	-55.6	-53.6	0	0	0	108.2	R136 N144 N145 F176	R136-I139 PolarHBondContact O-N 3.07Å; I139-N144 WeakPolarHBondContact CA-O 3.49Å; I139-N145 HydrophobicContact CD1-CB 3.63Å; I139-F176 HydrophobicContact CD1-CE1 4.35Å; I139-F176 HydrophobicContact CD1-CZ 4.41Å; I139-F176 HydrophobicContact CG1-CE1 4.14Å; I139-F176 HydrophobicContact CG1-CZ 3.85Å
140	D	83.8	Confident	89.7	Confident	50 Å²	50	44.2 Å²	44.2	27%	0.267	23%	0.229	S	C	.	.			trans	-77.8	171.8	177.6	64.8	23.3	0	0	0	113.3	D142 G143 N144	D140-D142 PolarHBondContact O-N 3.37Å; D140-D142 VanDerWaalsContact OD1-C 3.32Å; D140-D142 WeakPolarHBondContact OD1-CA 3.33Å; D140-D142 WeakPolarHBondContact OD1-CB 3.38Å; D140-D142 PolarHBondContact OD1-N 3.3Å; D140-D142 VanDerWaalsContact OD1-N 3.14Å; D140-G143 WeakPolarHBondContact O-CA 3.3Å; D140-G143 PolarHBondContact O-N 3.07Å; D140-G143 PolarHBondContact OD1-N 3.25Å; D140-N144 PolarHBondContact N-O 3.48Å; D140-N144 WeakPolarHBondContact OD1-CA 3.46Å; D140-N144 WeakPolarHBondContact OD1-CB 3.47Å; D140-N144 PolarHBondContact OD1-N 3.22Å; D140-N144 PolarHBondContact OD1-ND2 3.32Å
141	E	79.5	Confident	89.5	Confident	209 Å²	209	44.8 Å²	44.8	98%	0.977	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.6	177.5	-64	-165.4	165.1	0	0	113	G143	E141-G143 PolarHBondContact O-N 3.32Å
142	D	81.1	Confident	89.3	Confident	124 Å²	124	50.6 Å²	50.6	66%	0.663	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-3.4	173.8	-70.2	-45.5	0	0	0	111.9	D140 N144 N182	D140-D142 PolarHBondContact O-N 3.37Å; D140-D142 VanDerWaalsContact OD1-C 3.32Å; D140-D142 WeakPolarHBondContact OD1-CA 3.33Å; D140-D142 WeakPolarHBondContact OD1-CB 3.38Å; D140-D142 PolarHBondContact OD1-N 3.3Å; D140-D142 VanDerWaalsContact OD1-N 3.14Å; D142-N144 WeakPolarHBondContact CB-ND2 3.35Å; D142-N182 PolarHBondContact O-ND2 3.01Å
143	G	83.8	Confident	89.4	Confident	16 Å²	16	51.1 Å²	51.1	17%	0.165	26%	0.259	C	S	.	.	S	Bend	trans	80.9	22	179.5	0	0	0	0	0	114.5	D140 E141 G181 N182	D140-G143 WeakPolarHBondContact O-CA 3.3Å; D140-G143 PolarHBondContact O-N 3.07Å; D140-G143 PolarHBondContact OD1-N 3.25Å; E141-G143 PolarHBondContact O-N 3.32Å; G143-G181 CarbonylContact O-C 2.99Å; G143-G181 WeakPolarHBondContact O-CA 3.26Å; G143-N182 PolarHBondContact O-N 3.26Å
144	N	87.3	Confident	89.3	Confident	58 Å²	58	50.7 Å²	50.7	31%	0.31	26%	0.257	S	S	.	.			trans	-100.7	139.8	179.4	-53.1	-66.4	0	0	0	112.2	I139 D140 D142	I139-N144 WeakPolarHBondContact CA-O 3.49Å; D140-N144 PolarHBondContact N-O 3.48Å; D140-N144 WeakPolarHBondContact OD1-CA 3.46Å; D140-N144 WeakPolarHBondContact OD1-CB 3.47Å; D140-N144 PolarHBondContact OD1-N 3.22Å; D140-N144 PolarHBondContact OD1-ND2 3.32Å; D142-N144 WeakPolarHBondContact CB-ND2 3.35Å
145	N	88.3	Confident	88.9	Confident	29 Å²	29	52.8 Å²	52.8	16%	0.155	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-78.1	122.5	176.7	-173.2	-50.4	0	0	0	111.8	I139 W147 L151 I179	I139-N145 HydrophobicContact CD1-CB 3.63Å; N145-W147 WeakPolarHBondContact OD1-CA 3.49Å; N145-W147 PolarHBondContact OD1-N 2.68Å; N145-W147 PolarHBondContact OD1-O 2.91Å; N145-L151 HydrophobicContact CB-CD1 4.26Å; N145-I179 PolarHBondContact ND2-O 3.33Å
146	Q	91.3	Very high	88.8	Confident	103 Å²	103	57 Å²	57	48%	0.481	29%	0.289	S	S	.	.	S	Bend	trans	-88.3	-1.1	179.8	-57.5	-179.5	-14	0	0	114	L138 P148	L138-Q146 HydrophobicContact CB-CB 4.38Å; L138-Q146 WeakPolarHBondContact O-CB 3.15Å; L138-Q146 WeakPolarHBondContact O-CG 3.32Å; L138-Q146 PolarHBondContact O-N 3.34Å; Q146-P148 VanDerWaalsContact C-CD 3.46Å; Q146-P148 WeakPolarHBondContact O-CD 3.45Å
147	W	94.2	Very high	88.9	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.015	28%	0.284	C	S	.	.			trans	-121.4	69.2	179.9	-169.1	17.7	0	0	0	113.2	K108 L112 A131 L134 A135 L138 N145 E149 G150	K108-W147 HydrophobicContact CB-CZ2 3.96Å; K108-W147 HydrophobicContact CD-CB 4.4Å; K108-W147 HydrophobicContact CD-CD2 4.14Å; K108-W147 HydrophobicContact CD-CG 3.82Å; K108-W147 HydrophobicContact CG-CD2 4.26Å; K108-W147 HydrophobicContact CG-CG 4.43Å; K108-W147 HydrophobicContact CG-CZ2 4.26Å; K108-W147 WeakPolarHBondContact O-CZ2 3.33Å; L112-W147 HydrophobicContact CD1-CZ2 3.83Å; L112-W147 HydrophobicContact CD2-CH2 3.92Å; L112-W147 HydrophobicContact CD2-CZ2 3.73Å; L112-W147 HydrophobicContact CG-CH2 4.31Å; L112-W147 HydrophobicContact CG-CZ2 3.68Å; A131-W147 HydrophobicContact CB-CH2 4.39Å; A131-W147 WeakPolarHBondContact O-CZ3 3.39Å; L134-W147 HydrophobicContact CB-CZ3 4.33Å; L134-W147 HydrophobicContact CD2-CH2 4.3Å; L134-W147 HydrophobicContact CD2-CZ3 4.18Å; L134-W147 HydrophobicContact CG-CZ3 4.28Å; A135-W147 HydrophobicContact CB-CE3 3.93Å; A135-W147 HydrophobicContact CB-CZ3 4.12Å; L138-W147 HydrophobicContact CD1-CB 3.99Å; L138-W147 HydrophobicContact CD1-CE3 4.39Å; L138-W147 HydrophobicContact CD1-CG 4.42Å; N145-W147 WeakPolarHBondContact OD1-CA 3.49Å; N145-W147 PolarHBondContact OD1-N 2.68Å; N145-W147 PolarHBondContact OD1-O 2.91Å; W147-E149 VanDerWaalsContact CD1-OE2 3.3Å; W147-E149 PolarHBondContact O-N 3.23Å; W147-G150 PolarHBondContact O-N 2.91Å
148	P	90.2	Very high	88.5	Confident	77 Å²	77	53.9 Å²	53.9	50%	0.5	28%	0.276	S	S	.	.	H	α-helix	trans	-63.5	-25.7	-179.2	27	-35.4	0	0	0	113.5	Q146 G150 L151 K152	Q146-P148 VanDerWaalsContact C-CD 3.46Å; Q146-P148 WeakPolarHBondContact O-CD 3.45Å; P148-G150 VanDerWaalsContact C-N 3.3Å; P148-G150 PolarHBondContact O-N 3.09Å; P148-L151 PolarHBondContact O-N 2.53Å; P148-K152 WeakPolarHBondContact O-CB 3.4Å; P148-K152 PolarHBondContact O-N 2.79Å
149	E	93.6	Very high	88.1	Confident	101 Å²	101	58.5 Å²	58.5	47%	0.472	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-33.1	175	-59.3	85.1	171.9	0	0	112.3	L112 W147 K152 F153	L112-E149 HydrophobicContact CD1-CB 4.38Å; W147-E149 VanDerWaalsContact CD1-OE2 3.3Å; W147-E149 PolarHBondContact O-N 3.23Å; E149-K152 PolarHBondContact O-N 3.37Å; E149-F153 WeakPolarHBondContact O-CB 3.38Å; E149-F153 PolarHBondContact O-N 3.33Å
150	G	92.1	Very high	88.2	Confident	6 Å²	6	58 Å²	58	6%	0.062	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-44.8	173.7	0	0	0	0	0	111.7	W147 P148 K152 F153 L154	W147-G150 PolarHBondContact O-N 2.91Å; P148-G150 VanDerWaalsContact C-N 3.3Å; P148-G150 PolarHBondContact O-N 3.09Å; G150-K152 PolarHBondContact O-N 3.39Å; G150-F153 WeakPolarHBondContact O-CB 3.42Å; G150-F153 PolarHBondContact O-N 3.32Å; G150-L154 PolarHBondContact O-N 3.49Å
151	L	88.6	Confident	88.3	Confident	12 Å²	12	64.7 Å²	64.7	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-45.5	173.5	-73.4	-179.9	0	0	0	112.1	N145 P148 F153 L154 F155 I179 F180	N145-L151 HydrophobicContact CB-CD1 4.26Å; P148-L151 PolarHBondContact O-N 2.53Å; L151-F153 VanDerWaalsContact C-N 3.32Å; L151-F153 PolarHBondContact O-N 3.16Å; L151-L154 WeakPolarHBondContact O-CB 3.38Å; L151-L154 PolarHBondContact O-N 3.45Å; L151-F155 WeakPolarHBondContact O-CD2 3.47Å; L151-F155 PolarHBondContact O-N 3.12Å; L151-I179 HydrophobicContact CD2-CB 4.19Å; L151-I179 HydrophobicContact CD2-CD1 4.16Å; L151-I179 HydrophobicContact CD2-CG1 3.74Å; L151-I179 HydrophobicContact CD2-CG2 3.69Å; L151-I179 HydrophobicContact CG-CG1 4.49Å; L151-F180 HydrophobicContact CD1-CD1 4.48Å; L151-F180 HydrophobicContact CD2-CD1 3.53Å; L151-F180 HydrophobicContact CD2-CE1 3.56Å; L151-F180 HydrophobicContact CD2-CG 4.36Å; L151-F180 HydrophobicContact CD2-CZ 4.42Å
152	K	90.3	Very high	88.8	Confident	124 Å²	124	58.5 Å²	58.5	54%	0.539	31%	0.313	S	S	.	.	H	α-helix	trans	-59.5	-44.1	176.1	177.1	165.7	175.4	46.4	0	111.6	P148 E149 G150 L154 F155 D156	P148-K152 WeakPolarHBondContact O-CB 3.4Å; P148-K152 PolarHBondContact O-N 2.79Å; E149-K152 PolarHBondContact O-N 3.37Å; G150-K152 PolarHBondContact O-N 3.39Å; K152-L154 VanDerWaalsContact C-N 3.3Å; K152-L154 PolarHBondContact O-N 2.98Å; K152-F155 PolarHBondContact O-N 2.9Å; K152-D156 WeakPolarHBondContact CE-OD2 3.17Å; K152-D156 WeakPolarHBondContact CG-OD2 3.34Å; K152-D156 IonicContact NZ-OD1 3.91Å; K152-D156 PolarHBondContact NZ-OD1 3.33Å; K152-D156 IonicContact NZ-OD2 3.14Å; K152-D156 PolarHBondContact NZ-OD2 2.94Å; K152-D156 WeakPolarHBondContact O-CB 3.23Å; K152-D156 VanDerWaalsContact O-CG 3.31Å; K152-D156 PolarHBondContact O-N 2.92Å
153	F	94.4	Very high	89.1	Confident	11 Å²	11	54.4 Å²	54.4	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-42.5	177.1	172.3	-96.9	0	0	0	111.9	L112 I115 Q116 E149 G150 L151 S157 L165 I172	L112-F153 HydrophobicContact CB-CD2 4.34Å; L112-F153 HydrophobicContact CD1-CB 4.07Å; L112-F153 HydrophobicContact CD1-CG 4.46Å; L112-F153 HydrophobicContact CD2-CB 4.04Å; L112-F153 HydrophobicContact CD2-CD1 3.77Å; L112-F153 HydrophobicContact CD2-CD2 4.31Å; L112-F153 HydrophobicContact CD2-CE1 4.34Å; L112-F153 HydrophobicContact CD2-CG 3.76Å; L112-F153 HydrophobicContact CG-CG 4.47Å; I115-F153 HydrophobicContact CB-CZ 4.12Å; I115-F153 HydrophobicContact CD1-CE1 4.41Å; I115-F153 HydrophobicContact CG2-CE1 4.17Å; I115-F153 HydrophobicContact CG2-CZ 3.64Å; Q116-F153 HydrophobicContact CG-CD2 4.5Å; Q116-F153 HydrophobicContact CG-CE2 3.65Å; Q116-F153 HydrophobicContact CG-CZ 4.49Å; E149-F153 WeakPolarHBondContact O-CB 3.38Å; E149-F153 PolarHBondContact O-N 3.33Å; G150-F153 WeakPolarHBondContact O-CB 3.42Å; G150-F153 PolarHBondContact O-N 3.32Å; L151-F153 VanDerWaalsContact C-N 3.32Å; L151-F153 PolarHBondContact O-N 3.16Å; F153-S157 WeakPolarHBondContact CE2-OG 3.37Å; F153-S157 WeakPolarHBondContact CZ-OG 3.47Å; F153-S157 WeakPolarHBondContact O-CB 3.2Å; F153-S157 PolarHBondContact O-N 3.41Å; F153-S157 PolarHBondContact O-OG 2.77Å; F153-L165 HydrophobicContact CE2-CD2 4.38Å; F153-L165 HydrophobicContact CZ-CD2 4.26Å; F153-I172 HydrophobicContact CD1-CD1 4.26Å; F153-I172 HydrophobicContact CE1-CD1 3.87Å
154	L	90.5	Very high	89.5	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-61.3	-51	179.1	-158.6	159.1	0	0	0	111.1	G150 L151 K152 S157 V158 A169 I172 F173 I179 M194	G150-L154 PolarHBondContact O-N 3.49Å; L151-L154 WeakPolarHBondContact O-CB 3.38Å; L151-L154 PolarHBondContact O-N 3.45Å; K152-L154 VanDerWaalsContact C-N 3.3Å; K152-L154 PolarHBondContact O-N 2.98Å; L154-S157 PolarHBondContact O-N 2.63Å; L154-V158 HydrophobicContact CD2-CG2 4.12Å; L154-V158 VanDerWaalsContact O-CG2 3.24Å; L154-V158 WeakPolarHBondContact O-CG2 3.39Å; L154-V158 PolarHBondContact O-N 3.01Å; L154-A169 HydrophobicContact CD2-CB 4.5Å; L154-A169 HydrophobicContact CG-CB 4.26Å; L154-I172 HydrophobicContact CD1-CG2 4.38Å; L154-F173 HydrophobicContact CD1-CB 4.19Å; L154-I179 HydrophobicContact CD1-CD1 4.36Å; L154-I179 HydrophobicContact CD1-CG2 4.26Å; L154-M194 HydrophobicContact CD2-SD 4.06Å
155	F	84.6	Confident	89.7	Confident	43 Å²	43	52.6 Å²	52.6	19%	0.189	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-43.1	179.4	-70	-58.1	0	0	0	113.7	L151 K152 S157 S159 F180 Y187 V190	L151-F155 WeakPolarHBondContact O-CD2 3.47Å; L151-F155 PolarHBondContact O-N 3.12Å; K152-F155 PolarHBondContact O-N 2.9Å; F155-S157 VanDerWaalsContact C-N 3.32Å; F155-S159 PolarHBondContact O-N 2.94Å; F155-S159 PolarHBondContact O-OG 3.03Å; F155-S159 VanDerWaalsContact O-OG 3.09Å; F155-F180 HydrophobicContact CE1-CE1 4.22Å; F155-F180 HydrophobicContact CE1-CZ 4.5Å; F155-F180 AromaticContact CE2-CE1 3.91Å; F155-F180 HydrophobicContact CE2-CE1 3.91Å; F155-F180 HydrophobicContact CZ-CD1 4.3Å; F155-F180 AromaticContact CZ-CE1 3.42Å; F155-F180 HydrophobicContact CZ-CE1 3.42Å; F155-F180 VanDerWaalsContact CZ-CE1 3.42Å; F155-F180 HydrophobicContact CZ-CZ 4.11Å; F155-Y187 HydrophobicContact CE1-CD1 4.33Å; F155-Y187 AromaticContact CE2-CD1 3.89Å; F155-Y187 HydrophobicContact CE2-CD1 3.89Å; F155-Y187 AromaticContact CE2-CE1 3.9Å; F155-Y187 HydrophobicContact CE2-CE1 3.9Å; F155-Y187 HydrophobicContact CE2-CG 4.41Å; F155-Y187 AromaticContact CZ-CD1 3.44Å; F155-Y187 HydrophobicContact CZ-CD1 3.44Å; F155-Y187 VanDerWaalsContact CZ-CD1 3.44Å; F155-Y187 AromaticContact CZ-CE1 3.94Å; F155-Y187 HydrophobicContact CZ-CE1 3.94Å; F155-Y187 AromaticContact CZ-CG 3.81Å; F155-Y187 HydrophobicContact CZ-CG 3.81Å; F155-V190 HydrophobicContact CD1-CG1 3.82Å; F155-V190 HydrophobicContact CE1-CB 4.2Å; F155-V190 HydrophobicContact CE1-CG1 3.52Å
156	D	89.9	Confident	89.8	Confident	89 Å²	89	53.1 Å²	53.1	48%	0.476	28%	0.281	S	S	.	.	H	α-helix	trans	-66.5	-37.7	179	-70.7	-17	0	0	0	110.7	K152 S159 S160	K152-D156 WeakPolarHBondContact CE-OD2 3.17Å; K152-D156 WeakPolarHBondContact CG-OD2 3.34Å; K152-D156 IonicContact NZ-OD1 3.91Å; K152-D156 PolarHBondContact NZ-OD1 3.33Å; K152-D156 IonicContact NZ-OD2 3.14Å; K152-D156 PolarHBondContact NZ-OD2 2.94Å; K152-D156 WeakPolarHBondContact O-CB 3.23Å; K152-D156 VanDerWaalsContact O-CG 3.31Å; K152-D156 PolarHBondContact O-N 2.92Å; D156-S159 PolarHBondContact O-N 3.4Å; D156-S160 PolarHBondContact O-N 2.98Å
157	S	91.9	Very high	89.8	Confident	5 Å²	5	49.3 Å²	49.3	4%	0.035	26%	0.263	C	S	.	.	H	α-helix	trans	-73.5	-37.5	-177.7	-65.4	0	0	0	0	113.1	F153 L154 F155 S159 S160 L165 R166	F153-S157 WeakPolarHBondContact CE2-OG 3.37Å; F153-S157 WeakPolarHBondContact CZ-OG 3.47Å; F153-S157 WeakPolarHBondContact O-CB 3.2Å; F153-S157 PolarHBondContact O-N 3.41Å; F153-S157 PolarHBondContact O-OG 2.77Å; L154-S157 PolarHBondContact O-N 2.63Å; F155-S157 VanDerWaalsContact C-N 3.32Å; S157-S159 VanDerWaalsContact C-N 3.28Å; S157-S159 PolarHBondContact O-N 3.38Å; S157-S160 WeakPolarHBondContact O-CB 3.03Å; S157-S160 PolarHBondContact O-N 3.33Å; S157-S160 VanDerWaalsContact O-N 3.16Å; S157-L165 WeakPolarHBondContact CB-O 3.42Å; S157-R166 WeakPolarHBondContact O-CG 3.39Å
158	V	83.6	Confident	89.8	Confident	17 Å²	17	49.2 Å²	49.2	10%	0.103	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-38.2	172.6	165	0	0	0	0	111.9	L154 S160 R166 A169 M194	L154-V158 HydrophobicContact CD2-CG2 4.12Å; L154-V158 VanDerWaalsContact O-CG2 3.24Å; L154-V158 WeakPolarHBondContact O-CG2 3.39Å; L154-V158 PolarHBondContact O-N 3.01Å; V158-S160 PolarHBondContact O-N 2.92Å; V158-R166 WeakPolarHBondContact O-CD 3.26Å; V158-R166 WeakPolarHBondContact O-CG 3.46Å; V158-A169 HydrophobicContact CG2-CB 3.63Å; V158-M194 HydrophobicContact CB-CG 4.32Å; V158-M194 HydrophobicContact CB-SD 4.25Å; V158-M194 HydrophobicContact CG1-CB 3.87Å; V158-M194 HydrophobicContact CG1-CG 3.47Å; V158-M194 VanDerWaalsContact CG1-CG 3.47Å; V158-M194 HydrophobicContact CG1-SD 4.01Å; V158-M194 HydrophobicContact CG2-CG 3.86Å; V158-M194 HydrophobicContact CG2-SD 3.32Å; V158-M194 WeakPolarHBondContact CG2-SD 3.27Å
159	S	83.8	Confident	89.9	Confident	104 Å²	104	45.5 Å²	45.5	73%	0.727	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-2.9	-180	-54.6	0	0	0	0	113	F155 D156 S157	F155-S159 PolarHBondContact O-N 2.94Å; F155-S159 PolarHBondContact O-OG 3.03Å; F155-S159 VanDerWaalsContact O-OG 3.09Å; D156-S159 PolarHBondContact O-N 3.4Å; S157-S159 VanDerWaalsContact C-N 3.28Å; S157-S159 PolarHBondContact O-N 3.38Å
160	S	89.3	Confident	89.9	Confident	34 Å²	34	40.7 Å²	40.7	24%	0.238	22%	0.216	C	C	.	.			trans	-75.6	145.3	-176.3	-172.2	0	0	0	0	112.1	D156 S157 V158 N162 R166	D156-S160 PolarHBondContact O-N 2.98Å; S157-S160 WeakPolarHBondContact O-CB 3.03Å; S157-S160 PolarHBondContact O-N 3.33Å; S157-S160 VanDerWaalsContact O-N 3.16Å; V158-S160 PolarHBondContact O-N 2.92Å; S160-N162 PolarHBondContact O-N 3.33Å; S160-N162 PolarHBondContact OG-N 2.89Å; S160-R166 WeakPolarHBondContact O-CD 3.43Å; S160-R166 WeakPolarHBondContact O-CG 3.32Å; S160-R166 PolarHBondContact O-NE 3.23Å
161	Q	86.6	Confident	89.9	Confident	191 Å²	191	41 Å²	41	89%	0.893	22%	0.216	S	C	*	.	S	Bend	trans	-71.4	-15	169.8	-65.7	-179	3.3	0	0	112.3	V163	Q161-V163 PolarHBondContact O-N 2.83Å
162	N	89.5	Confident	90.1	Very high	80 Å²	80	40.9 Å²	40.9	43%	0.428	22%	0.215	S	C	.	.			trans	-77.1	111.6	177.2	-173.6	-29.7	0	0	0	110.2	S160 G164 L165 R166	S160-N162 PolarHBondContact O-N 3.33Å; S160-N162 PolarHBondContact OG-N 2.89Å; N162-G164 VanDerWaalsContact C-N 3.25Å; N162-G164 PolarHBondContact O-N 2.93Å; N162-G164 PolarHBondContact OD1-N 3.42Å; N162-L165 HydrophobicContact CB-CB 4.18Å; N162-L165 HydrophobicContact CB-CD1 4.07Å; N162-L165 HydrophobicContact CB-CG 4.15Å; N162-L165 PolarHBondContact O-N 3.43Å; N162-L165 PolarHBondContact OD1-N 2.9Å; N162-R166 PolarHBondContact O-N 2.46Å; N162-R166 VanDerWaalsContact O-N 3.12Å
163	V	88.4	Confident	90.3	Very high	38 Å²	38	35 Å²	35	23%	0.23	19%	0.189	C	C	.	.	H	α-helix	trans	-54.1	-42	178.3	-179.8	0	0	0	0	111.6	Q161 L165 R166 E167 H204 I207	Q161-V163 PolarHBondContact O-N 2.83Å; V163-L165 VanDerWaalsContact C-N 3.3Å; V163-L165 PolarHBondContact O-N 2.72Å; V163-R166 PolarHBondContact O-N 2.94Å; V163-E167 WeakPolarHBondContact O-CB 3.28Å; V163-E167 PolarHBondContact O-N 3.21Å; V163-H204 WeakPolarHBondContact CG2-NE2 3.43Å; V163-I207 HydrophobicContact CG1-CD1 4.12Å; V163-I207 HydrophobicContact CG1-CG1 4.01Å
164	G	90.7	Very high	90.1	Very high	10 Å²	10	35.6 Å²	35.6	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-67.4	-28.1	-179.8	0	0	0	0	0	113.6	R124 N162 A168	R124-G164 VanDerWaalsContact CD-O 3.25Å; R124-G164 WeakPolarHBondContact CD-O 3.32Å; R124-G164 VanDerWaalsContact NH1-CA 3.33Å; R124-G164 PolarHBondContact NH1-O 2.8Å; R124-G164 VanDerWaalsContact NH1-O 3.1Å; N162-G164 VanDerWaalsContact C-N 3.25Å; N162-G164 PolarHBondContact O-N 2.93Å; N162-G164 PolarHBondContact OD1-N 3.42Å; G164-A168 WeakPolarHBondContact O-CB 3.28Å; G164-A168 PolarHBondContact O-N 3.3Å
165	L	92.4	Very high	90.1	Very high	25 Å²	25	35.9 Å²	35.9	13%	0.131	19%	0.193	C	C	.	.	H	α-helix	trans	-76.1	-37.7	172.5	-74.3	178.7	0	0	0	111.6	Q116 F153 S157 N162 V163 E167 A168 A169	Q116-L165 HydrophobicContact CG-CD2 4.18Å; F153-L165 HydrophobicContact CE2-CD2 4.38Å; F153-L165 HydrophobicContact CZ-CD2 4.26Å; S157-L165 WeakPolarHBondContact CB-O 3.42Å; N162-L165 HydrophobicContact CB-CB 4.18Å; N162-L165 HydrophobicContact CB-CD1 4.07Å; N162-L165 HydrophobicContact CB-CG 4.15Å; N162-L165 PolarHBondContact O-N 3.43Å; N162-L165 PolarHBondContact OD1-N 2.9Å; V163-L165 VanDerWaalsContact C-N 3.3Å; V163-L165 PolarHBondContact O-N 2.72Å; L165-E167 VanDerWaalsContact C-N 3.34Å; L165-A168 PolarHBondContact O-N 2.87Å; L165-A169 WeakPolarHBondContact O-CB 3.27Å; L165-A169 PolarHBondContact O-N 3.34Å
166	R	90.7	Very high	90.3	Very high	41 Å²	41	34.9 Å²	34.9	16%	0.155	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-44.1	172.6	-67.6	-168.6	-76	148.6	-0.1	111.2	S157 V158 S160 N162 V163 A169 L170 D201 I207	S157-R166 WeakPolarHBondContact O-CG 3.39Å; V158-R166 WeakPolarHBondContact O-CD 3.26Å; V158-R166 WeakPolarHBondContact O-CG 3.46Å; S160-R166 WeakPolarHBondContact O-CD 3.43Å; S160-R166 WeakPolarHBondContact O-CG 3.32Å; S160-R166 PolarHBondContact O-NE 3.23Å; N162-R166 PolarHBondContact O-N 2.46Å; N162-R166 VanDerWaalsContact O-N 3.12Å; V163-R166 PolarHBondContact O-N 2.94Å; R166-A169 PolarHBondContact O-N 3.13Å; R166-L170 WeakPolarHBondContact O-CG 3.45Å; R166-L170 PolarHBondContact O-N 3.2Å; R166-L170 VanDerWaalsContact O-N 3.09Å; R166-D201 IonicContact CZ-OD2 2.79Å; R166-D201 IonicContact NH1-OD2 3.34Å; R166-D201 PolarHBondContact NH1-OD2 3.08Å; R166-D201 IonicContact NH2-OD2 2.76Å; R166-D201 PolarHBondContact NH2-OD2 3.16Å; R166-I207 HydrophobicContact CB-CD1 4.21Å
167	E	90.9	Very high	90.3	Very high	23 Å²	23	30.9 Å²	30.9	11%	0.107	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-49	174	-169.2	-176.7	164.5	0	0	111.1	S121 K125 V163 L165 A169 L170 H171 I207 L210	S121-E167 PolarHBondContact OG-OE1 2.85Å; K125-E167 WeakPolarHBondContact CE-OE1 3.35Å; V163-E167 WeakPolarHBondContact O-CB 3.28Å; V163-E167 PolarHBondContact O-N 3.21Å; L165-E167 VanDerWaalsContact C-N 3.34Å; E167-A169 PolarHBondContact O-N 3.41Å; E167-L170 PolarHBondContact O-N 3.38Å; E167-H171 WeakPolarHBondContact O-CB 3.26Å; E167-H171 PolarHBondContact O-N 3.45Å; E167-I207 HydrophobicContact CB-CD1 3.74Å; E167-I207 HydrophobicContact CG-CD1 4.42Å; E167-L210 HydrophobicContact CG-CD2 3.75Å; E167-L210 VanDerWaalsContact O-CD2 3.25Å; E167-L210 WeakPolarHBondContact O-CD2 3.36Å
168	A	94.1	Very high	90.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-58	-44.9	178.7	0	0	0	0	0	112.9	I115 R124 C128 G164 L165 H171 I172	I115-A168 HydrophobicContact CG2-CB 3.52Å; R124-A168 HydrophobicContact CG-CB 4.21Å; C128-A168 VanDerWaalsContact SG-CB 3.56Å; G164-A168 WeakPolarHBondContact O-CB 3.28Å; G164-A168 PolarHBondContact O-N 3.3Å; L165-A168 PolarHBondContact O-N 2.87Å; A168-H171 WeakPolarHBondContact O-CB 3.24Å; A168-H171 PolarHBondContact O-N 3.13Å; A168-I172 WeakPolarHBondContact O-CG1 3.31Å; A168-I172 PolarHBondContact O-N 2.85Å
169	A	92.9	Very high	90.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.1	-42.5	-179.9	0	0	0	0	0	112.4	L154 V158 L165 R166 E167 H171 F173	L154-A169 HydrophobicContact CD2-CB 4.5Å; L154-A169 HydrophobicContact CG-CB 4.26Å; V158-A169 HydrophobicContact CG2-CB 3.63Å; L165-A169 WeakPolarHBondContact O-CB 3.27Å; L165-A169 PolarHBondContact O-N 3.34Å; R166-A169 PolarHBondContact O-N 3.13Å; E167-A169 PolarHBondContact O-N 3.41Å; A169-H171 VanDerWaalsContact C-N 3.29Å; A169-H171 PolarHBondContact O-N 3.23Å; A169-F173 WeakPolarHBondContact O-CB 3.38Å; A169-F173 PolarHBondContact O-N 3.01Å
170	L	92.4	Very high	90.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.3	-34.3	174	-70.4	172.3	0	0	0	111.8	R166 E167 F173 W174 M194 L195 C198 I207 L210	R166-L170 WeakPolarHBondContact O-CG 3.45Å; R166-L170 PolarHBondContact O-N 3.2Å; R166-L170 VanDerWaalsContact O-N 3.09Å; E167-L170 PolarHBondContact O-N 3.38Å; L170-F173 PolarHBondContact O-N 3.17Å; L170-W174 WeakPolarHBondContact O-CB 3.39Å; L170-W174 PolarHBondContact O-N 3.42Å; L170-M194 HydrophobicContact CD2-CE 4.42Å; L170-M194 HydrophobicContact CD2-CG 4.36Å; L170-M194 HydrophobicContact CD2-SD 4.46Å; L170-L195 HydrophobicContact CD2-CD2 4.27Å; L170-C198 HydrophobicContact CD1-CB 4Å; L170-C198 HydrophobicContact CD2-CB 4.49Å; L170-I207 HydrophobicContact CD1-CG2 3.95Å; L170-L210 HydrophobicContact CB-CD2 3.66Å; L170-L210 HydrophobicContact CB-CG 3.77Å
171	H	92.4	Very high	90.1	Very high	13 Å²	13	25.6 Å²	25.6	6%	0.06	14%	0.137	C	C	.	.	H	α-helix	trans	-67.5	-45.8	178.5	-153.7	79.3	0	0	0	111.8	C128 D129 E167 A168 A169 F173 W174 N175 L210	C128-H171 HydrophobicContact CB-CB 4.12Å; D129-H171 IonicContact OD1-CD2 2.62Å; D129-H171 PolarHBondContact OD1-CD2 3.08Å; D129-H171 IonicContact OD1-NE2 3.63Å; D129-H171 PolarHBondContact OD1-NE2 2.99Å; E167-H171 WeakPolarHBondContact O-CB 3.26Å; E167-H171 PolarHBondContact O-N 3.45Å; A168-H171 WeakPolarHBondContact O-CB 3.24Å; A168-H171 PolarHBondContact O-N 3.13Å; A169-H171 VanDerWaalsContact C-N 3.29Å; A169-H171 PolarHBondContact O-N 3.23Å; H171-F173 VanDerWaalsContact C-N 3.32Å; H171-F173 PolarHBondContact O-N 2.84Å; H171-W174 AromaticContact CE1-CE3 3.73Å; H171-W174 AromaticContact CE1-CZ3 3.34Å; H171-W174 WeakPolarHBondContact CE1-CZ3 3.48Å; H171-W174 AromaticContact ND1-CE3 3.77Å; H171-W174 AromaticContact ND1-CZ3 3.86Å; H171-W174 AromaticContact NE2-CZ3 3.74Å; H171-W174 PolarHBondContact O-N 3.42Å; H171-N175 WeakPolarHBondContact O-CB 3.23Å; H171-N175 PolarHBondContact O-N 2.82Å; H171-L210 HydrophobicContact CB-CD2 4.17Å
172	I	93.5	Very high	89.9	Confident	8 Å²	8	21.8 Å²	21.8	4%	0.041	12%	0.123	C	C	.	.	H	α-helix	trans	-60.5	-45.2	174.3	-65.7	165.3	0	0	0	110.1	I115 C128 A131 A132 F153 L154 A168 N175 F176 I179	I115-I172 HydrophobicContact CD1-CD1 4Å; C128-I172 HydrophobicContact CB-CD1 4.44Å; C128-I172 HydrophobicContact CB-CG1 3.7Å; A131-I172 HydrophobicContact CB-CD1 4.22Å; A131-I172 HydrophobicContact CB-CG1 4.41Å; A132-I172 HydrophobicContact CB-CG2 4.38Å; F153-I172 HydrophobicContact CD1-CD1 4.26Å; F153-I172 HydrophobicContact CE1-CD1 3.87Å; L154-I172 HydrophobicContact CD1-CG2 4.38Å; A168-I172 WeakPolarHBondContact O-CG1 3.31Å; A168-I172 PolarHBondContact O-N 2.85Å; I172-N175 PolarHBondContact O-N 2.78Å; I172-F176 PolarHBondContact O-N 3.32Å; I172-I179 HydrophobicContact CG2-CD1 4.36Å
173	F	93.1	Very high	89.5	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-36.6	179.8	-175.1	-117.8	0	0	0	113.2	L154 A169 L170 H171 F176 P177 F180 I191 M194 L195 A214 F218	L154-F173 HydrophobicContact CD1-CB 4.19Å; A169-F173 WeakPolarHBondContact O-CB 3.38Å; A169-F173 PolarHBondContact O-N 3.01Å; L170-F173 PolarHBondContact O-N 3.17Å; H171-F173 VanDerWaalsContact C-N 3.32Å; H171-F173 PolarHBondContact O-N 2.84Å; F173-F176 CarbonylContact O-C 3.59Å; F173-P177 HydrophobicContact CE2-CB 4.22Å; F173-P177 WeakPolarHBondContact CE2-O 3.42Å; F173-P177 HydrophobicContact CZ-CB 4.44Å; F173-P177 WeakPolarHBondContact O-CA 3.47Å; F173-P177 WeakPolarHBondContact O-CD 3.31Å; F173-P177 WeakPolarHBondContact O-CG 3.29Å; F173-P177 VanDerWaalsContact O-N 3.1Å; F173-F180 HydrophobicContact CD2-CE2 4.1Å; F173-F180 HydrophobicContact CE2-CD2 4.48Å; F173-F180 AromaticContact CE2-CE2 3.62Å; F173-F180 HydrophobicContact CE2-CE2 3.62Å; F173-F180 HydrophobicContact CE2-CZ 4.47Å; F173-I191 HydrophobicContact CE1-CG2 3.99Å; F173-I191 HydrophobicContact CE2-CG2 4.44Å; F173-I191 HydrophobicContact CZ-CG2 3.58Å; F173-M194 HydrophobicContact CD1-CE 3.48Å; F173-M194 VanDerWaalsContact CD1-CE 3.48Å; F173-M194 HydrophobicContact CE1-CE 3.72Å; F173-M194 HydrophobicContact CG-CE 4.01Å; F173-M194 HydrophobicContact CZ-CE 4.41Å; F173-L195 HydrophobicContact CD1-CD2 4.28Å; F173-L195 HydrophobicContact CE1-CD1 4.2Å; F173-L195 HydrophobicContact CE1-CD2 4.08Å; F173-L195 HydrophobicContact CE1-CG 4.47Å; F173-A214 HydrophobicContact CD1-CB 4Å; F173-F218 HydrophobicContact CE1-CB 4.09Å; F173-F218 HydrophobicContact CE1-CD2 4.43Å; F173-F218 HydrophobicContact CE1-CG 4.35Å; F173-F218 HydrophobicContact CE2-CD2 4Å; F173-F218 HydrophobicContact CZ-CB 3.89Å; F173-F218 AromaticContact CZ-CD2 3.44Å; F173-F218 HydrophobicContact CZ-CD2 3.44Å; F173-F218 VanDerWaalsContact CZ-CD2 3.44Å; F173-F218 HydrophobicContact CZ-CE2 4.12Å; F173-F218 AromaticContact CZ-CG 3.74Å; F173-F218 HydrophobicContact CZ-CG 3.74Å
174	W	91.4	Very high	89.2	Confident	25 Å²	25	22 Å²	22	10%	0.095	12%	0.119	C	C	.	.	H	α-helix	trans	-65.6	-40.8	173.8	164.9	59	0	0	0	111.9	L170 H171 L210 R213 A214 Q683	L170-W174 WeakPolarHBondContact O-CB 3.39Å; L170-W174 PolarHBondContact O-N 3.42Å; H171-W174 AromaticContact CE1-CE3 3.73Å; H171-W174 AromaticContact CE1-CZ3 3.34Å; H171-W174 WeakPolarHBondContact CE1-CZ3 3.48Å; H171-W174 AromaticContact ND1-CE3 3.77Å; H171-W174 AromaticContact ND1-CZ3 3.86Å; H171-W174 AromaticContact NE2-CZ3 3.74Å; H171-W174 PolarHBondContact O-N 3.42Å; W174-L210 HydrophobicContact CB-CD1 4.47Å; W174-L210 HydrophobicContact CD2-CD1 4.43Å; W174-L210 HydrophobicContact CE3-CD1 4.29Å; W174-R213 HydrophobicContact CG-CB 4.42Å; W174-A214 HydrophobicContact CB-CB 3.86Å; W174-Q683 VanDerWaalsContact CE2-NE2 3.28Å; W174-Q683 HydrophobicContact CH2-CG 4.22Å; W174-Q683 HydrophobicContact CZ2-CG 4.05Å
175	N	88.9	Confident	88.7	Confident	6 Å²	6	27.5 Å²	27.5	3%	0.032	14%	0.142	C	C	.	.	H	α-helix	trans	-72.2	-41.3	179.4	-168.5	-51.7	0	0	0	112	D129 A132 R136 H171 I172 D682	D129-N175 PolarHBondContact OD1-ND2 2.94Å; A132-N175 HydrophobicContact CB-CB 3.66Å; R136-N175 PolarHBondContact NH2-O 2.82Å; R136-N175 PolarHBondContact NH2-OD1 3.29Å; R136-N175 VanDerWaalsContact NH2-OD1 3.11Å; H171-N175 WeakPolarHBondContact O-CB 3.23Å; H171-N175 PolarHBondContact O-N 2.82Å; I172-N175 PolarHBondContact O-N 2.78Å; N175-D682 VanDerWaalsContact O-OD1 3.14Å
176	F	90.7	Very high	88.4	Confident	22 Å²	22	33.3 Å²	33.3	10%	0.096	17%	0.168	C	C	.	.			trans	-132.6	85.8	175	-178.8	-134.7	0	0	0	112.3	A132 A135 R136 I139 I172 F173 G178 I179	A132-F176 HydrophobicContact CB-CB 4.1Å; A135-F176 HydrophobicContact CB-CD1 4.06Å; A135-F176 HydrophobicContact CB-CE1 4.41Å; R136-F176 VanDerWaalsContact CA-CE1 3.49Å; R136-F176 HydrophobicContact CB-CD1 4.22Å; R136-F176 HydrophobicContact CB-CD2 4.24Å; R136-F176 HydrophobicContact CB-CE1 4.23Å; R136-F176 HydrophobicContact CB-CE2 4.3Å; R136-F176 HydrophobicContact CB-CG 4.23Å; R136-F176 HydrophobicContact CB-CZ 4.3Å; R136-F176 HydrophobicContact CG-CD2 4.27Å; R136-F176 HydrophobicContact CG-CE2 4.12Å; R136-F176 HydrophobicContact CG-CZ 4.42Å; I139-F176 HydrophobicContact CD1-CE1 4.35Å; I139-F176 HydrophobicContact CD1-CZ 4.41Å; I139-F176 HydrophobicContact CG1-CE1 4.14Å; I139-F176 HydrophobicContact CG1-CZ 3.85Å; I172-F176 PolarHBondContact O-N 3.32Å; F173-F176 CarbonylContact O-C 3.59Å; F176-G178 VanDerWaalsContact CZ-C 3.5Å; F176-G178 PolarHBondContact O-N 3.39Å; F176-I179 HydrophobicContact CD1-CB 3.72Å; F176-I179 HydrophobicContact CD1-CG1 4.04Å; F176-I179 HydrophobicContact CE1-CB 3.87Å; F176-I179 HydrophobicContact CE1-CG1 4.14Å
177	P	89.1	Confident	88.2	Confident	6 Å²	6	34.3 Å²	34.3	4%	0.039	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-23.4	-178.8	-17.3	29.4	0	0	0	113.6	F173 I179 A217 F218 A221	F173-P177 HydrophobicContact CE2-CB 4.22Å; F173-P177 WeakPolarHBondContact CE2-O 3.42Å; F173-P177 HydrophobicContact CZ-CB 4.44Å; F173-P177 WeakPolarHBondContact O-CA 3.47Å; F173-P177 WeakPolarHBondContact O-CD 3.31Å; F173-P177 WeakPolarHBondContact O-CG 3.29Å; F173-P177 VanDerWaalsContact O-N 3.1Å; P177-I179 PolarHBondContact O-N 2.91Å; P177-A217 HydrophobicContact CG-CB 3.77Å; P177-F218 HydrophobicContact CB-CB 4.06Å; P177-F218 HydrophobicContact CB-CD2 3.9Å; P177-F218 HydrophobicContact CB-CG 4.5Å; P177-A221 HydrophobicContact CB-CB 4.14Å; P177-A221 HydrophobicContact CG-CB 4.3Å
178	G	86.6	Confident	88.1	Confident	23 Å²	23	34.1 Å²	34.1	24%	0.237	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	8.5	-178.9	0	0	0	0	0	115.6	F176 F180 G181	F176-G178 VanDerWaalsContact CZ-C 3.5Å; F176-G178 PolarHBondContact O-N 3.39Å; G178-F180 PolarHBondContact O-N 3.04Å; G178-G181 PolarHBondContact O-N 3.41Å
179	I	88.7	Confident	87.9	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.015	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-19.9	-173.3	-161.8	169.9	0	0	0	114.8	A135 N145 L151 L154 I172 F176 P177	A135-I179 HydrophobicContact CB-CD1 3.83Å; A135-I179 HydrophobicContact CB-CG1 4.11Å; N145-I179 PolarHBondContact ND2-O 3.33Å; L151-I179 HydrophobicContact CD2-CB 4.19Å; L151-I179 HydrophobicContact CD2-CD1 4.16Å; L151-I179 HydrophobicContact CD2-CG1 3.74Å; L151-I179 HydrophobicContact CD2-CG2 3.69Å; L151-I179 HydrophobicContact CG-CG1 4.49Å; L154-I179 HydrophobicContact CD1-CD1 4.36Å; L154-I179 HydrophobicContact CD1-CG2 4.26Å; I172-I179 HydrophobicContact CG2-CD1 4.36Å; F176-I179 HydrophobicContact CD1-CB 3.72Å; F176-I179 HydrophobicContact CD1-CG1 4.04Å; F176-I179 HydrophobicContact CE1-CB 3.87Å; F176-I179 HydrophobicContact CE1-CG1 4.14Å; P177-I179 PolarHBondContact O-N 2.91Å
180	F	85.6	Confident	87.7	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.009	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.7	-179.3	-53.3	-76.4	0	0	0	114.2	L151 F155 F173 G178 N182 Q183 Q184 Y187 I191	L151-F180 HydrophobicContact CD1-CD1 4.48Å; L151-F180 HydrophobicContact CD2-CD1 3.53Å; L151-F180 HydrophobicContact CD2-CE1 3.56Å; L151-F180 HydrophobicContact CD2-CG 4.36Å; L151-F180 HydrophobicContact CD2-CZ 4.42Å; F155-F180 HydrophobicContact CE1-CE1 4.22Å; F155-F180 HydrophobicContact CE1-CZ 4.5Å; F155-F180 AromaticContact CE2-CE1 3.91Å; F155-F180 HydrophobicContact CE2-CE1 3.91Å; F155-F180 HydrophobicContact CZ-CD1 4.3Å; F155-F180 AromaticContact CZ-CE1 3.42Å; F155-F180 HydrophobicContact CZ-CE1 3.42Å; F155-F180 VanDerWaalsContact CZ-CE1 3.42Å; F155-F180 HydrophobicContact CZ-CZ 4.11Å; F173-F180 HydrophobicContact CD2-CE2 4.1Å; F173-F180 HydrophobicContact CE2-CD2 4.48Å; F173-F180 AromaticContact CE2-CE2 3.62Å; F173-F180 HydrophobicContact CE2-CE2 3.62Å; F173-F180 HydrophobicContact CE2-CZ 4.47Å; G178-F180 PolarHBondContact O-N 3.04Å; F180-N182 PolarHBondContact O-N 3.07Å; F180-Q183 WeakPolarHBondContact O-CB 3.43Å; F180-Q183 PolarHBondContact O-N 2.72Å; F180-Q184 HydrophobicContact CB-CB 3.99Å; F180-Y187 AromaticContact CD1-CD2 3.9Å; F180-Y187 HydrophobicContact CD1-CD2 3.9Å; F180-Y187 HydrophobicContact CD1-CG 4.21Å; F180-I191 HydrophobicContact CD2-CD1 3.6Å; F180-I191 HydrophobicContact CD2-CG1 4.44Å; F180-I191 HydrophobicContact CE2-CD1 3.34Å; F180-I191 HydrophobicContact CE2-CG1 3.72Å; F180-I191 HydrophobicContact CG-CD1 4.37Å; F180-I191 HydrophobicContact CZ-CD1 3.95Å; F180-I191 HydrophobicContact CZ-CG1 3.89Å
181	G	83.4	Confident	87.7	Confident	20 Å²	20	41.4 Å²	41.4	21%	0.206	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	49.3	-135.7	-174.7	0	0	0	0	0	112.4	G143 G178 Q183 Q184	G143-G181 CarbonylContact O-C 2.99Å; G143-G181 WeakPolarHBondContact O-CA 3.26Å; G178-G181 PolarHBondContact O-N 3.41Å; G181-Q183 PolarHBondContact O-N 3.49Å; G181-Q184 WeakPolarHBondContact O-CB 3.42Å; G181-Q184 PolarHBondContact O-N 3.41Å; G181-Q184 VanDerWaalsContact O-N 3.07Å
182	N	83	Confident	87.7	Confident	112 Å²	112	42.3 Å²	42.3	60%	0.599	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-63.4	-12.7	178.1	-72.4	-8.5	0	0	0	115	D142 G143 F180 Q184	D142-N182 PolarHBondContact O-ND2 3.01Å; G143-N182 PolarHBondContact O-N 3.26Å; F180-N182 PolarHBondContact O-N 3.07Å; N182-Q184 VanDerWaalsContact C-N 3.32Å
183	Q	79.7	Confident	87.6	Confident	100 Å²	100	49.8 Å²	49.8	47%	0.467	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-86.6	-2.6	176.8	-57.5	-171.8	-7.3	0	0	113	F180 G181 Q185 H186 Y187	F180-Q183 WeakPolarHBondContact O-CB 3.43Å; F180-Q183 PolarHBondContact O-N 2.72Å; G181-Q183 PolarHBondContact O-N 3.49Å; Q183-Q185 PolarHBondContact O-N 3.22Å; Q183-Q185 VanDerWaalsContact O-N 3.14Å; Q183-H186 WeakPolarHBondContact O-CB 3.31Å; Q183-H186 PolarHBondContact O-N 3.35Å; Q183-Y187 HydrophobicContact CB-CD2 4.17Å; Q183-Y187 HydrophobicContact CB-CE2 3.97Å; Q183-Y187 WeakPolarHBondContact O-CD2 3.3Å; Q183-Y187 PolarHBondContact O-N 3.04Å
184	Q	82.1	Confident	87.4	Confident	22 Å²	22	50.2 Å²	50.2	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-51.1	-42	-177.2	-176.5	172.7	-68.8	0	0	113	F180 G181 N182 H186 Y187 L188 F218 N222	F180-Q184 HydrophobicContact CB-CB 3.99Å; G181-Q184 WeakPolarHBondContact O-CB 3.42Å; G181-Q184 PolarHBondContact O-N 3.41Å; G181-Q184 VanDerWaalsContact O-N 3.07Å; N182-Q184 VanDerWaalsContact C-N 3.32Å; Q184-H186 PolarHBondContact O-N 2.96Å; Q184-Y187 PolarHBondContact O-N 3.29Å; Q184-Y187 VanDerWaalsContact O-N 3.1Å; Q184-L188 HydrophobicContact CG-CD1 4.33Å; Q184-L188 PolarHBondContact O-N 3.47Å; Q184-F218 HydrophobicContact CG-CE2 4.42Å; Q184-F218 HydrophobicContact CG-CZ 4.39Å; Q184-N222 PolarHBondContact NE2-OD1 2.7Å
185	Q	81.8	Confident	87.5	Confident	125 Å²	125	49 Å²	49	58%	0.584	24%	0.242	S	C	*	.	H	α-helix	trans	-60.1	-31.1	179.5	-66.9	-62	-25.5	0	0	113.1	Q183	Q183-Q185 PolarHBondContact O-N 3.22Å; Q183-Q185 VanDerWaalsContact O-N 3.14Å
186	H	85.8	Confident	87.7	Confident	147 Å²	147	50.7 Å²	50.7	68%	0.681	25%	0.253	S	S	*	.	H	α-helix	trans	-73.2	-34.1	177.9	-174.2	57.4	0	0	0	112.5	Q183 Q184	Q183-H186 WeakPolarHBondContact O-CB 3.31Å; Q183-H186 PolarHBondContact O-N 3.35Å; Q184-H186 PolarHBondContact O-N 2.96Å
187	Y	86.6	Confident	87.7	Confident	62 Å²	62	55.6 Å²	55.6	24%	0.243	28%	0.276	C	S	.	.	H	α-helix	trans	-96.8	-0.2	-175.6	-64.8	-69.6	0	0	0	113.9	F155 F180 Q183 Q184 D189 V190 I191	F155-Y187 HydrophobicContact CE1-CD1 4.33Å; F155-Y187 AromaticContact CE2-CD1 3.89Å; F155-Y187 HydrophobicContact CE2-CD1 3.89Å; F155-Y187 AromaticContact CE2-CE1 3.9Å; F155-Y187 HydrophobicContact CE2-CE1 3.9Å; F155-Y187 HydrophobicContact CE2-CG 4.41Å; F155-Y187 AromaticContact CZ-CD1 3.44Å; F155-Y187 HydrophobicContact CZ-CD1 3.44Å; F155-Y187 VanDerWaalsContact CZ-CD1 3.44Å; F155-Y187 AromaticContact CZ-CE1 3.94Å; F155-Y187 HydrophobicContact CZ-CE1 3.94Å; F155-Y187 AromaticContact CZ-CG 3.81Å; F155-Y187 HydrophobicContact CZ-CG 3.81Å; F180-Y187 AromaticContact CD1-CD2 3.9Å; F180-Y187 HydrophobicContact CD1-CD2 3.9Å; F180-Y187 HydrophobicContact CD1-CG 4.21Å; Q183-Y187 HydrophobicContact CB-CD2 4.17Å; Q183-Y187 HydrophobicContact CB-CE2 3.97Å; Q183-Y187 WeakPolarHBondContact O-CD2 3.3Å; Q183-Y187 PolarHBondContact O-N 3.04Å; Q184-Y187 PolarHBondContact O-N 3.29Å; Q184-Y187 VanDerWaalsContact O-N 3.1Å; Y187-D189 PolarHBondContact O-N 2.78Å; Y187-V190 WeakPolarHBondContact O-CA 2.97Å; Y187-V190 WeakPolarHBondContact O-CB 3.49Å; Y187-V190 PolarHBondContact O-N 3.49Å; Y187-I191 WeakPolarHBondContact O-CG1 3.4Å; Y187-I191 PolarHBondContact O-N 3.03Å
188	L	89.2	Confident	87.7	Confident	19 Å²	19	55.6 Å²	55.6	10%	0.099	28%	0.276	C	S	.	.	H	α-helix	trans	-54.6	-47.2	-171.5	-158.5	69.7	0	0	0	113.6	Q184 V190 I191 K192 F218 L228 F232	Q184-L188 HydrophobicContact CG-CD1 4.33Å; Q184-L188 PolarHBondContact O-N 3.47Å; L188-V190 VanDerWaalsContact C-N 3.27Å; L188-V190 PolarHBondContact O-N 3.07Å; L188-I191 PolarHBondContact O-N 3.21Å; L188-K192 WeakPolarHBondContact O-CB 3.41Å; L188-K192 PolarHBondContact O-N 3.46Å; L188-F218 HydrophobicContact CD1-CE1 4.37Å; L188-F218 HydrophobicContact CD1-CZ 3.98Å; L188-L228 HydrophobicContact CD1-CD1 3.92Å; L188-L228 HydrophobicContact CD1-CG 4.43Å; L188-F232 HydrophobicContact CD1-CE2 3.59Å; L188-F232 HydrophobicContact CD1-CZ 3.94Å; L188-F232 HydrophobicContact CD2-CE2 4.24Å; L188-F232 HydrophobicContact CG-CE2 3.67Å; L188-F232 HydrophobicContact CG-CZ 4.12Å
189	D	90	Very high	87.9	Confident	89 Å²	89	55.1 Å²	55.1	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-31.2	176.7	-81.8	-46.3	0	0	0	112.6	Y187 R193 H231	Y187-D189 PolarHBondContact O-N 2.78Å; D189-R193 VanDerWaalsContact O-CG 3.27Å; D189-R193 WeakPolarHBondContact O-CG 3.43Å; D189-R193 PolarHBondContact O-N 3.16Å; D189-H231 IonicContact OD1-CE1 3.12Å; D189-H231 PolarHBondContact OD1-CE1 3.43Å; D189-H231 IonicContact OD1-NE2 3.98Å; D189-H231 PolarHBondContact OD1-NE2 3.46Å
190	V	88.8	Confident	87.9	Confident	65 Å²	65	61.6 Å²	61.6	39%	0.394	30%	0.298	S	S	.	.	H	α-helix	trans	-73.2	-44.4	179.3	-175.5	0	0	0	0	109.9	F155 Y187 L188 K192 R193 M194	F155-V190 HydrophobicContact CD1-CG1 3.82Å; F155-V190 HydrophobicContact CE1-CB 4.2Å; F155-V190 HydrophobicContact CE1-CG1 3.52Å; Y187-V190 WeakPolarHBondContact O-CA 2.97Å; Y187-V190 WeakPolarHBondContact O-CB 3.49Å; Y187-V190 PolarHBondContact O-N 3.49Å; L188-V190 VanDerWaalsContact C-N 3.27Å; L188-V190 PolarHBondContact O-N 3.07Å; V190-K192 VanDerWaalsContact C-N 3.32Å; V190-K192 PolarHBondContact O-N 3.04Å; V190-R193 PolarHBondContact O-N 2.84Å; V190-M194 WeakPolarHBondContact O-CB 3.18Å; V190-M194 PolarHBondContact O-N 3Å
191	I	90.9	Very high	88	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-48.4	173.6	-61.8	164.6	0	0	0	109.5	F173 F180 Y187 L188 R193 M194 L195 F218 F232	F173-I191 HydrophobicContact CE1-CG2 3.99Å; F173-I191 HydrophobicContact CE2-CG2 4.44Å; F173-I191 HydrophobicContact CZ-CG2 3.58Å; F180-I191 HydrophobicContact CD2-CD1 3.6Å; F180-I191 HydrophobicContact CD2-CG1 4.44Å; F180-I191 HydrophobicContact CE2-CD1 3.34Å; F180-I191 HydrophobicContact CE2-CG1 3.72Å; F180-I191 HydrophobicContact CG-CD1 4.37Å; F180-I191 HydrophobicContact CZ-CD1 3.95Å; F180-I191 HydrophobicContact CZ-CG1 3.89Å; Y187-I191 WeakPolarHBondContact O-CG1 3.4Å; Y187-I191 PolarHBondContact O-N 3.03Å; L188-I191 PolarHBondContact O-N 3.21Å; I191-R193 PolarHBondContact O-N 3.19Å; I191-M194 HydrophobicContact CG2-CE 4.34Å; I191-M194 WeakPolarHBondContact O-CB 3.22Å; I191-M194 PolarHBondContact O-N 3.35Å; I191-L195 HydrophobicContact CG2-CD1 3.97Å; I191-L195 WeakPolarHBondContact O-CG 3.47Å; I191-L195 PolarHBondContact O-N 3.43Å; I191-F218 HydrophobicContact CD1-CE2 4.28Å; I191-F218 HydrophobicContact CD1-CZ 4.25Å; I191-F218 HydrophobicContact CG2-CE1 4.42Å; I191-F218 HydrophobicContact CG2-CZ 4.42Å; I191-F232 HydrophobicContact CG2-CE1 4.29Å; I191-F232 HydrophobicContact CG2-CZ 4.33Å
192	K	93	Very high	88	Confident	32 Å²	32	68.9 Å²	68.9	14%	0.139	33%	0.327	C	S	.	.	H	α-helix	trans	-56.3	-49	177	-170.4	178.4	174	173.8	0	111.9	L188 V190 M194 L195 V196 H231 F232 D234 L235	L188-K192 WeakPolarHBondContact O-CB 3.41Å; L188-K192 PolarHBondContact O-N 3.46Å; V190-K192 VanDerWaalsContact C-N 3.32Å; V190-K192 PolarHBondContact O-N 3.04Å; K192-M194 PolarHBondContact O-N 3.49Å; K192-L195 PolarHBondContact O-N 2.88Å; K192-V196 HydrophobicContact CG-CG2 4.5Å; K192-V196 WeakPolarHBondContact O-CB 3.38Å; K192-V196 VanDerWaalsContact O-CG2 3.24Å; K192-V196 WeakPolarHBondContact O-CG2 3.46Å; K192-V196 PolarHBondContact O-N 2.7Å; K192-H231 WeakPolarHBondContact CE-O 3.34Å; K192-H231 PolarHBondContact NZ-O 3.13Å; K192-F232 HydrophobicContact CB-CE1 3.91Å; K192-F232 HydrophobicContact CB-CZ 4Å; K192-F232 HydrophobicContact CG-CD1 4.47Å; K192-F232 HydrophobicContact CG-CE1 4.27Å; K192-D234 IonicContact NZ-OD2 3.4Å; K192-D234 PolarHBondContact NZ-OD2 3.3Å; K192-L235 HydrophobicContact CD-CD1 4.34Å; K192-L235 HydrophobicContact CG-CD1 3.67Å
193	R	90.5	Very high	88.2	Confident	164 Å²	164	71.2 Å²	71.2	62%	0.619	33%	0.334	S	S	*	.	H	α-helix	trans	-61.8	-42.7	179.1	-75.3	175.2	-163.2	178.9	8.1	112.6	D189 V190 I191 Q197	D189-R193 VanDerWaalsContact O-CG 3.27Å; D189-R193 WeakPolarHBondContact O-CG 3.43Å; D189-R193 PolarHBondContact O-N 3.16Å; V190-R193 PolarHBondContact O-N 2.84Å; I191-R193 PolarHBondContact O-N 3.19Å; R193-Q197 WeakPolarHBondContact O-CB 3.18Å; R193-Q197 VanDerWaalsContact O-CG 3.24Å; R193-Q197 WeakPolarHBondContact O-CG 3.21Å; R193-Q197 PolarHBondContact O-N 2.92Å
194	M	90.6	Very high	88.5	Confident	9 Å²	9	68.9 Å²	68.9	4%	0.044	32%	0.323	C	S	.	.	H	α-helix	trans	-55.3	-55.9	176.3	163.3	-176.6	88.1	0	0	110.9	L154 V158 L170 F173 V190 I191 K192 V196 Q197 C198	L154-M194 HydrophobicContact CD2-SD 4.06Å; V158-M194 HydrophobicContact CB-CG 4.32Å; V158-M194 HydrophobicContact CB-SD 4.25Å; V158-M194 HydrophobicContact CG1-CB 3.87Å; V158-M194 HydrophobicContact CG1-CG 3.47Å; V158-M194 VanDerWaalsContact CG1-CG 3.47Å; V158-M194 HydrophobicContact CG1-SD 4.01Å; V158-M194 HydrophobicContact CG2-CG 3.86Å; V158-M194 HydrophobicContact CG2-SD 3.32Å; V158-M194 WeakPolarHBondContact CG2-SD 3.27Å; L170-M194 HydrophobicContact CD2-CE 4.42Å; L170-M194 HydrophobicContact CD2-CG 4.36Å; L170-M194 HydrophobicContact CD2-SD 4.46Å; F173-M194 HydrophobicContact CD1-CE 3.48Å; F173-M194 VanDerWaalsContact CD1-CE 3.48Å; F173-M194 HydrophobicContact CE1-CE 3.72Å; F173-M194 HydrophobicContact CG-CE 4.01Å; F173-M194 HydrophobicContact CZ-CE 4.41Å; V190-M194 WeakPolarHBondContact O-CB 3.18Å; V190-M194 PolarHBondContact O-N 3Å; I191-M194 HydrophobicContact CG2-CE 4.34Å; I191-M194 WeakPolarHBondContact O-CB 3.22Å; I191-M194 PolarHBondContact O-N 3.35Å; K192-M194 PolarHBondContact O-N 3.49Å; M194-V196 PolarHBondContact O-N 3.23Å; M194-Q197 PolarHBondContact O-N 3.3Å; M194-C198 PolarHBondContact O-N 3.13Å; M194-C198 PolarHBondContact O-SG 3.35Å; M194-C198 VanDerWaalsContact O-SG 3.38Å
195	L	93.3	Very high	88.7	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.8	-41	-176.1	-64.6	171.4	0	0	0	111.8	L170 F173 I191 K192 C198 M199 S211 A214 F232 L235	L170-L195 HydrophobicContact CD2-CD2 4.27Å; F173-L195 HydrophobicContact CD1-CD2 4.28Å; F173-L195 HydrophobicContact CE1-CD1 4.2Å; F173-L195 HydrophobicContact CE1-CD2 4.08Å; F173-L195 HydrophobicContact CE1-CG 4.47Å; I191-L195 HydrophobicContact CG2-CD1 3.97Å; I191-L195 WeakPolarHBondContact O-CG 3.47Å; I191-L195 PolarHBondContact O-N 3.43Å; K192-L195 PolarHBondContact O-N 2.88Å; L195-C198 PolarHBondContact O-N 3.45Å; L195-M199 HydrophobicContact CB-CE 4.33Å; L195-M199 WeakPolarHBondContact O-CB 3.48Å; L195-M199 WeakPolarHBondContact O-CE 3.37Å; L195-M199 WeakPolarHBondContact O-CG 3.31Å; L195-M199 PolarHBondContact O-N 2.93Å; L195-S211 PolarHBondContact O-OG 2.97Å; L195-S211 VanDerWaalsContact O-OG 3.1Å; L195-A214 HydrophobicContact CD2-CB 4.05Å; L195-F232 HydrophobicContact CD1-CE1 4.26Å; L195-L235 HydrophobicContact CB-CD2 3.59Å; L195-L235 HydrophobicContact CD1-CD2 3.85Å; L195-L235 HydrophobicContact CG-CD2 4.4Å
196	V	92.8	Very high	88.9	Confident	41 Å²	41	69 Å²	69	25%	0.248	34%	0.339	C	S	.	.	H	α-helix	trans	-61.5	-46.5	176.2	170.7	0	0	0	0	111.4	K192 M194 M199 Q200 L235	K192-V196 HydrophobicContact CG-CG2 4.5Å; K192-V196 WeakPolarHBondContact O-CB 3.38Å; K192-V196 VanDerWaalsContact O-CG2 3.24Å; K192-V196 WeakPolarHBondContact O-CG2 3.46Å; K192-V196 PolarHBondContact O-N 2.7Å; M194-V196 PolarHBondContact O-N 3.23Å; V196-M199 PolarHBondContact O-N 3.06Å; V196-Q200 WeakPolarHBondContact O-CB 3.23Å; V196-Q200 VanDerWaalsContact O-CG 3.27Å; V196-Q200 WeakPolarHBondContact O-CG 3.2Å; V196-Q200 PolarHBondContact O-N 3.34Å; V196-Q200 VanDerWaalsContact O-N 3.12Å; V196-L235 HydrophobicContact CG2-CD1 3.55Å; V196-L235 HydrophobicContact CG2-CG 3.8Å
197	Q	89.7	Confident	89.1	Confident	126 Å²	126	62 Å²	62	59%	0.589	31%	0.306	S	S	*	.	H	α-helix	trans	-63.8	-43.5	-179.9	-74.9	175.9	-10.9	0	0	111.8	R193 M194 Q200 D201	R193-Q197 WeakPolarHBondContact O-CB 3.18Å; R193-Q197 VanDerWaalsContact O-CG 3.24Å; R193-Q197 WeakPolarHBondContact O-CG 3.21Å; R193-Q197 PolarHBondContact O-N 2.92Å; M194-Q197 PolarHBondContact O-N 3.3Å; Q197-Q200 PolarHBondContact O-N 3.14Å; Q197-D201 PolarHBondContact O-N 3.27Å
198	C	90.5	Very high	89.2	Confident	5 Å²	5	60 Å²	60	3%	0.034	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-37.8	179.3	-69.1	0	0	0	0	112.5	L170 M194 L195 Q200 D201 I207 R208 S211	L170-C198 HydrophobicContact CD1-CB 4Å; L170-C198 HydrophobicContact CD2-CB 4.49Å; M194-C198 PolarHBondContact O-N 3.13Å; M194-C198 PolarHBondContact O-SG 3.35Å; M194-C198 VanDerWaalsContact O-SG 3.38Å; L195-C198 PolarHBondContact O-N 3.45Å; C198-Q200 VanDerWaalsContact C-N 3.27Å; C198-Q200 PolarHBondContact O-N 3.32Å; C198-D201 WeakPolarHBondContact O-CB 3.44Å; C198-D201 PolarHBondContact O-N 2.81Å; C198-I207 HydrophobicContact CB-CG2 3.83Å; C198-R208 WeakPolarHBondContact O-CG 3.04Å; C198-S211 WeakPolarHBondContact CB-OG 3.37Å
199	M	90.5	Very high	89.3	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.069	30%	0.301	C	S	.	.	H	α-helix	trans	-68.6	-24.2	173.9	-76.6	-171.6	-74.6	0	0	113.8	L195 V196 R208 L235 F239	L195-M199 HydrophobicContact CB-CE 4.33Å; L195-M199 WeakPolarHBondContact O-CB 3.48Å; L195-M199 WeakPolarHBondContact O-CE 3.37Å; L195-M199 WeakPolarHBondContact O-CG 3.31Å; L195-M199 PolarHBondContact O-N 2.93Å; V196-M199 PolarHBondContact O-N 3.06Å; M199-R208 WeakPolarHBondContact O-CG 3.26Å; M199-R208 PolarHBondContact O-NE 3.16Å; M199-L235 HydrophobicContact CE-CB 3.81Å; M199-L235 HydrophobicContact CE-CD2 3.62Å; M199-L235 HydrophobicContact CE-CG 3.58Å; M199-F239 HydrophobicContact SD-CB 4.45Å
200	Q	88.5	Confident	89.4	Confident	138 Å²	138	56.8 Å²	56.8	65%	0.645	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-5	175.8	-71.1	176.8	1.6	0	0	113.6	V196 Q197 C198 Q202	V196-Q200 WeakPolarHBondContact O-CB 3.23Å; V196-Q200 VanDerWaalsContact O-CG 3.27Å; V196-Q200 WeakPolarHBondContact O-CG 3.2Å; V196-Q200 PolarHBondContact O-N 3.34Å; V196-Q200 VanDerWaalsContact O-N 3.12Å; Q197-Q200 PolarHBondContact O-N 3.14Å; C198-Q200 VanDerWaalsContact C-N 3.27Å; C198-Q200 PolarHBondContact O-N 3.32Å; Q200-Q202 PolarHBondContact O-N 3.37Å
201	D	87.5	Confident	89.6	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.112	26%	0.263	C	S	.	.			trans	-72.2	88.5	179.8	-168.1	-30.7	0	0	0	111.2	R166 Q197 C198 E203 H204 I207 R208	R166-D201 IonicContact CZ-OD2 2.79Å; R166-D201 IonicContact NH1-OD2 3.34Å; R166-D201 PolarHBondContact NH1-OD2 3.08Å; R166-D201 IonicContact NH2-OD2 2.76Å; R166-D201 PolarHBondContact NH2-OD2 3.16Å; Q197-D201 PolarHBondContact O-N 3.27Å; C198-D201 WeakPolarHBondContact O-CB 3.44Å; C198-D201 PolarHBondContact O-N 2.81Å; D201-E203 PolarHBondContact O-N 3.11Å; D201-E203 WeakPolarHBondContact OD1-CB 3.42Å; D201-E203 PolarHBondContact OD1-N 3.31Å; D201-H204 IonicContact OD1-CG 3.53Å; D201-H204 PolarHBondContact OD1-N 3.39Å; D201-H204 VanDerWaalsContact OD1-N 3.14Å; D201-H204 IonicContact OD1-ND1 3.32Å; D201-H204 PolarHBondContact OD1-ND1 3.39Å; D201-H204 VanDerWaalsContact OD1-ND1 3.14Å; D201-H204 IonicContact OD2-ND1 2.72Å; D201-H204 PolarHBondContact OD2-ND1 2.88Å; D201-I207 HydrophobicContact CB-CG2 4.46Å; D201-R208 WeakPolarHBondContact O-CD 3.43Å; D201-R208 WeakPolarHBondContact O-CG 3.19Å
202	Q	83.6	Confident	89.8	Confident	154 Å²	154	53.6 Å²	53.6	72%	0.72	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.4	177.7	-69.6	-80.2	-44	0	0	113.2	Q200	Q200-Q202 PolarHBondContact O-N 3.37Å
203	E	86.5	Confident	89.9	Confident	161 Å²	161	54.8 Å²	54.8	75%	0.752	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.1	-178.7	-61.4	-174.8	167.5	0	0	111.7	D201	D201-E203 PolarHBondContact O-N 3.11Å; D201-E203 WeakPolarHBondContact OD1-CB 3.42Å; D201-E203 PolarHBondContact OD1-N 3.31Å
204	H	87.1	Confident	90	Very high	51 Å²	51	47 Å²	47	24%	0.236	24%	0.237	C	C	.	.			trans	-131.3	94.6	-173	-53.8	88.7	0	0	0	112.3	V163 D201 S206 I207 R208	V163-H204 WeakPolarHBondContact CG2-NE2 3.43Å; D201-H204 IonicContact OD1-CG 3.53Å; D201-H204 PolarHBondContact OD1-N 3.39Å; D201-H204 VanDerWaalsContact OD1-N 3.14Å; D201-H204 IonicContact OD1-ND1 3.32Å; D201-H204 PolarHBondContact OD1-ND1 3.39Å; D201-H204 VanDerWaalsContact OD1-ND1 3.14Å; D201-H204 IonicContact OD2-ND1 2.72Å; D201-H204 PolarHBondContact OD2-ND1 2.88Å; H204-S206 VanDerWaalsContact C-N 3.31Å; H204-S206 PolarHBondContact O-N 3.15Å; H204-I207 HydrophobicContact CB-CB 4.13Å; H204-I207 HydrophobicContact CB-CG1 3.83Å; H204-I207 PolarHBondContact O-N 3.45Å; H204-R208 PolarHBondContact O-N 3.3Å
205	P	84.8	Confident	90.3	Very high	87 Å²	87	46.6 Å²	46.6	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-55.7	-39.8	-179.8	-27	34.7	0	0	0	114.3	I207 R208 T209	P205-I207 VanDerWaalsContact C-N 3.31Å; P205-I207 PolarHBondContact O-N 3.03Å; P205-R208 WeakPolarHBondContact O-CB 3.41Å; P205-R208 PolarHBondContact O-N 3.47Å; P205-R208 VanDerWaalsContact O-N 3.13Å; P205-T209 PolarHBondContact O-N 3.49Å; P205-T209 PolarHBondContact O-OG1 3.28Å
206	S	85.8	Confident	90.4	Very high	63 Å²	63	46.6 Å²	46.6	44%	0.441	24%	0.235	S	C	.	.	H	α-helix	trans	-62.6	-34.2	-179.8	55.7	0	0	0	0	113.6	H204 L210	H204-S206 VanDerWaalsContact C-N 3.31Å; H204-S206 PolarHBondContact O-N 3.15Å; S206-L210 VanDerWaalsContact O-CB 3.31Å; S206-L210 WeakPolarHBondContact O-CB 3.5Å; S206-L210 PolarHBondContact O-N 2.98Å
207	I	90.1	Very high	90.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.1	-38.6	176.2	-65.2	-63.2	0	0	0	110.6	V163 R166 E167 L170 C198 D201 H204 P205 S211	V163-I207 HydrophobicContact CG1-CD1 4.12Å; V163-I207 HydrophobicContact CG1-CG1 4.01Å; R166-I207 HydrophobicContact CB-CD1 4.21Å; E167-I207 HydrophobicContact CB-CD1 3.74Å; E167-I207 HydrophobicContact CG-CD1 4.42Å; L170-I207 HydrophobicContact CD1-CG2 3.95Å; C198-I207 HydrophobicContact CB-CG2 3.83Å; D201-I207 HydrophobicContact CB-CG2 4.46Å; H204-I207 HydrophobicContact CB-CB 4.13Å; H204-I207 HydrophobicContact CB-CG1 3.83Å; H204-I207 PolarHBondContact O-N 3.45Å; P205-I207 VanDerWaalsContact C-N 3.31Å; P205-I207 PolarHBondContact O-N 3.03Å; I207-S211 WeakPolarHBondContact O-CB 3.37Å; I207-S211 PolarHBondContact O-N 3.28Å
208	R	90.6	Very high	90.5	Very high	21 Å²	21	39.5 Å²	39.5	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-49.5	176.6	-66.4	177.8	51.2	-130.7	-9.7	111.5	C198 M199 D201 H204 P205 L210 S211 A212 D245	C198-R208 WeakPolarHBondContact O-CG 3.04Å; M199-R208 WeakPolarHBondContact O-CG 3.26Å; M199-R208 PolarHBondContact O-NE 3.16Å; D201-R208 WeakPolarHBondContact O-CD 3.43Å; D201-R208 WeakPolarHBondContact O-CG 3.19Å; H204-R208 PolarHBondContact O-N 3.3Å; P205-R208 WeakPolarHBondContact O-CB 3.41Å; P205-R208 PolarHBondContact O-N 3.47Å; P205-R208 VanDerWaalsContact O-N 3.13Å; R208-L210 PolarHBondContact O-N 3.45Å; R208-S211 PolarHBondContact O-N 2.91Å; R208-A212 WeakPolarHBondContact O-CB 3.24Å; R208-A212 PolarHBondContact O-N 3.36Å; R208-D245 IonicContact CZ-OD2 3.42Å; R208-D245 IonicContact NH1-OD2 3.51Å; R208-D245 PolarHBondContact NH1-OD2 2.89Å; R208-D245 IonicContact NH2-OD2 2.94Å; R208-D245 PolarHBondContact NH2-OD2 2.96Å
209	T	90.6	Very high	90.7	Very high	26 Å²	26	39.3 Å²	39.3	16%	0.16	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-49	176.9	-60.2	0	0	0	0	110.8	P205 S211 A212 R213 S246 D251 V254	P205-T209 PolarHBondContact O-N 3.49Å; P205-T209 PolarHBondContact O-OG1 3.28Å; T209-S211 PolarHBondContact O-N 3.43Å; T209-A212 WeakPolarHBondContact O-CB 3.42Å; T209-A212 PolarHBondContact O-N 2.95Å; T209-R213 WeakPolarHBondContact O-CG 3.3Å; T209-R213 PolarHBondContact O-N 3.2Å; T209-S246 PolarHBondContact OG1-OG 3.12Å; T209-D251 WeakPolarHBondContact CG2-OD2 3.3Å; T209-V254 HydrophobicContact CG2-CG2 3.55Å
210	L	91.2	Very high	90.7	Very high	13 Å²	13	40.2 Å²	40.2	7%	0.068	21%	0.206	C	C	.	.	H	α-helix	trans	-66.2	-38.6	179.7	-172.6	60.2	0	0	0	112.3	E167 L170 H171 W174 S206 R208 A212 R213 A214	E167-L210 HydrophobicContact CG-CD2 3.75Å; E167-L210 VanDerWaalsContact O-CD2 3.25Å; E167-L210 WeakPolarHBondContact O-CD2 3.36Å; L170-L210 HydrophobicContact CB-CD2 3.66Å; L170-L210 HydrophobicContact CB-CG 3.77Å; H171-L210 HydrophobicContact CB-CD2 4.17Å; W174-L210 HydrophobicContact CB-CD1 4.47Å; W174-L210 HydrophobicContact CD2-CD1 4.43Å; W174-L210 HydrophobicContact CE3-CD1 4.29Å; S206-L210 VanDerWaalsContact O-CB 3.31Å; S206-L210 WeakPolarHBondContact O-CB 3.5Å; S206-L210 PolarHBondContact O-N 2.98Å; R208-L210 PolarHBondContact O-N 3.45Å; L210-A212 VanDerWaalsContact C-N 3.3Å; L210-A212 PolarHBondContact O-N 2.92Å; L210-R213 PolarHBondContact O-N 3.1Å; L210-A214 VanDerWaalsContact O-CB 3.32Å; L210-A214 WeakPolarHBondContact O-CB 3.41Å; L210-A214 PolarHBondContact O-N 2.92Å
211	S	94.2	Very high	90.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-33.4	174.6	-171.3	0	0	0	0	112.7	L195 C198 I207 R208 T209 T215	L195-S211 PolarHBondContact O-OG 2.97Å; L195-S211 VanDerWaalsContact O-OG 3.1Å; C198-S211 WeakPolarHBondContact CB-OG 3.37Å; I207-S211 WeakPolarHBondContact O-CB 3.37Å; I207-S211 PolarHBondContact O-N 3.28Å; R208-S211 PolarHBondContact O-N 2.91Å; T209-S211 PolarHBondContact O-N 3.43Å; S211-T215 WeakPolarHBondContact O-CB 3.47Å; S211-T215 PolarHBondContact O-N 3.13Å; S211-T215 PolarHBondContact O-OG1 3.25Å
212	A	95.5	Very high	90.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.1	-47.1	175.5	0	0	0	0	0	110.9	R208 T209 L210 A214 T215 A216 F239 A242 V254	R208-A212 WeakPolarHBondContact O-CB 3.24Å; R208-A212 PolarHBondContact O-N 3.36Å; T209-A212 WeakPolarHBondContact O-CB 3.42Å; T209-A212 PolarHBondContact O-N 2.95Å; L210-A212 VanDerWaalsContact C-N 3.3Å; L210-A212 PolarHBondContact O-N 2.92Å; A212-A214 VanDerWaalsContact C-N 3.34Å; A212-A214 PolarHBondContact O-N 3.41Å; A212-T215 WeakPolarHBondContact O-CB 3.39Å; A212-T215 PolarHBondContact O-N 2.93Å; A212-T215 VanDerWaalsContact O-N 3.11Å; A212-A216 PolarHBondContact O-N 3.27Å; A212-F239 HydrophobicContact CB-CD2 3.77Å; A212-F239 HydrophobicContact CB-CE2 4.18Å; A212-F239 WeakPolarHBondContact O-CD2 3.37Å; A212-F239 WeakPolarHBondContact O-CE2 3.23Å; A212-A242 HydrophobicContact CB-CB 3.55Å; A212-V254 HydrophobicContact CB-CG1 3.62Å
213	R	93.8	Very high	91	Very high	57 Å²	57	33.5 Å²	33.5	22%	0.215	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-43	173.6	-64.6	179.8	74	-171.8	6.8	112.2	W174 T209 L210 T215 A216 A217 V254	W174-R213 HydrophobicContact CG-CB 4.42Å; T209-R213 WeakPolarHBondContact O-CG 3.3Å; T209-R213 PolarHBondContact O-N 3.2Å; L210-R213 PolarHBondContact O-N 3.1Å; R213-T215 VanDerWaalsContact C-N 3.28Å; R213-T215 PolarHBondContact O-N 3.42Å; R213-A216 PolarHBondContact O-N 3.16Å; R213-A217 PolarHBondContact O-N 3.42Å; R213-V254 HydrophobicContact CG-CG2 4.16Å
214	A	93.7	Very high	90.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-35.2	175.4	0	0	0	0	0	112.5	F173 W174 L195 L210 A212 F218	F173-A214 HydrophobicContact CD1-CB 4Å; W174-A214 HydrophobicContact CB-CB 3.86Å; L195-A214 HydrophobicContact CD2-CB 4.05Å; L210-A214 VanDerWaalsContact O-CB 3.32Å; L210-A214 WeakPolarHBondContact O-CB 3.41Å; L210-A214 PolarHBondContact O-N 2.92Å; A212-A214 VanDerWaalsContact C-N 3.34Å; A212-A214 PolarHBondContact O-N 3.41Å; A214-F218 WeakPolarHBondContact O-CB 3.34Å; A214-F218 PolarHBondContact O-N 3.4Å
215	T	96	Very high	90.8	Very high	1 Å²	1	33 Å²	33	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-48	174	-57.7	0	0	0	0	110.2	S211 A212 R213 F218 I219 L235	S211-T215 WeakPolarHBondContact O-CB 3.47Å; S211-T215 PolarHBondContact O-N 3.13Å; S211-T215 PolarHBondContact O-OG1 3.25Å; A212-T215 WeakPolarHBondContact O-CB 3.39Å; A212-T215 PolarHBondContact O-N 2.93Å; A212-T215 VanDerWaalsContact O-N 3.11Å; R213-T215 VanDerWaalsContact C-N 3.28Å; R213-T215 PolarHBondContact O-N 3.42Å; T215-F218 PolarHBondContact O-N 3.22Å; T215-I219 VanDerWaalsContact O-CG1 3.27Å; T215-I219 WeakPolarHBondContact O-CG1 3.42Å; T215-I219 PolarHBondContact O-N 3.38Å; T215-L235 HydrophobicContact CG2-CB 4.2Å; T215-L235 HydrophobicContact CG2-CD2 3.71Å
216	A	94.8	Very high	90.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.1	-52.3	177.2	0	0	0	0	0	112.1	A212 R213 F218 I219 L220 F239 I261	A212-A216 PolarHBondContact O-N 3.27Å; R213-A216 PolarHBondContact O-N 3.16Å; A216-F218 VanDerWaalsContact C-N 3.28Å; A216-F218 PolarHBondContact O-N 3.01Å; A216-I219 PolarHBondContact O-N 3.47Å; A216-L220 WeakPolarHBondContact O-CG 3.18Å; A216-L220 PolarHBondContact O-N 2.93Å; A216-F239 HydrophobicContact CB-CE2 3.98Å; A216-F239 HydrophobicContact CB-CZ 4.34Å; A216-I261 HydrophobicContact CB-CD1 3.66Å; A216-I261 HydrophobicContact CB-CG1 4.11Å
217	A	92.3	Very high	91.1	Very high	18 Å²	18	32.9 Å²	32.9	15%	0.149	19%	0.186	C	C	.	.	H	α-helix	trans	-56.8	-40.1	178.3	0	0	0	0	0	112.6	P177 R213 L220 A221	P177-A217 HydrophobicContact CG-CB 3.77Å; R213-A217 PolarHBondContact O-N 3.42Å; A217-L220 PolarHBondContact O-N 2.88Å; A217-A221 VanDerWaalsContact O-CB 3.31Å; A217-A221 WeakPolarHBondContact O-CB 3.49Å; A217-A221 PolarHBondContact O-N 3.14Å
218	F	94.1	Very high	91.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.9	-37.7	176.6	-178.6	-107.6	0	0	0	113.3	F173 P177 Q184 L188 I191 A214 T215 A216 N222 L228 F232	F173-F218 HydrophobicContact CE1-CB 4.09Å; F173-F218 HydrophobicContact CE1-CD2 4.43Å; F173-F218 HydrophobicContact CE1-CG 4.35Å; F173-F218 HydrophobicContact CE2-CD2 4Å; F173-F218 HydrophobicContact CZ-CB 3.89Å; F173-F218 AromaticContact CZ-CD2 3.44Å; F173-F218 HydrophobicContact CZ-CD2 3.44Å; F173-F218 VanDerWaalsContact CZ-CD2 3.44Å; F173-F218 HydrophobicContact CZ-CE2 4.12Å; F173-F218 AromaticContact CZ-CG 3.74Å; F173-F218 HydrophobicContact CZ-CG 3.74Å; P177-F218 HydrophobicContact CB-CB 4.06Å; P177-F218 HydrophobicContact CB-CD2 3.9Å; P177-F218 HydrophobicContact CB-CG 4.5Å; Q184-F218 HydrophobicContact CG-CE2 4.42Å; Q184-F218 HydrophobicContact CG-CZ 4.39Å; L188-F218 HydrophobicContact CD1-CE1 4.37Å; L188-F218 HydrophobicContact CD1-CZ 3.98Å; I191-F218 HydrophobicContact CD1-CE2 4.28Å; I191-F218 HydrophobicContact CD1-CZ 4.25Å; I191-F218 HydrophobicContact CG2-CE1 4.42Å; I191-F218 HydrophobicContact CG2-CZ 4.42Å; A214-F218 WeakPolarHBondContact O-CB 3.34Å; A214-F218 PolarHBondContact O-N 3.4Å; T215-F218 PolarHBondContact O-N 3.22Å; A216-F218 VanDerWaalsContact C-N 3.28Å; A216-F218 PolarHBondContact O-N 3.01Å; F218-N222 PolarHBondContact O-N 3.48Å; F218-N222 PolarHBondContact O-ND2 3Å; F218-L228 HydrophobicContact CE1-CD1 3.96Å; F218-L228 HydrophobicContact CE1-CD2 4.07Å; F218-L228 HydrophobicContact CE1-CG 4.37Å; F218-L228 HydrophobicContact CZ-CD1 3.97Å; F218-F232 HydrophobicContact CD1-CD1 4.46Å; F218-F232 HydrophobicContact CD1-CE1 4.07Å; F218-F232 HydrophobicContact CD1-CZ 4.23Å; F218-F232 HydrophobicContact CE1-CD1 4.39Å; F218-F232 HydrophobicContact CE1-CD2 4.41Å; F218-F232 AromaticContact CE1-CE1 3.8Å; F218-F232 HydrophobicContact CE1-CE1 3.8Å; F218-F232 AromaticContact CE1-CE2 3.81Å; F218-F232 HydrophobicContact CE1-CE2 3.81Å; F218-F232 AromaticContact CE1-CZ 3.48Å; F218-F232 HydrophobicContact CE1-CZ 3.48Å; F218-F232 VanDerWaalsContact CE1-CZ 3.48Å; F218-F232 HydrophobicContact CZ-CZ 4.27Å
219	I	94.4	Very high	91.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.6	-44.6	176.3	-64.5	-65.5	0	0	0	110.4	T215 A216 A221 N222 L228 F229 F232 V265 Y268	T215-I219 VanDerWaalsContact O-CG1 3.27Å; T215-I219 WeakPolarHBondContact O-CG1 3.42Å; T215-I219 PolarHBondContact O-N 3.38Å; A216-I219 PolarHBondContact O-N 3.47Å; I219-A221 PolarHBondContact O-N 2.87Å; I219-N222 CarbonylContact O-C 3.55Å; I219-N222 WeakPolarHBondContact O-CA 3.12Å; I219-N222 PolarHBondContact O-N 3.46Å; I219-L228 HydrophobicContact CD1-CD2 3.74Å; I219-F229 HydrophobicContact CD1-CD1 4.36Å; I219-F229 HydrophobicContact CG2-CD1 4.07Å; I219-F229 HydrophobicContact CG2-CE1 3.76Å; I219-F232 HydrophobicContact CD1-CB 3.83Å; I219-F232 HydrophobicContact CD1-CG 4.26Å; I219-V265 HydrophobicContact CG2-CG2 3.89Å; I219-Y268 HydrophobicContact CD1-CD2 4.05Å; I219-Y268 HydrophobicContact CD1-CE1 4.4Å; I219-Y268 HydrophobicContact CD1-CE2 3.7Å; I219-Y268 HydrophobicContact CG1-CD1 4.33Å; I219-Y268 HydrophobicContact CG1-CE1 3.97Å; I219-Y268 HydrophobicContact CG1-CE2 4.18Å; I219-Y268 HydrophobicContact CG2-CD1 3.77Å; I219-Y268 HydrophobicContact CG2-CD2 4.19Å; I219-Y268 HydrophobicContact CG2-CE1 4.26Å; I219-Y268 HydrophobicContact CG2-CG 3.72Å
220	L	90.3	Very high	91.4	Very high	34 Å²	34	38.8 Å²	38.8	18%	0.178	21%	0.21	C	C	.	.	H	α-helix	trans	-59.8	-44.6	176.4	-69.6	165.6	0	0	0	111.8	A216 A217 N222 E223 E260 T264 V265	A216-L220 WeakPolarHBondContact O-CG 3.18Å; A216-L220 PolarHBondContact O-N 2.93Å; A217-L220 PolarHBondContact O-N 2.88Å; L220-N222 PolarHBondContact O-N 2.91Å; L220-E223 PolarHBondContact O-N 3.25Å; L220-E260 HydrophobicContact CD1-CB 3.82Å; L220-E260 WeakPolarHBondContact CD1-OE2 3.29Å; L220-E260 HydrophobicContact CD2-CB 4.43Å; L220-E260 WeakPolarHBondContact CD2-O 3.47Å; L220-T264 HydrophobicContact CD2-CG2 4.38Å; L220-V265 HydrophobicContact CD2-CG2 3.8Å
221	A	90.2	Very high	91.6	Very high	61 Å²	61	41 Å²	41	50%	0.504	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-7.5	175	0	0	0	0	0	114.2	P177 A217 I219	P177-A221 HydrophobicContact CB-CB 4.14Å; P177-A221 HydrophobicContact CG-CB 4.3Å; A217-A221 VanDerWaalsContact O-CB 3.31Å; A217-A221 WeakPolarHBondContact O-CB 3.49Å; A217-A221 PolarHBondContact O-N 3.14Å; I219-A221 PolarHBondContact O-N 2.87Å
222	N	89.6	Confident	91.7	Very high	21 Å²	21	41 Å²	41	11%	0.112	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	37.7	179.9	-75	-88.3	0	0	0	112.1	Q184 F218 I219 L220 H224 N225 L228 F229	Q184-N222 PolarHBondContact NE2-OD1 2.7Å; F218-N222 PolarHBondContact O-N 3.48Å; F218-N222 PolarHBondContact O-ND2 3Å; I219-N222 CarbonylContact O-C 3.55Å; I219-N222 WeakPolarHBondContact O-CA 3.12Å; I219-N222 PolarHBondContact O-N 3.46Å; L220-N222 PolarHBondContact O-N 2.91Å; N222-H224 VanDerWaalsContact C-N 3.31Å; N222-H224 PolarHBondContact O-N 2.79Å; N222-N225 HydrophobicContact CB-CB 4.33Å; N222-N225 WeakPolarHBondContact O-CB 3.31Å; N222-N225 PolarHBondContact O-N 2.86Å; N222-L228 HydrophobicContact CB-CD1 3.94Å; N222-L228 HydrophobicContact CB-CD2 4.23Å; N222-F229 WeakPolarHBondContact O-CE1 3.46Å; N222-F229 WeakPolarHBondContact O-CZ 3.29Å
223	E	86.1	Confident	91.7	Very high	89 Å²	89	41.5 Å²	41.5	42%	0.416	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43.6	-43.4	-169.3	-164.9	-170.9	140.2	0	0	116.3	L220 F229 T264 V265	L220-E223 PolarHBondContact O-N 3.25Å; E223-F229 WeakPolarHBondContact O-CE2 3.44Å; E223-F229 WeakPolarHBondContact O-CZ 3.26Å; E223-T264 HydrophobicContact CG-CG2 3.98Å; E223-V265 HydrophobicContact CB-CG1 4.06Å; E223-V265 HydrophobicContact CG-CG1 3.58Å
224	H	81.9	Confident	91.7	Very high	157 Å²	157	44.2 Å²	44.2	73%	0.727	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	2.8	-175.2	-51.5	-43.3	0	0	0	113.9	N222 V226	N222-H224 VanDerWaalsContact C-N 3.31Å; N222-H224 PolarHBondContact O-N 2.79Å; H224-V226 PolarHBondContact O-N 2.67Å; H224-V226 VanDerWaalsContact O-N 3.16Å
225	N	87.3	Confident	91.8	Very high	46 Å²	46	44.3 Å²	44.3	25%	0.246	24%	0.243	C	C	.	.			trans	-92.4	76	-171.2	-163.1	-22.3	0	0	0	113.1	N222 A227 L228 F229	N222-N225 HydrophobicContact CB-CB 4.33Å; N222-N225 WeakPolarHBondContact O-CB 3.31Å; N222-N225 PolarHBondContact O-N 2.86Å; N225-A227 PolarHBondContact O-N 3.49Å; N225-A227 VanDerWaalsContact O-N 3.14Å; N225-A227 PolarHBondContact OD1-N 2.94Å; N225-L228 HydrophobicContact CB-CB 3.86Å; N225-L228 VanDerWaalsContact CG-CB 3.41Å; N225-L228 WeakPolarHBondContact O-CA 3.32Å; N225-L228 WeakPolarHBondContact O-CB 3.38Å; N225-L228 PolarHBondContact O-N 3.18Å; N225-L228 WeakPolarHBondContact OD1-CB 3.39Å; N225-L228 PolarHBondContact OD1-N 2.91Å; N225-F229 WeakPolarHBondContact O-CG 3.41Å; N225-F229 PolarHBondContact O-N 2.93Å
226	V	87.4	Confident	91.8	Very high	75 Å²	75	44.2 Å²	44.2	46%	0.455	24%	0.243	S	C	.	.	H	α-helix	trans	-57.4	-32.1	179.8	-177.1	0	0	0	0	113.1	H224 F229 K230	H224-V226 PolarHBondContact O-N 2.67Å; H224-V226 VanDerWaalsContact O-N 3.16Å; V226-F229 PolarHBondContact O-N 3.15Å; V226-K230 WeakPolarHBondContact O-CG 3.47Å; V226-K230 PolarHBondContact O-N 2.56Å; V226-K230 VanDerWaalsContact O-N 3.14Å
227	A	89.3	Confident	91.9	Very high	72 Å²	72	47.1 Å²	47.1	60%	0.595	26%	0.262	S	S	*	.	H	α-helix	trans	-67	-39.7	176.5	0	0	0	0	0	111.7	N225 K230 H231	N225-A227 PolarHBondContact O-N 3.49Å; N225-A227 VanDerWaalsContact O-N 3.14Å; N225-A227 PolarHBondContact OD1-N 2.94Å; A227-K230 PolarHBondContact O-N 3.17Å; A227-H231 PolarHBondContact O-N 3.41Å; A227-H231 VanDerWaalsContact O-N 3.09Å
228	L	92.6	Very high	92.1	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-43.1	173.6	-175.2	154.1	0	0	0	110.9	L188 F218 I219 N222 N225 K230 H231 F232	L188-L228 HydrophobicContact CD1-CD1 3.92Å; L188-L228 HydrophobicContact CD1-CG 4.43Å; F218-L228 HydrophobicContact CE1-CD1 3.96Å; F218-L228 HydrophobicContact CE1-CD2 4.07Å; F218-L228 HydrophobicContact CE1-CG 4.37Å; F218-L228 HydrophobicContact CZ-CD1 3.97Å; I219-L228 HydrophobicContact CD1-CD2 3.74Å; N222-L228 HydrophobicContact CB-CD1 3.94Å; N222-L228 HydrophobicContact CB-CD2 4.23Å; N225-L228 HydrophobicContact CB-CB 3.86Å; N225-L228 VanDerWaalsContact CG-CB 3.41Å; N225-L228 WeakPolarHBondContact O-CA 3.32Å; N225-L228 WeakPolarHBondContact O-CB 3.38Å; N225-L228 PolarHBondContact O-N 3.18Å; N225-L228 WeakPolarHBondContact OD1-CB 3.39Å; N225-L228 PolarHBondContact OD1-N 2.91Å; L228-K230 VanDerWaalsContact C-N 3.31Å; L228-K230 PolarHBondContact O-N 3.24Å; L228-H231 CarbonylContact O-C 3.11Å; L228-H231 WeakPolarHBondContact O-CA 3.27Å; L228-H231 WeakPolarHBondContact O-CB 3.49Å; L228-H231 PolarHBondContact O-N 2.92Å; L228-F232 HydrophobicContact CD2-CD2 3.76Å; L228-F232 HydrophobicContact CD2-CE2 4.23Å; L228-F232 HydrophobicContact CD2-CG 4.31Å; L228-F232 HydrophobicContact CG-CD2 3.81Å; L228-F232 HydrophobicContact CG-CE2 3.97Å; L228-F232 WeakPolarHBondContact O-CD2 2.92Å; L228-F232 PolarHBondContact O-N 3.38Å
229	F	93.4	Very high	92.3	Very high	13 Å²	13	47.7 Å²	47.7	6%	0.057	27%	0.269	C	S	.	.	H	α-helix	trans	-56.2	-46	176.5	-60.5	-17.2	0	0	0	112.1	I219 N222 E223 N225 V226 H231 F232 A233 V265 Y268	I219-F229 HydrophobicContact CD1-CD1 4.36Å; I219-F229 HydrophobicContact CG2-CD1 4.07Å; I219-F229 HydrophobicContact CG2-CE1 3.76Å; N222-F229 WeakPolarHBondContact O-CE1 3.46Å; N222-F229 WeakPolarHBondContact O-CZ 3.29Å; E223-F229 WeakPolarHBondContact O-CE2 3.44Å; E223-F229 WeakPolarHBondContact O-CZ 3.26Å; N225-F229 WeakPolarHBondContact O-CG 3.41Å; N225-F229 PolarHBondContact O-N 2.93Å; V226-F229 PolarHBondContact O-N 3.15Å; F229-H231 VanDerWaalsContact C-N 3.3Å; F229-H231 PolarHBondContact O-N 3.13Å; F229-F232 PolarHBondContact O-N 3.35Å; F229-A233 PolarHBondContact O-N 3Å; F229-V265 HydrophobicContact CZ-CB 4.19Å; F229-V265 HydrophobicContact CZ-CG1 3.98Å; F229-Y268 HydrophobicContact CB-CD2 3.94Å; F229-Y268 HydrophobicContact CD1-CD2 4.23Å; F229-Y268 HydrophobicContact CG-CD2 4.26Å
230	K	92.4	Very high	92.4	Very high	155 Å²	155	48.2 Å²	48.2	67%	0.674	27%	0.272	S	S	*	.	H	α-helix	trans	-61.2	-38.9	174.3	-71.1	176.5	-179.5	177	0	112.3	V226 A227 L228	V226-K230 WeakPolarHBondContact O-CG 3.47Å; V226-K230 PolarHBondContact O-N 2.56Å; V226-K230 VanDerWaalsContact O-N 3.14Å; A227-K230 PolarHBondContact O-N 3.17Å; L228-K230 VanDerWaalsContact C-N 3.31Å; L228-K230 PolarHBondContact O-N 3.24Å
231	H	94.1	Very high	92.7	Very high	59 Å²	59	51.1 Å²	51.1	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-69.9	-33.7	178.5	-172.4	80.4	0	0	0	112.7	D189 K192 A227 L228 F229	D189-H231 IonicContact OD1-CE1 3.12Å; D189-H231 PolarHBondContact OD1-CE1 3.43Å; D189-H231 IonicContact OD1-NE2 3.98Å; D189-H231 PolarHBondContact OD1-NE2 3.46Å; K192-H231 WeakPolarHBondContact CE-O 3.34Å; K192-H231 PolarHBondContact NZ-O 3.13Å; A227-H231 PolarHBondContact O-N 3.41Å; A227-H231 VanDerWaalsContact O-N 3.09Å; L228-H231 CarbonylContact O-C 3.11Å; L228-H231 WeakPolarHBondContact O-CA 3.27Å; L228-H231 WeakPolarHBondContact O-CB 3.49Å; L228-H231 PolarHBondContact O-N 2.92Å; F229-H231 VanDerWaalsContact C-N 3.3Å; F229-H231 PolarHBondContact O-N 3.13Å
232	F	96.4	Very high	93	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-94.7	-4.5	-178.7	-79.6	-102.7	0	0	0	114.4	L188 I191 K192 L195 F218 I219 L228 F229 D234 L235 Y268	L188-F232 HydrophobicContact CD1-CE2 3.59Å; L188-F232 HydrophobicContact CD1-CZ 3.94Å; L188-F232 HydrophobicContact CD2-CE2 4.24Å; L188-F232 HydrophobicContact CG-CE2 3.67Å; L188-F232 HydrophobicContact CG-CZ 4.12Å; I191-F232 HydrophobicContact CG2-CE1 4.29Å; I191-F232 HydrophobicContact CG2-CZ 4.33Å; K192-F232 HydrophobicContact CB-CE1 3.91Å; K192-F232 HydrophobicContact CB-CZ 4Å; K192-F232 HydrophobicContact CG-CD1 4.47Å; K192-F232 HydrophobicContact CG-CE1 4.27Å; L195-F232 HydrophobicContact CD1-CE1 4.26Å; F218-F232 HydrophobicContact CD1-CD1 4.46Å; F218-F232 HydrophobicContact CD1-CE1 4.07Å; F218-F232 HydrophobicContact CD1-CZ 4.23Å; F218-F232 HydrophobicContact CE1-CD1 4.39Å; F218-F232 HydrophobicContact CE1-CD2 4.41Å; F218-F232 AromaticContact CE1-CE1 3.8Å; F218-F232 HydrophobicContact CE1-CE1 3.8Å; F218-F232 AromaticContact CE1-CE2 3.81Å; F218-F232 HydrophobicContact CE1-CE2 3.81Å; F218-F232 AromaticContact CE1-CZ 3.48Å; F218-F232 HydrophobicContact CE1-CZ 3.48Å; F218-F232 VanDerWaalsContact CE1-CZ 3.48Å; F218-F232 HydrophobicContact CZ-CZ 4.27Å; I219-F232 HydrophobicContact CD1-CB 3.83Å; I219-F232 HydrophobicContact CD1-CG 4.26Å; L228-F232 HydrophobicContact CD2-CD2 3.76Å; L228-F232 HydrophobicContact CD2-CE2 4.23Å; L228-F232 HydrophobicContact CD2-CG 4.31Å; L228-F232 HydrophobicContact CG-CD2 3.81Å; L228-F232 HydrophobicContact CG-CE2 3.97Å; L228-F232 WeakPolarHBondContact O-CD2 2.92Å; L228-F232 PolarHBondContact O-N 3.38Å; F229-F232 PolarHBondContact O-N 3.35Å; F232-D234 PolarHBondContact O-N 2.8Å; F232-L235 HydrophobicContact CD1-CD1 4.21Å; F232-L235 HydrophobicContact CD1-CD2 3.96Å; F232-L235 WeakPolarHBondContact O-CB 3.26Å; F232-L235 PolarHBondContact O-N 3.44Å; F232-Y268 HydrophobicContact CB-CE2 4.15Å; F232-Y268 PolarHBondContact O-OH 3.24Å
233	A	95.1	Very high	93.3	Very high	10 Å²	10	47.3 Å²	47.3	8%	0.083	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-50.2	-31.9	179.4	0	0	0	0	0	114.3	F229 L235 L236 P271	F229-A233 PolarHBondContact O-N 3Å; A233-L235 PolarHBondContact O-N 3.22Å; A233-L235 VanDerWaalsContact O-N 3.15Å; A233-L236 WeakPolarHBondContact O-CB 3.05Å; A233-L236 PolarHBondContact O-N 3.12Å; A233-L236 VanDerWaalsContact O-N 3.13Å; A233-P271 HydrophobicContact CB-CB 4.15Å; A233-P271 HydrophobicContact CB-CG 3.86Å
234	D	94.4	Very high	93.9	Very high	114 Å²	114	44.1 Å²	44.1	61%	0.61	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-62.3	-18.8	177.5	-58.7	-37.6	0	0	0	114	K192 F232	K192-D234 IonicContact NZ-OD2 3.4Å; K192-D234 PolarHBondContact NZ-OD2 3.3Å; F232-D234 PolarHBondContact O-N 2.8Å
235	L	96.3	Very high	94.4	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-81.9	-24	178.5	-83.8	71.8	0	0	0	112.2	K192 L195 V196 M199 T215 F232 A233 G238 F239	K192-L235 HydrophobicContact CD-CD1 4.34Å; K192-L235 HydrophobicContact CG-CD1 3.67Å; L195-L235 HydrophobicContact CB-CD2 3.59Å; L195-L235 HydrophobicContact CD1-CD2 3.85Å; L195-L235 HydrophobicContact CG-CD2 4.4Å; V196-L235 HydrophobicContact CG2-CD1 3.55Å; V196-L235 HydrophobicContact CG2-CG 3.8Å; M199-L235 HydrophobicContact CE-CB 3.81Å; M199-L235 HydrophobicContact CE-CD2 3.62Å; M199-L235 HydrophobicContact CE-CG 3.58Å; T215-L235 HydrophobicContact CG2-CB 4.2Å; T215-L235 HydrophobicContact CG2-CD2 3.71Å; F232-L235 HydrophobicContact CD1-CD1 4.21Å; F232-L235 HydrophobicContact CD1-CD2 3.96Å; F232-L235 WeakPolarHBondContact O-CB 3.26Å; F232-L235 PolarHBondContact O-N 3.44Å; A233-L235 PolarHBondContact O-N 3.22Å; A233-L235 VanDerWaalsContact O-N 3.15Å; L235-G238 PolarHBondContact O-N 3.11Å; L235-F239 PolarHBondContact O-N 3.32Å
236	L	96.3	Very high	94.7	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.5	-41.5	-171.2	-174.2	56.8	0	0	0	113.2	A233 G238 F239 L240 Y268 L269 H272	A233-L236 WeakPolarHBondContact O-CB 3.05Å; A233-L236 PolarHBondContact O-N 3.12Å; A233-L236 VanDerWaalsContact O-N 3.13Å; L236-G238 VanDerWaalsContact C-N 3.3Å; L236-G238 PolarHBondContact O-N 3.29Å; L236-F239 HydrophobicContact CD1-CD1 4.05Å; L236-F239 WeakPolarHBondContact O-CB 3.38Å; L236-F239 PolarHBondContact O-N 3Å; L236-L240 HydrophobicContact CD1-CG 4.32Å; L236-L240 HydrophobicContact CG-CD1 4.49Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 3.35Å; L236-Y268 HydrophobicContact CD1-CE1 4.01Å; L236-L269 HydrophobicContact CD1-CD2 3.74Å; L236-L269 HydrophobicContact CD2-CD2 4.15Å; L236-H272 HydrophobicContact CD2-CB 3.72Å; L236-H272 HydrophobicContact CG-CB 4.1Å
237	P	97.1	Very high	95	Very high	60 Å²	60	33.4 Å²	33.4	39%	0.39	19%	0.188	S	C	.	.	H	α-helix	trans	-59.8	-38.2	173.9	-25.2	35.9	0	0	0	113.7	Q241	P237-Q241 PolarHBondContact O-N 3.16Å; P237-Q241 VanDerWaalsContact O-N 3.14Å
238	G	95.4	Very high	95.3	Very high	29 Å²	29	33.7 Å²	33.7	30%	0.299	17%	0.174	S	C	.	.	H	α-helix	trans	-69.3	-38.7	176.8	0	0	0	0	0	112.3	L235 L236 Q241 A242	L235-G238 PolarHBondContact O-N 3.11Å; L236-G238 VanDerWaalsContact C-N 3.3Å; L236-G238 PolarHBondContact O-N 3.29Å; G238-Q241 PolarHBondContact O-N 3.31Å; G238-A242 PolarHBondContact O-N 3.46Å
239	F	97.8	Very high	95.4	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-49.2	173.8	175.3	-96.1	0	0	0	111.6	M199 A212 A216 L235 L236 Q241 A242 V243 V254 L258 I261	M199-F239 HydrophobicContact SD-CB 4.45Å; A212-F239 HydrophobicContact CB-CD2 3.77Å; A212-F239 HydrophobicContact CB-CE2 4.18Å; A212-F239 WeakPolarHBondContact O-CD2 3.37Å; A212-F239 WeakPolarHBondContact O-CE2 3.23Å; A216-F239 HydrophobicContact CB-CE2 3.98Å; A216-F239 HydrophobicContact CB-CZ 4.34Å; L235-F239 PolarHBondContact O-N 3.32Å; L236-F239 HydrophobicContact CD1-CD1 4.05Å; L236-F239 WeakPolarHBondContact O-CB 3.38Å; L236-F239 PolarHBondContact O-N 3Å; F239-Q241 VanDerWaalsContact C-N 3.29Å; F239-Q241 PolarHBondContact O-N 2.9Å; F239-A242 WeakPolarHBondContact O-CA 3.33Å; F239-A242 WeakPolarHBondContact O-CB 3.38Å; F239-A242 PolarHBondContact O-N 3.01Å; F239-V243 HydrophobicContact CD1-CG2 4.34Å; F239-V243 HydrophobicContact CE1-CG2 3.92Å; F239-V243 HydrophobicContact CZ-CG2 4.1Å; F239-V243 PolarHBondContact O-N 3.43Å; F239-V254 HydrophobicContact CD2-CG1 4.32Å; F239-V254 HydrophobicContact CE2-CG1 3.73Å; F239-V254 HydrophobicContact CZ-CG1 4.11Å; F239-L258 HydrophobicContact CE1-CB 3.91Å; F239-L258 HydrophobicContact CE1-CD1 3.86Å; F239-L258 HydrophobicContact CE1-CG 4.37Å; F239-L258 HydrophobicContact CZ-CB 4.1Å; F239-I261 HydrophobicContact CE1-CD1 3.96Å; F239-I261 HydrophobicContact CE2-CD1 4.35Å; F239-I261 HydrophobicContact CZ-CD1 3.78Å
240	L	97.9	Very high	95.3	Very high	12 Å²	12	46 Å²	46	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-60.2	-37.9	177.1	-66.1	176.9	0	0	0	112.2	L236 A242 V243 N244 L258 A275 T276 L279	L236-L240 HydrophobicContact CD1-CG 4.32Å; L236-L240 HydrophobicContact CG-CD1 4.49Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 3.35Å; L240-A242 VanDerWaalsContact C-N 3.32Å; L240-A242 PolarHBondContact O-N 2.99Å; L240-V243 PolarHBondContact O-N 3.07Å; L240-N244 PolarHBondContact O-N 3.45Å; L240-L258 HydrophobicContact CD2-CD1 4.41Å; L240-L258 HydrophobicContact CD2-CD2 4.27Å; L240-A275 HydrophobicContact CD1-CB 3.95Å; L240-T276 HydrophobicContact CD2-CG2 4.04Å; L240-L279 HydrophobicContact CB-CD2 3.95Å; L240-L279 HydrophobicContact CD2-CD2 4.05Å; L240-L279 WeakPolarHBondContact O-CD2 3.43Å
241	Q	96.3	Very high	95.1	Very high	95 Å²	95	40.9 Å²	40.9	44%	0.444	22%	0.215	S	C	.	.	H	α-helix	trans	-65.4	-36.2	173.7	-171.6	62.6	57.2	0	0	112.2	P237 G238 F239 N244 D245	P237-Q241 PolarHBondContact O-N 3.16Å; P237-Q241 VanDerWaalsContact O-N 3.14Å; G238-Q241 PolarHBondContact O-N 3.31Å; F239-Q241 VanDerWaalsContact C-N 3.29Å; F239-Q241 PolarHBondContact O-N 2.9Å; Q241-N244 PolarHBondContact NE2-ND2 3.45Å; Q241-N244 PolarHBondContact O-N 2.98Å; Q241-D245 PolarHBondContact NE2-OD1 3.05Å; Q241-D245 WeakPolarHBondContact O-CB 3.32Å; Q241-D245 PolarHBondContact O-N 3.07Å
242	A	95.8	Very high	95	Very high	2 Å²	2	39.6 Å²	39.6	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-68.4	-37	176.2	0	0	0	0	0	112.3	A212 G238 F239 L240 D245 S246	A212-A242 HydrophobicContact CB-CB 3.55Å; G238-A242 PolarHBondContact O-N 3.46Å; F239-A242 WeakPolarHBondContact O-CA 3.33Å; F239-A242 WeakPolarHBondContact O-CB 3.38Å; F239-A242 PolarHBondContact O-N 3.01Å; L240-A242 VanDerWaalsContact C-N 3.32Å; L240-A242 PolarHBondContact O-N 2.99Å; A242-D245 PolarHBondContact O-N 3.24Å; A242-S246 WeakPolarHBondContact O-CB 3.49Å; A242-S246 PolarHBondContact O-N 3.41Å; A242-S246 PolarHBondContact O-OG 3.31Å
243	V	97	Very high	94.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.9	-55.2	170.2	174.5	0	0	0	0	109.7	F239 L240 D245 S246 C247 V254 L255 L258 L279 L283	F239-V243 HydrophobicContact CD1-CG2 4.34Å; F239-V243 HydrophobicContact CE1-CG2 3.92Å; F239-V243 HydrophobicContact CZ-CG2 4.1Å; F239-V243 PolarHBondContact O-N 3.43Å; L240-V243 PolarHBondContact O-N 3.07Å; V243-D245 VanDerWaalsContact C-N 3.31Å; V243-D245 PolarHBondContact O-N 2.94Å; V243-S246 PolarHBondContact O-N 3.39Å; V243-C247 PolarHBondContact O-N 3.18Å; V243-C247 PolarHBondContact O-SG 2.84Å; V243-V254 HydrophobicContact CB-CG1 4.5Å; V243-V254 HydrophobicContact CG2-CB 4.09Å; V243-V254 HydrophobicContact CG2-CG1 3.56Å; V243-L255 HydrophobicContact CG1-CB 4.19Å; V243-L255 HydrophobicContact CG1-CD1 3.88Å; V243-L258 HydrophobicContact CG1-CD2 4.47Å; V243-L258 HydrophobicContact CG2-CB 4.38Å; V243-L258 HydrophobicContact CG2-CD2 4.46Å; V243-L279 HydrophobicContact CB-CD2 4.04Å; V243-L279 HydrophobicContact CG1-CD2 4.05Å; V243-L283 HydrophobicContact CG1-CD1 4Å
244	N	96.8	Very high	94.6	Very high	22 Å²	22	40.5 Å²	40.5	12%	0.118	22%	0.216	C	C	.	.	H	α-helix	trans	-51.6	-50.8	178.7	176.2	90	0	0	0	111.8	L240 Q241 Y248 L279 K282	L240-N244 PolarHBondContact O-N 3.45Å; Q241-N244 PolarHBondContact NE2-ND2 3.45Å; Q241-N244 PolarHBondContact O-N 2.98Å; N244-Y248 WeakPolarHBondContact O-CD2 3.43Å; N244-Y248 PolarHBondContact O-N 3.41Å; N244-L279 HydrophobicContact CB-CD1 3.8Å; N244-K282 PolarHBondContact OD1-NZ 3.35Å
245	D	94	Very high	94.7	Very high	47 Å²	47	35.1 Å²	35.1	25%	0.251	19%	0.187	S	C	.	.	H	α-helix	trans	-68.2	-39.2	-175	-65.8	-3.2	0	0	0	112.5	R208 Q241 A242 V243 Q249	R208-D245 IonicContact CZ-OD2 3.42Å; R208-D245 IonicContact NH1-OD2 3.51Å; R208-D245 PolarHBondContact NH1-OD2 2.89Å; R208-D245 IonicContact NH2-OD2 2.94Å; R208-D245 PolarHBondContact NH2-OD2 2.96Å; Q241-D245 PolarHBondContact NE2-OD1 3.05Å; Q241-D245 WeakPolarHBondContact O-CB 3.32Å; Q241-D245 PolarHBondContact O-N 3.07Å; A242-D245 PolarHBondContact O-N 3.24Å; V243-D245 VanDerWaalsContact C-N 3.31Å; V243-D245 PolarHBondContact O-N 2.94Å; D245-Q249 WeakPolarHBondContact O-CG 3.49Å; D245-Q249 PolarHBondContact O-N 3.46Å
246	S	92.9	Very high	94.5	Very high	5 Å²	5	38 Å²	38	4%	0.035	20%	0.2	C	C	.	.	H	α-helix	trans	-67.5	-41.6	-179.6	-52.2	0	0	0	0	111	T209 A242 V243 Y248 Q249 N250 D251	T209-S246 PolarHBondContact OG1-OG 3.12Å; A242-S246 WeakPolarHBondContact O-CB 3.49Å; A242-S246 PolarHBondContact O-N 3.41Å; A242-S246 PolarHBondContact O-OG 3.31Å; V243-S246 PolarHBondContact O-N 3.39Å; S246-Y248 PolarHBondContact O-N 2.88Å; S246-Q249 CarbonylContact O-C 3.47Å; S246-Q249 WeakPolarHBondContact O-CA 3.47Å; S246-Q249 PolarHBondContact O-N 2.89Å; S246-N250 PolarHBondContact O-N 3.02Å; S246-D251 CarbonylContact C-O 3.6Å; S246-D251 PolarHBondContact O-N 2.98Å; S246-D251 VanDerWaalsContact O-O 3.13Å
247	C	94.6	Very high	94.5	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-58.4	-46	178.2	-68.9	0	0	0	0	112.1	V243 Q249 N250 D251 L283 Q293	V243-C247 PolarHBondContact O-N 3.18Å; V243-C247 PolarHBondContact O-SG 2.84Å; C247-Q249 PolarHBondContact O-N 3.01Å; C247-Q249 VanDerWaalsContact O-N 3.13Å; C247-N250 PolarHBondContact O-N 3.41Å; C247-D251 PolarHBondContact N-O 3.4Å; C247-L283 HydrophobicContact CB-CD1 4.47Å; C247-L283 HydrophobicContact CB-CD2 4.01Å; C247-Q293 PolarHBondContact O-NE2 3.37Å
248	Y	95.6	Very high	94.5	Very high	78 Å²	78	35.3 Å²	35.3	31%	0.306	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-1.6	176.7	-71	-68.3	0	0	0	114.4	N244 S246 K282 L283 D286 L289	N244-Y248 WeakPolarHBondContact O-CD2 3.43Å; N244-Y248 PolarHBondContact O-N 3.41Å; S246-Y248 PolarHBondContact O-N 2.88Å; Y248-K282 WeakPolarHBondContact OH-CE 3.36Å; Y248-L283 HydrophobicContact CE2-CD2 4.08Å; Y248-D286 VanDerWaalsContact CE1-OD2 3.27Å; Y248-D286 WeakPolarHBondContact CE1-OD2 3.31Å; Y248-D286 PolarHBondContact OH-OD2 2.92Å; Y248-L289 HydrophobicContact CD1-CD2 3.85Å; Y248-L289 HydrophobicContact CE1-CD2 4.08Å; Y248-L289 HydrophobicContact CE1-CG 4.38Å
249	Q	93.1	Very high	94.5	Very high	158 Å²	158	35 Å²	35	74%	0.738	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.9	15	168.5	-61.6	-57.2	-58.4	0	0	112.3	D245 S246 C247 D251	D245-Q249 WeakPolarHBondContact O-CG 3.49Å; D245-Q249 PolarHBondContact O-N 3.46Å; S246-Q249 CarbonylContact O-C 3.47Å; S246-Q249 WeakPolarHBondContact O-CA 3.47Å; S246-Q249 PolarHBondContact O-N 2.89Å; C247-Q249 PolarHBondContact O-N 3.01Å; C247-Q249 VanDerWaalsContact O-N 3.13Å; Q249-D251 VanDerWaalsContact C-N 3.3Å; Q249-D251 PolarHBondContact O-N 3.38Å
250	N	91.5	Very high	94.3	Very high	117 Å²	117	38.4 Å²	38.4	63%	0.626	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	37	-178	-159.4	81.9	0	0	0	112.8	S246 C247 N290	S246-N250 PolarHBondContact O-N 3.02Å; C247-N250 PolarHBondContact O-N 3.41Å; N250-N290 PolarHBondContact OD1-ND2 3.09Å
251	D	89.2	Confident	94.2	Very high	46 Å²	46	37.9 Å²	37.9	25%	0.246	19%	0.188	C	C	.	.			trans	-122	113.9	173.4	179.4	13.2	0	0	0	109.8	T209 S246 C247 Q249 S253	T209-D251 WeakPolarHBondContact CG2-OD2 3.3Å; S246-D251 CarbonylContact C-O 3.6Å; S246-D251 PolarHBondContact O-N 2.98Å; S246-D251 VanDerWaalsContact O-O 3.13Å; C247-D251 PolarHBondContact N-O 3.4Å; Q249-D251 VanDerWaalsContact C-N 3.3Å; Q249-D251 PolarHBondContact O-N 3.38Å; D251-S253 WeakPolarHBondContact OD1-CB 3.49Å; D251-S253 PolarHBondContact OD1-N 3.05Å; D251-S253 PolarHBondContact OD1-OG 3.38Å
252	D	91.4	Very high	94.2	Very high	32 Å²	32	33.3 Å²	33.3	17%	0.171	17%	0.167	C	C	.	.			trans	-93	-1.7	179.5	66.4	-25.3	0	0	0	113	V254 L255 K256 Q293 L296	D252-V254 VanDerWaalsContact C-N 3.32Å; D252-V254 PolarHBondContact O-N 3.41Å; D252-L255 WeakPolarHBondContact O-CB 3.48Å; D252-L255 PolarHBondContact O-N 2.85Å; D252-K256 PolarHBondContact O-N 3.18Å; D252-K256 IonicContact OD1-NZ 2.72Å; D252-K256 WeakPolarHBondContact OD2-CE 3.34Å; D252-K256 IonicContact OD2-NZ 3.06Å; D252-K256 PolarHBondContact OD2-NZ 2.78Å; D252-Q293 HydrophobicContact CB-CG 4.22Å; D252-L296 HydrophobicContact CB-CD1 3.92Å
253	S	89.1	Confident	94	Very high	29 Å²	29	37.5 Å²	37.5	20%	0.203	19%	0.189	C	C	.	.	H	α-helix	trans	-56.5	-40.7	-173.1	-58.2	0	0	0	0	113.9	D251 S257	D251-S253 WeakPolarHBondContact OD1-CB 3.49Å; D251-S253 PolarHBondContact OD1-N 3.05Å; D251-S253 PolarHBondContact OD1-OG 3.38Å; S253-S257 PolarHBondContact O-N 3.32Å; S253-S257 PolarHBondContact O-OG 3Å
254	V	94.3	Very high	93.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-80.1	-27.4	-179.6	-161.6	0	0	0	0	111.1	T209 A212 R213 F239 V243 D252 S257 L258	T209-V254 HydrophobicContact CG2-CG2 3.55Å; A212-V254 HydrophobicContact CB-CG1 3.62Å; R213-V254 HydrophobicContact CG-CG2 4.16Å; F239-V254 HydrophobicContact CD2-CG1 4.32Å; F239-V254 HydrophobicContact CE2-CG1 3.73Å; F239-V254 HydrophobicContact CZ-CG1 4.11Å; V243-V254 HydrophobicContact CB-CG1 4.5Å; V243-V254 HydrophobicContact CG2-CB 4.09Å; V243-V254 HydrophobicContact CG2-CG1 3.56Å; D252-V254 VanDerWaalsContact C-N 3.32Å; D252-V254 PolarHBondContact O-N 3.41Å; V254-S257 WeakPolarHBondContact O-CB 3.46Å; V254-S257 PolarHBondContact O-N 3.5Å; V254-L258 PolarHBondContact O-N 2.82Å
255	L	96.3	Very high	93.4	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-69.5	-42.5	175.1	-178.6	60.3	0	0	0	110.5	V243 D252 S257 L258 V259 L283 Q293 L296 A297 V300	V243-L255 HydrophobicContact CG1-CB 4.19Å; V243-L255 HydrophobicContact CG1-CD1 3.88Å; D252-L255 WeakPolarHBondContact O-CB 3.48Å; D252-L255 PolarHBondContact O-N 2.85Å; L255-S257 VanDerWaalsContact C-N 3.29Å; L255-S257 PolarHBondContact O-N 2.76Å; L255-L258 HydrophobicContact CD1-CD2 4.35Å; L255-L258 WeakPolarHBondContact O-CA 3.36Å; L255-L258 WeakPolarHBondContact O-CB 3.49Å; L255-L258 PolarHBondContact O-N 3.46Å; L255-V259 PolarHBondContact O-N 2.82Å; L255-L283 HydrophobicContact CD1-CD1 4.46Å; L255-Q293 WeakPolarHBondContact CD2-O 3.31Å; L255-L296 HydrophobicContact CD2-CB 3.56Å; L255-L296 HydrophobicContact CG-CB 3.96Å; L255-A297 HydrophobicContact CD2-CB 4.23Å; L255-V300 HydrophobicContact CD1-CG2 4.15Å
256	K	93.3	Very high	93.5	Very high	62 Å²	62	37.7 Å²	37.7	27%	0.27	19%	0.193	S	C	.	.	H	α-helix	trans	-53.5	-46.3	169.1	-74	171.6	168.8	155.1	0	111.5	D252 L258 V259 E260 L296	D252-K256 PolarHBondContact O-N 3.18Å; D252-K256 IonicContact OD1-NZ 2.72Å; D252-K256 WeakPolarHBondContact OD2-CE 3.34Å; D252-K256 IonicContact OD2-NZ 3.06Å; D252-K256 PolarHBondContact OD2-NZ 2.78Å; K256-L258 VanDerWaalsContact C-N 3.25Å; K256-L258 PolarHBondContact O-N 3.21Å; K256-V259 WeakPolarHBondContact O-CB 3.28Å; K256-V259 PolarHBondContact O-N 3.46Å; K256-V259 VanDerWaalsContact O-N 3.09Å; K256-E260 WeakPolarHBondContact O-CG 3.46Å; K256-E260 PolarHBondContact O-N 3.28Å; K256-L296 HydrophobicContact CG-CD1 4.05Å; K256-L296 HydrophobicContact CG-CD2 4.04Å
257	S	94.4	Very high	93.4	Very high	4 Å²	4	42.2 Å²	42.2	3%	0.028	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-27.8	173.7	-64.3	0	0	0	0	114.4	S253 V254 L255 I261	S253-S257 PolarHBondContact O-N 3.32Å; S253-S257 PolarHBondContact O-OG 3Å; V254-S257 WeakPolarHBondContact O-CB 3.46Å; V254-S257 PolarHBondContact O-N 3.5Å; L255-S257 VanDerWaalsContact C-N 3.29Å; L255-S257 PolarHBondContact O-N 2.76Å; S257-I261 VanDerWaalsContact O-CG1 3.24Å; S257-I261 WeakPolarHBondContact O-CG1 3.3Å; S257-I261 PolarHBondContact O-N 3.28Å; S257-I261 VanDerWaalsContact O-N 3.15Å
258	L	97.8	Very high	93.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-74.6	-36.7	173.9	176.1	60.7	0	0	0	111.4	F239 L240 V243 V254 L255 K256 I261 A262 L269 T276 V300	F239-L258 HydrophobicContact CE1-CB 3.91Å; F239-L258 HydrophobicContact CE1-CD1 3.86Å; F239-L258 HydrophobicContact CE1-CG 4.37Å; F239-L258 HydrophobicContact CZ-CB 4.1Å; L240-L258 HydrophobicContact CD2-CD1 4.41Å; L240-L258 HydrophobicContact CD2-CD2 4.27Å; V243-L258 HydrophobicContact CG1-CD2 4.47Å; V243-L258 HydrophobicContact CG2-CB 4.38Å; V243-L258 HydrophobicContact CG2-CD2 4.46Å; V254-L258 PolarHBondContact O-N 2.82Å; L255-L258 HydrophobicContact CD1-CD2 4.35Å; L255-L258 WeakPolarHBondContact O-CA 3.36Å; L255-L258 WeakPolarHBondContact O-CB 3.49Å; L255-L258 PolarHBondContact O-N 3.46Å; K256-L258 VanDerWaalsContact C-N 3.25Å; K256-L258 PolarHBondContact O-N 3.21Å; L258-I261 PolarHBondContact O-N 3.16Å; L258-A262 WeakPolarHBondContact O-CB 3.42Å; L258-A262 PolarHBondContact O-N 3.21Å; L258-L269 HydrophobicContact CD1-CD1 4.34Å; L258-L269 HydrophobicContact CD1-CD2 3.91Å; L258-T276 HydrophobicContact CD1-CG2 3.79Å; L258-T276 HydrophobicContact CD2-CG2 4.2Å; L258-V300 HydrophobicContact CB-CG2 4.47Å; L258-V300 HydrophobicContact CD2-CG1 4.2Å; L258-V300 HydrophobicContact CD2-CG2 4.03Å; L258-V300 HydrophobicContact CG-CG1 4.06Å; L258-V300 HydrophobicContact CG-CG2 3.9Å
259	V	96.1	Very high	93.6	Very high	23 Å²	23	38.5 Å²	38.5	14%	0.139	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-48.8	171.7	177.5	0	0	0	0	110	L255 K256 I261 A262 D263 L296 E299 V300	L255-V259 PolarHBondContact O-N 2.82Å; K256-V259 WeakPolarHBondContact O-CB 3.28Å; K256-V259 PolarHBondContact O-N 3.46Å; K256-V259 VanDerWaalsContact O-N 3.09Å; V259-I261 VanDerWaalsContact C-N 3.3Å; V259-I261 PolarHBondContact O-N 3.39Å; V259-A262 WeakPolarHBondContact O-CA 3.4Å; V259-A262 WeakPolarHBondContact O-CB 3.5Å; V259-A262 PolarHBondContact O-N 3.15Å; V259-D263 PolarHBondContact O-N 2.79Å; V259-L296 HydrophobicContact CG2-CD2 4.24Å; V259-E299 HydrophobicContact CG1-CG 3.89Å; V259-E299 HydrophobicContact CG2-CB 4.34Å; V259-E299 HydrophobicContact CG2-CG 4.4Å; V259-V300 HydrophobicContact CG2-CG2 3.54Å
260	E	92.8	Very high	93.7	Very high	72 Å²	72	34.2 Å²	34.2	34%	0.336	17%	0.174	S	C	.	.	H	α-helix	trans	-56.3	-41.8	175.7	-67.1	166.1	-164.5	0	0	112.2	L220 K256 D263 T264	L220-E260 HydrophobicContact CD1-CB 3.82Å; L220-E260 WeakPolarHBondContact CD1-OE2 3.29Å; L220-E260 HydrophobicContact CD2-CB 4.43Å; L220-E260 WeakPolarHBondContact CD2-O 3.47Å; K256-E260 WeakPolarHBondContact O-CG 3.46Å; K256-E260 PolarHBondContact O-N 3.28Å; E260-D263 PolarHBondContact O-N 3.49Å; E260-T264 PolarHBondContact O-N 3.38Å; E260-T264 PolarHBondContact O-OG1 3.01Å
261	I	95.5	Very high	93.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-42.5	175.4	-72.6	168.7	0	0	0	111.4	A216 F239 S257 L258 V259 D263 V265 Y268 L269	A216-I261 HydrophobicContact CB-CD1 3.66Å; A216-I261 HydrophobicContact CB-CG1 4.11Å; F239-I261 HydrophobicContact CE1-CD1 3.96Å; F239-I261 HydrophobicContact CE2-CD1 4.35Å; F239-I261 HydrophobicContact CZ-CD1 3.78Å; S257-I261 VanDerWaalsContact O-CG1 3.24Å; S257-I261 WeakPolarHBondContact O-CG1 3.3Å; S257-I261 PolarHBondContact O-N 3.28Å; S257-I261 VanDerWaalsContact O-N 3.15Å; L258-I261 PolarHBondContact O-N 3.16Å; V259-I261 VanDerWaalsContact C-N 3.3Å; V259-I261 PolarHBondContact O-N 3.39Å; I261-D263 VanDerWaalsContact C-N 3.29Å; I261-V265 HydrophobicContact CB-CG2 4.35Å; I261-V265 HydrophobicContact CG1-CG2 4.48Å; I261-V265 HydrophobicContact CG2-CG2 4.09Å; I261-V265 CarbonylContact O-C 3.54Å; I261-V265 WeakPolarHBondContact O-CA 3.41Å; I261-V265 WeakPolarHBondContact O-CG2 3.45Å; I261-V265 PolarHBondContact O-N 3.43Å; I261-V265 VanDerWaalsContact O-N 3.08Å; I261-Y268 HydrophobicContact CG2-CD1 4.02Å; I261-L269 HydrophobicContact CG2-CD1 3.93Å; I261-L269 HydrophobicContact CG2-CD2 3.64Å; I261-L269 HydrophobicContact CG2-CG 3.63Å
262	A	96.3	Very high	94.3	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-36.9	178.9	0	0	0	0	0	111.5	L258 V259 P266 L269 V300 T303 L304 T307	L258-A262 WeakPolarHBondContact O-CB 3.42Å; L258-A262 PolarHBondContact O-N 3.21Å; V259-A262 WeakPolarHBondContact O-CA 3.4Å; V259-A262 WeakPolarHBondContact O-CB 3.5Å; V259-A262 PolarHBondContact O-N 3.15Å; A262-P266 WeakPolarHBondContact O-CB 3.13Å; A262-P266 WeakPolarHBondContact O-CD 3.45Å; A262-L269 HydrophobicContact CB-CD1 4.16Å; A262-V300 HydrophobicContact CB-CG1 4.35Å; A262-T303 HydrophobicContact CB-CG2 4.25Å; A262-L304 HydrophobicContact CB-CD2 4.01Å; A262-L304 HydrophobicContact CB-CG 3.9Å; A262-T307 PolarHBondContact O-OG1 3.26Å
263	D	92.4	Very high	94.5	Very high	89 Å²	89	31.8 Å²	31.8	48%	0.476	16%	0.163	S	C	.	.	H	α-helix	trans	-70.9	-61.4	178.8	-175	42.7	0	0	0	112.2	V259 E260 I261 T303 T307	V259-D263 PolarHBondContact O-N 2.79Å; E260-D263 PolarHBondContact O-N 3.49Å; I261-D263 VanDerWaalsContact C-N 3.29Å; D263-T303 VanDerWaalsContact CA-CG2 3.46Å; D263-T303 HydrophobicContact CB-CG2 3.64Å; D263-T307 WeakPolarHBondContact O-CG2 3.38Å
264	T	88.4	Confident	94.9	Very high	56 Å²	56	33.5 Å²	33.5	34%	0.344	17%	0.168	S	C	.	.	H	α-helix	trans	-85.5	-35	-168.4	-38.3	0	0	0	0	113.2	L220 E223 E260	L220-T264 HydrophobicContact CD2-CG2 4.38Å; E223-T264 HydrophobicContact CG-CG2 3.98Å; E260-T264 PolarHBondContact O-N 3.38Å; E260-T264 PolarHBondContact O-OG1 3.01Å
265	V	93.1	Very high	95.1	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.024	19%	0.187	C	C	.	.			trans	-137	48.8	-169.6	-67.2	0	0	0	0	113.8	I219 L220 E223 F229 I261 K267 Y268	I219-V265 HydrophobicContact CG2-CG2 3.89Å; L220-V265 HydrophobicContact CD2-CG2 3.8Å; E223-V265 HydrophobicContact CB-CG1 4.06Å; E223-V265 HydrophobicContact CG-CG1 3.58Å; F229-V265 HydrophobicContact CZ-CB 4.19Å; F229-V265 HydrophobicContact CZ-CG1 3.98Å; I261-V265 HydrophobicContact CB-CG2 4.35Å; I261-V265 HydrophobicContact CG1-CG2 4.48Å; I261-V265 HydrophobicContact CG2-CG2 4.09Å; I261-V265 CarbonylContact O-C 3.54Å; I261-V265 WeakPolarHBondContact O-CA 3.41Å; I261-V265 WeakPolarHBondContact O-CG2 3.45Å; I261-V265 PolarHBondContact O-N 3.43Å; I261-V265 VanDerWaalsContact O-N 3.08Å; V265-K267 PolarHBondContact O-N 3.47Å; V265-Y268 WeakPolarHBondContact O-CB 3.41Å; V265-Y268 PolarHBondContact O-N 2.89Å
266	P	94.4	Very high	95.2	Very high	14 Å²	14	35.7 Å²	35.7	9%	0.091	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-59.4	-27.7	-171.7	21.1	-33.2	0	0	0	114	A262 Y268 L269 L304 A308	A262-P266 WeakPolarHBondContact O-CB 3.13Å; A262-P266 WeakPolarHBondContact O-CD 3.45Å; P266-Y268 PolarHBondContact O-N 3.45Å; P266-Y268 VanDerWaalsContact O-N 3.14Å; P266-L269 WeakPolarHBondContact O-CB 3.49Å; P266-L269 PolarHBondContact O-N 3.36Å; P266-L304 HydrophobicContact CB-CD2 3.74Å; P266-A308 HydrophobicContact CB-CB 3.51Å; P266-A308 HydrophobicContact CG-CB 3.72Å
267	K	92.3	Very high	95.5	Very high	99 Å²	99	32.8 Å²	32.8	43%	0.43	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-60.3	-23.3	177.1	-68.4	-169.8	179.3	-173.3	0	113.3	V265 L269 R270 M311 D835	V265-K267 PolarHBondContact O-N 3.47Å; K267-L269 VanDerWaalsContact C-N 3.28Å; K267-L269 PolarHBondContact O-N 3.04Å; K267-R270 VanDerWaalsContact O-CB 3.3Å; K267-R270 WeakPolarHBondContact O-CB 3.45Å; K267-R270 PolarHBondContact O-N 3.41Å; K267-M311 HydrophobicContact CG-SD 4.25Å; K267-D835 IonicContact NZ-OD2 3.35Å; K267-D835 PolarHBondContact NZ-OD2 2.72Å
268	Y	96.4	Very high	95.7	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.008	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-65.5	-31.6	172.8	174.4	-115.4	0	0	0	112.4	I219 F229 F232 L236 I261 V265 P266 R270 P271	I219-Y268 HydrophobicContact CD1-CD2 4.05Å; I219-Y268 HydrophobicContact CD1-CE1 4.4Å; I219-Y268 HydrophobicContact CD1-CE2 3.7Å; I219-Y268 HydrophobicContact CG1-CD1 4.33Å; I219-Y268 HydrophobicContact CG1-CE1 3.97Å; I219-Y268 HydrophobicContact CG1-CE2 4.18Å; I219-Y268 HydrophobicContact CG2-CD1 3.77Å; I219-Y268 HydrophobicContact CG2-CD2 4.19Å; I219-Y268 HydrophobicContact CG2-CE1 4.26Å; I219-Y268 HydrophobicContact CG2-CG 3.72Å; F229-Y268 HydrophobicContact CB-CD2 3.94Å; F229-Y268 HydrophobicContact CD1-CD2 4.23Å; F229-Y268 HydrophobicContact CG-CD2 4.26Å; F232-Y268 HydrophobicContact CB-CE2 4.15Å; F232-Y268 PolarHBondContact O-OH 3.24Å; L236-Y268 HydrophobicContact CD1-CE1 4.01Å; I261-Y268 HydrophobicContact CG2-CD1 4.02Å; V265-Y268 WeakPolarHBondContact O-CB 3.41Å; V265-Y268 PolarHBondContact O-N 2.89Å; P266-Y268 PolarHBondContact O-N 3.45Å; P266-Y268 VanDerWaalsContact O-N 3.14Å; Y268-R270 VanDerWaalsContact C-N 3.29Å; Y268-R270 PolarHBondContact O-N 2.87Å; Y268-P271 WeakPolarHBondContact O-CD 3.31Å
269	L	97.5	Very high	95.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-21.1	-179.3	-62.2	173.5	0	0	0	113	L236 L258 I261 A262 P266 K267 P271 H272 L273 T276 L304	L236-L269 HydrophobicContact CD1-CD2 3.74Å; L236-L269 HydrophobicContact CD2-CD2 4.15Å; L258-L269 HydrophobicContact CD1-CD1 4.34Å; L258-L269 HydrophobicContact CD1-CD2 3.91Å; I261-L269 HydrophobicContact CG2-CD1 3.93Å; I261-L269 HydrophobicContact CG2-CD2 3.64Å; I261-L269 HydrophobicContact CG2-CG 3.63Å; A262-L269 HydrophobicContact CB-CD1 4.16Å; P266-L269 WeakPolarHBondContact O-CB 3.49Å; P266-L269 PolarHBondContact O-N 3.36Å; K267-L269 VanDerWaalsContact C-N 3.28Å; K267-L269 PolarHBondContact O-N 3.04Å; L269-P271 VanDerWaalsContact O-N 3.12Å; L269-H272 CarbonylContact O-C 3.1Å; L269-H272 VanDerWaalsContact O-C 3.27Å; L269-H272 PolarHBondContact O-N 3.2Å; L269-L273 HydrophobicContact CB-CD1 4.39Å; L269-L273 WeakPolarHBondContact O-CA 3.47Å; L269-L273 PolarHBondContact O-N 2.93Å; L269-T276 HydrophobicContact CD1-CG2 4.27Å; L269-T276 HydrophobicContact CD2-CG2 4.23Å; L269-L304 HydrophobicContact CD1-CD2 4.19Å
270	R	94.4	Very high	95.8	Very high	67 Å²	67	36.1 Å²	36.1	25%	0.253	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-44.1	-47.2	-175	-170.3	-168.4	-170.5	113.3	14	115	K267 Y268 H272 L273 M311 E836 D837	K267-R270 VanDerWaalsContact O-CB 3.3Å; K267-R270 WeakPolarHBondContact O-CB 3.45Å; K267-R270 PolarHBondContact O-N 3.41Å; Y268-R270 VanDerWaalsContact C-N 3.29Å; Y268-R270 PolarHBondContact O-N 2.87Å; R270-H272 PolarHBondContact O-N 3.05Å; R270-L273 PolarHBondContact O-N 3.44Å; R270-M311 HydrophobicContact CB-CE 3.66Å; R270-M311 HydrophobicContact CG-CE 4.1Å; R270-E836 VanDerWaalsContact CZ-CG 3.47Å; R270-E836 IonicContact CZ-OE1 3.39Å; R270-E836 IonicContact CZ-OE2 3.42Å; R270-E836 VanDerWaalsContact CZ-OE2 3.31Å; R270-E836 IonicContact NE-OE1 3.84Å; R270-E836 PolarHBondContact NE-OE1 3.36Å; R270-E836 VanDerWaalsContact NE-OE1 3.17Å; R270-E836 IonicContact NE-OE2 2.71Å; R270-E836 VanDerWaalsContact NH1-CD 3.3Å; R270-E836 IonicContact NH1-OE1 2.73Å; R270-E836 PolarHBondContact NH1-OE1 3.08Å; R270-E836 VanDerWaalsContact NH1-OE1 3.09Å; R270-E836 IonicContact NH2-OE1 3.5Å; R270-E836 PolarHBondContact NH2-OE1 3.07Å; R270-E836 IonicContact NH2-OE2 3.38Å; R270-E836 PolarHBondContact NH2-OE2 2.8Å; R270-D837 IonicContact CZ-OD1 2.7Å; R270-D837 IonicContact CZ-OD2 3.09Å; R270-D837 IonicContact NH1-OD1 2.67Å; R270-D837 PolarHBondContact NH1-OD1 2.9Å; R270-D837 IonicContact NH1-OD2 3.19Å; R270-D837 PolarHBondContact NH1-OD2 3.05Å; R270-D837 IonicContact NH2-OD1 3.16Å; R270-D837 PolarHBondContact NH2-OD1 2.93Å; R270-D837 IonicContact NH2-OD2 3.17Å
271	P	96.1	Very high	96.1	Very high	75 Å²	75	33.3 Å²	33.3	49%	0.487	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-62.8	-25	-176.7	-22.6	36.4	0	0	0	114	A233 Y268 L269	A233-P271 HydrophobicContact CB-CB 4.15Å; A233-P271 HydrophobicContact CB-CG 3.86Å; Y268-P271 WeakPolarHBondContact O-CD 3.31Å; L269-P271 VanDerWaalsContact O-N 3.12Å
272	H	97.3	Very high	96.2	Very high	63 Å²	63	38 Å²	38	29%	0.292	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-131.4	34	179.7	-62.2	-77.5	0	0	0	111.9	L236 L269 R270 E274 A275 T276	L236-H272 HydrophobicContact CD2-CB 3.72Å; L236-H272 HydrophobicContact CG-CB 4.1Å; L269-H272 CarbonylContact O-C 3.1Å; L269-H272 VanDerWaalsContact O-C 3.27Å; L269-H272 PolarHBondContact O-N 3.2Å; R270-H272 PolarHBondContact O-N 3.05Å; H272-E274 PolarHBondContact O-N 3.45Å; H272-A275 HydrophobicContact CB-CB 4.39Å; H272-A275 PolarHBondContact O-N 3.2Å; H272-A275 VanDerWaalsContact O-N 3.13Å; H272-T276 PolarHBondContact O-N 2.95Å; H272-T276 PolarHBondContact O-OG1 3.43Å
273	L	97.1	Very high	96.3	Very high	7 Å²	7	38 Å²	38	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-46.9	-174.5	-177.2	59.6	0	0	0	111.8	L269 R270 A275 T276 L277 L304 M311	L269-L273 HydrophobicContact CB-CD1 4.39Å; L269-L273 WeakPolarHBondContact O-CA 3.47Å; L269-L273 PolarHBondContact O-N 2.93Å; R270-L273 PolarHBondContact O-N 3.44Å; L273-A275 VanDerWaalsContact C-N 3.28Å; L273-A275 PolarHBondContact O-N 3.2Å; L273-T276 WeakPolarHBondContact O-CB 3.3Å; L273-T276 PolarHBondContact O-N 2.92Å; L273-T276 VanDerWaalsContact O-N 3.08Å; L273-L277 HydrophobicContact CD1-CD1 4.16Å; L273-L277 HydrophobicContact CD1-CD2 4.46Å; L273-L277 HydrophobicContact CD1-CG 4.02Å; L273-L277 HydrophobicContact CG-CD1 3.88Å; L273-L277 HydrophobicContact CG-CG 4.2Å; L273-L277 WeakPolarHBondContact O-CB 3.33Å; L273-L277 VanDerWaalsContact O-CG 3.29Å; L273-L277 WeakPolarHBondContact O-CG 3.29Å; L273-L277 PolarHBondContact O-N 3.08Å; L273-L304 HydrophobicContact CD1-CD1 4Å; L273-M311 HydrophobicContact CD2-CB 3.99Å; L273-M311 HydrophobicContact CD2-CE 3.89Å
274	E	97.4	Very high	96.6	Very high	64 Å²	64	33.8 Å²	33.8	30%	0.299	17%	0.173	S	C	.	.	H	α-helix	trans	-56.3	-42	176	-176	70.9	-156.7	0	0	111.8	H272 T276 L277 Q278 H315 N317 I318	H272-E274 PolarHBondContact O-N 3.45Å; E274-T276 VanDerWaalsContact C-N 3.35Å; E274-L277 PolarHBondContact O-N 3.34Å; E274-Q278 HydrophobicContact CG-CG 4.27Å; E274-Q278 VanDerWaalsContact O-CB 3.29Å; E274-Q278 WeakPolarHBondContact O-CB 3.41Å; E274-Q278 WeakPolarHBondContact O-CG 3.5Å; E274-Q278 PolarHBondContact O-N 3.01Å; E274-Q278 PolarHBondContact OE1-NE2 2.8Å; E274-H315 IonicContact OE2-CE1 3.25Å; E274-H315 PolarHBondContact OE2-CE1 3.1Å; E274-H315 IonicContact OE2-CG 2.67Å; E274-H315 IonicContact OE2-ND1 2.92Å; E274-H315 PolarHBondContact OE2-ND1 3.05Å; E274-N317 PolarHBondContact OE1-ND2 2.83Å; E274-I318 WeakPolarHBondContact OE1-CD1 3.31Å
275	A	98.2	Very high	97	Very high	48 Å²	48	32.7 Å²	32.7	40%	0.397	17%	0.173	S	C	.	.	H	α-helix	trans	-68.2	-36.3	179	0	0	0	0	0	112.2	L240 H272 L273 L279	L240-A275 HydrophobicContact CD1-CB 3.95Å; H272-A275 HydrophobicContact CB-CB 4.39Å; H272-A275 PolarHBondContact O-N 3.2Å; H272-A275 VanDerWaalsContact O-N 3.13Å; L273-A275 VanDerWaalsContact C-N 3.28Å; L273-A275 PolarHBondContact O-N 3.2Å; A275-L279 WeakPolarHBondContact O-CB 3.11Å; A275-L279 PolarHBondContact O-N 3.16Å; A275-L279 VanDerWaalsContact O-N 3.08Å
276	T	98.5	Very high	97.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-52.6	174.8	-53.1	0	0	0	0	110	L240 L258 L269 H272 L273 E274 Q278 L279 S280 V300	L240-T276 HydrophobicContact CD2-CG2 4.04Å; L258-T276 HydrophobicContact CD1-CG2 3.79Å; L258-T276 HydrophobicContact CD2-CG2 4.2Å; L269-T276 HydrophobicContact CD1-CG2 4.27Å; L269-T276 HydrophobicContact CD2-CG2 4.23Å; H272-T276 PolarHBondContact O-N 2.95Å; H272-T276 PolarHBondContact O-OG1 3.43Å; L273-T276 WeakPolarHBondContact O-CB 3.3Å; L273-T276 PolarHBondContact O-N 2.92Å; L273-T276 VanDerWaalsContact O-N 3.08Å; E274-T276 VanDerWaalsContact C-N 3.35Å; T276-Q278 PolarHBondContact O-N 3.16Å; T276-L279 PolarHBondContact O-N 3.11Å; T276-S280 PolarHBondContact O-N 3.09Å; T276-S280 PolarHBondContact O-OG 3.1Å; T276-V300 HydrophobicContact CG2-CG1 4.43Å
277	L	98.4	Very high	97.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-42.4	179.9	-68.9	177.3	0	0	0	112.6	L273 E274 L279 S280 L281 I301 L304 L312 H315 I318	L273-L277 HydrophobicContact CD1-CD1 4.16Å; L273-L277 HydrophobicContact CD1-CD2 4.46Å; L273-L277 HydrophobicContact CD1-CG 4.02Å; L273-L277 HydrophobicContact CG-CD1 3.88Å; L273-L277 HydrophobicContact CG-CG 4.2Å; L273-L277 WeakPolarHBondContact O-CB 3.33Å; L273-L277 VanDerWaalsContact O-CG 3.29Å; L273-L277 WeakPolarHBondContact O-CG 3.29Å; L273-L277 PolarHBondContact O-N 3.08Å; E274-L277 PolarHBondContact O-N 3.34Å; L277-L279 VanDerWaalsContact C-N 3.34Å; L277-L279 PolarHBondContact O-N 3.3Å; L277-S280 PolarHBondContact O-N 3.36Å; L277-L281 VanDerWaalsContact O-CB 3.29Å; L277-L281 WeakPolarHBondContact O-CB 3.17Å; L277-L281 PolarHBondContact O-N 2.68Å; L277-I301 HydrophobicContact CD2-CG1 4.32Å; L277-I301 HydrophobicContact CD2-CG2 4.49Å; L277-L304 HydrophobicContact CD2-CD1 3.76Å; L277-L312 HydrophobicContact CD1-CD1 3.63Å; L277-L312 HydrophobicContact CD2-CD1 3.7Å; L277-L312 HydrophobicContact CG-CD1 4.34Å; L277-H315 HydrophobicContact CD1-CB 3.72Å; L277-I318 HydrophobicContact CB-CB 4.33Å; L277-I318 HydrophobicContact CB-CG1 3.97Å; L277-I318 HydrophobicContact CB-CG2 3.91Å; L277-I318 HydrophobicContact CD1-CB 4.39Å; L277-I318 HydrophobicContact CD1-CG1 4.22Å
278	Q	98.4	Very high	97.4	Very high	79 Å²	79	39.3 Å²	39.3	37%	0.369	22%	0.224	S	C	.	.	H	α-helix	trans	-64.5	-37.7	176.2	-70.6	-79	-2.1	0	0	112.3	E274 T276 K282 I318	E274-Q278 HydrophobicContact CG-CG 4.27Å; E274-Q278 VanDerWaalsContact O-CB 3.29Å; E274-Q278 WeakPolarHBondContact O-CB 3.41Å; E274-Q278 WeakPolarHBondContact O-CG 3.5Å; E274-Q278 PolarHBondContact O-N 3.01Å; E274-Q278 PolarHBondContact OE1-NE2 2.8Å; T276-Q278 PolarHBondContact O-N 3.16Å; Q278-K282 VanDerWaalsContact O-CB 3.29Å; Q278-K282 WeakPolarHBondContact O-CB 3.01Å; Q278-K282 PolarHBondContact O-N 3.33Å; Q278-I318 VanDerWaalsContact CD-CD1 3.47Å; Q278-I318 HydrophobicContact CG-CD1 3.89Å
279	L	98.6	Very high	97.4	Very high	18 Å²	18	40 Å²	40	9%	0.094	23%	0.227	C	C	.	.	H	α-helix	trans	-66.4	-48.9	175.5	175.4	62.1	0	0	0	111.1	L240 V243 N244 A275 T276 L277 L281 K282 L283	L240-L279 HydrophobicContact CB-CD2 3.95Å; L240-L279 HydrophobicContact CD2-CD2 4.05Å; L240-L279 WeakPolarHBondContact O-CD2 3.43Å; V243-L279 HydrophobicContact CB-CD2 4.04Å; V243-L279 HydrophobicContact CG1-CD2 4.05Å; N244-L279 HydrophobicContact CB-CD1 3.8Å; A275-L279 WeakPolarHBondContact O-CB 3.11Å; A275-L279 PolarHBondContact O-N 3.16Å; A275-L279 VanDerWaalsContact O-N 3.08Å; T276-L279 PolarHBondContact O-N 3.11Å; L277-L279 VanDerWaalsContact C-N 3.34Å; L277-L279 PolarHBondContact O-N 3.3Å; L279-L281 VanDerWaalsContact C-N 3.32Å; L279-L281 PolarHBondContact O-N 3.01Å; L279-K282 WeakPolarHBondContact O-CB 3.49Å; L279-K282 PolarHBondContact O-N 3.15Å; L279-L283 HydrophobicContact CD1-CD1 3.9Å; L279-L283 HydrophobicContact CD1-CD2 4.41Å; L279-L283 HydrophobicContact CD1-CG 3.94Å; L279-L283 HydrophobicContact CG-CD1 3.98Å; L279-L283 HydrophobicContact CG-CG 4.39Å; L279-L283 WeakPolarHBondContact O-CG 3.22Å; L279-L283 PolarHBondContact O-N 3.14Å
280	S	98.6	Very high	97.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.5	-46.9	177.4	-62.5	0	0	0	0	111.4	T276 L277 K282 L283 C284 A297 V300	T276-S280 PolarHBondContact O-N 3.09Å; T276-S280 PolarHBondContact O-OG 3.1Å; L277-S280 PolarHBondContact O-N 3.36Å; S280-K282 VanDerWaalsContact C-N 3.34Å; S280-K282 PolarHBondContact O-N 2.83Å; S280-L283 PolarHBondContact O-N 3.17Å; S280-C284 WeakPolarHBondContact O-CB 3.49Å; S280-C284 PolarHBondContact O-N 2.92Å; S280-A297 WeakPolarHBondContact CB-O 3.34Å; S280-V300 WeakPolarHBondContact OG-CG1 3.42Å
281	L	98.3	Very high	97.1	Very high	13 Å²	13	43.1 Å²	43.1	7%	0.068	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-41.4	177.3	-170.6	69.5	0	0	0	112.5	L277 L279 G285 I301 I318 Q321 Q325	L277-L281 VanDerWaalsContact O-CB 3.29Å; L277-L281 WeakPolarHBondContact O-CB 3.17Å; L277-L281 PolarHBondContact O-N 2.68Å; L279-L281 VanDerWaalsContact C-N 3.32Å; L279-L281 PolarHBondContact O-N 3.01Å; L281-G285 PolarHBondContact O-N 3.11Å; L281-G285 VanDerWaalsContact O-N 3.11Å; L281-I301 HydrophobicContact CB-CD1 4.42Å; L281-I318 HydrophobicContact CD2-CG2 4.37Å; L281-Q321 HydrophobicContact CD1-CB 4.26Å; L281-Q321 HydrophobicContact CD2-CB 3.59Å; L281-Q321 HydrophobicContact CD2-CG 4.4Å; L281-Q325 HydrophobicContact CD1-CG 3.76Å
282	K	98.4	Very high	97	Very high	99 Å²	99	43.9 Å²	43.9	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-61.7	-49.5	176.3	175.7	-163.7	167.3	-165.1	0	111.3	N244 Y248 Q278 L279 S280 G285 D286	N244-K282 PolarHBondContact OD1-NZ 3.35Å; Y248-K282 WeakPolarHBondContact OH-CE 3.36Å; Q278-K282 VanDerWaalsContact O-CB 3.29Å; Q278-K282 WeakPolarHBondContact O-CB 3.01Å; Q278-K282 PolarHBondContact O-N 3.33Å; L279-K282 WeakPolarHBondContact O-CB 3.49Å; L279-K282 PolarHBondContact O-N 3.15Å; S280-K282 VanDerWaalsContact C-N 3.34Å; S280-K282 PolarHBondContact O-N 2.83Å; K282-G285 PolarHBondContact O-N 3.4Å; K282-D286 WeakPolarHBondContact O-CB 3.47Å; K282-D286 PolarHBondContact O-N 3.49Å
283	L	98.3	Very high	96.9	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-42	-177.3	-66.1	174.3	0	0	0	111	V243 C247 Y248 L255 L279 S280 G285 D286 L289 A297	V243-L283 HydrophobicContact CG1-CD1 4Å; C247-L283 HydrophobicContact CB-CD1 4.47Å; C247-L283 HydrophobicContact CB-CD2 4.01Å; Y248-L283 HydrophobicContact CE2-CD2 4.08Å; L255-L283 HydrophobicContact CD1-CD1 4.46Å; L279-L283 HydrophobicContact CD1-CD1 3.9Å; L279-L283 HydrophobicContact CD1-CD2 4.41Å; L279-L283 HydrophobicContact CD1-CG 3.94Å; L279-L283 HydrophobicContact CG-CD1 3.98Å; L279-L283 HydrophobicContact CG-CG 4.39Å; L279-L283 WeakPolarHBondContact O-CG 3.22Å; L279-L283 PolarHBondContact O-N 3.14Å; S280-L283 PolarHBondContact O-N 3.17Å; L283-G285 VanDerWaalsContact C-N 3.34Å; L283-G285 PolarHBondContact O-N 3.42Å; L283-D286 PolarHBondContact O-N 3.13Å; L283-L289 HydrophobicContact CB-CD1 4.19Å; L283-L289 HydrophobicContact CD2-CD1 3.8Å; L283-A297 HydrophobicContact CB-CB 3.62Å
284	C	98.2	Very high	96.9	Very high	1 Å²	1	42 Å²	42	1%	0.007	24%	0.237	C	C	.	.	H	α-helix	trans	-58.2	-43.9	175.3	174	0	0	0	0	112.7	S280 D286 R294 A297	S280-C284 WeakPolarHBondContact O-CB 3.49Å; S280-C284 PolarHBondContact O-N 2.92Å; C284-D286 VanDerWaalsContact C-N 3.35Å; C284-D286 PolarHBondContact O-N 3.15Å; C284-R294 PolarHBondContact O-NE 3.29Å; C284-R294 VanDerWaalsContact O-NE 3.1Å; C284-A297 HydrophobicContact CB-CB 4.15Å
285	G	96.8	Very high	96.9	Very high	33 Å²	33	40.3 Å²	40.3	34%	0.34	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-2	-177.9	0	0	0	0	0	115.6	L281 K282 L283 T287	L281-G285 PolarHBondContact O-N 3.11Å; L281-G285 VanDerWaalsContact O-N 3.11Å; K282-G285 PolarHBondContact O-N 3.4Å; L283-G285 VanDerWaalsContact C-N 3.34Å; L283-G285 PolarHBondContact O-N 3.42Å; G285-T287 PolarHBondContact O-N 3.42Å
286	D	97.4	Very high	96.7	Very high	40 Å²	40	39 Å²	39	21%	0.214	22%	0.216	C	C	.	.			trans	-88.9	105.8	-178.7	-164.2	-33.6	0	0	0	111.2	Y248 K282 L283 C284 S288 L289 R294	Y248-D286 VanDerWaalsContact CE1-OD2 3.27Å; Y248-D286 WeakPolarHBondContact CE1-OD2 3.31Å; Y248-D286 PolarHBondContact OH-OD2 2.92Å; K282-D286 WeakPolarHBondContact O-CB 3.47Å; K282-D286 PolarHBondContact O-N 3.49Å; L283-D286 PolarHBondContact O-N 3.13Å; C284-D286 VanDerWaalsContact C-N 3.35Å; C284-D286 PolarHBondContact O-N 3.15Å; D286-S288 PolarHBondContact O-N 3.46Å; D286-S288 VanDerWaalsContact O-N 3.11Å; D286-S288 VanDerWaalsContact OD1-CB 3.28Å; D286-S288 WeakPolarHBondContact OD1-CB 3.49Å; D286-S288 PolarHBondContact OD1-N 3.36Å; D286-S288 PolarHBondContact OD1-OG 3.11Å; D286-L289 HydrophobicContact CB-CD1 4.28Å; D286-L289 HydrophobicContact CB-CG 4.38Å; D286-L289 PolarHBondContact O-N 3.43Å; D286-R294 WeakPolarHBondContact O-CD 3.16Å
287	T	94.8	Very high	96.7	Very high	127 Å²	127	39 Å²	39	78%	0.779	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-1.7	-178.6	61.6	0	0	0	0	114.3	G285	G285-T287 PolarHBondContact O-N 3.42Å
288	S	96.3	Very high	96.7	Very high	89 Å²	89	39.2 Å²	39.2	62%	0.622	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-16	172.2	70.5	0	0	0	0	113.8	D286	D286-S288 PolarHBondContact O-N 3.46Å; D286-S288 VanDerWaalsContact O-N 3.11Å; D286-S288 VanDerWaalsContact OD1-CB 3.28Å; D286-S288 WeakPolarHBondContact OD1-CB 3.49Å; D286-S288 PolarHBondContact OD1-N 3.36Å; D286-S288 PolarHBondContact OD1-OG 3.11Å
289	L	96.1	Very high	96.7	Very high	16 Å²	16	37.9 Å²	37.9	8%	0.084	21%	0.211	C	C	.	.	S	Bend	trans	-87.3	156.3	175.6	-60.2	177.7	0	0	0	110.8	Y248 L283 D286 Q293 R294	Y248-L289 HydrophobicContact CD1-CD2 3.85Å; Y248-L289 HydrophobicContact CE1-CD2 4.08Å; Y248-L289 HydrophobicContact CE1-CG 4.38Å; L283-L289 HydrophobicContact CB-CD1 4.19Å; L283-L289 HydrophobicContact CD2-CD1 3.8Å; D286-L289 HydrophobicContact CB-CD1 4.28Å; D286-L289 HydrophobicContact CB-CG 4.38Å; D286-L289 PolarHBondContact O-N 3.43Å; L289-Q293 HydrophobicContact CB-CB 4.26Å; L289-R294 HydrophobicContact CB-CG 4.02Å
290	N	94.7	Very high	96.7	Very high	59 Å²	59	37 Å²	37	32%	0.316	21%	0.206	S	C	.	.			trans	-74.5	167.2	176.8	68.5	51.6	0	0	0	111.8	N250 M292 Q293 R294	N250-N290 PolarHBondContact OD1-ND2 3.09Å; N290-M292 PolarHBondContact O-N 3.47Å; N290-M292 PolarHBondContact OD1-N 2.94Å; N290-Q293 PolarHBondContact ND2-OE1 3.45Å; N290-Q293 PolarHBondContact O-N 3.23Å; N290-Q293 WeakPolarHBondContact OD1-CG 3.42Å; N290-Q293 PolarHBondContact OD1-N 3.3Å; N290-R294 WeakPolarHBondContact O-CG 3.46Å; N290-R294 PolarHBondContact O-N 3.24Å; N290-R294 VanDerWaalsContact O-N 3.16Å
291	N	92.6	Very high	96.7	Very high	73 Å²	73	37 Å²	37	39%	0.39	21%	0.206	S	C	.	.	H	α-helix	trans	-58	-49.7	-176.5	-71.3	-4.4	0	0	0	112.2	Q293 R294 Q295 N353	N291-Q293 VanDerWaalsContact C-N 3.31Å; N291-Q293 PolarHBondContact O-N 3.36Å; N291-R294 PolarHBondContact O-N 3.43Å; N291-Q295 WeakPolarHBondContact O-CB 3.38Å; N291-Q295 VanDerWaalsContact O-CG 3.29Å; N291-Q295 WeakPolarHBondContact O-CG 3.27Å; N291-Q295 PolarHBondContact O-N 3.28Å; N291-N353 PolarHBondContact OD1-ND2 3.4Å
292	M	92.1	Very high	96.7	Very high	91 Å²	91	36.4 Å²	36.4	45%	0.448	20%	0.203	S	C	.	.	H	α-helix	trans	-55	-44.3	180	-178.2	51.6	160.4	0	0	112.6	N290 R294 Q295 L296	N290-M292 PolarHBondContact O-N 3.47Å; N290-M292 PolarHBondContact OD1-N 2.94Å; M292-R294 PolarHBondContact O-N 3.42Å; M292-Q295 PolarHBondContact O-N 3.2Å; M292-L296 HydrophobicContact CE-CD1 3.98Å; M292-L296 HydrophobicContact CE-CG 4.32Å; M292-L296 HydrophobicContact CG-CD1 4.03Å; M292-L296 WeakPolarHBondContact O-CB 3.26Å; M292-L296 WeakPolarHBondContact O-CG 3.4Å; M292-L296 PolarHBondContact O-N 3.36Å; M292-L296 HydrophobicContact SD-CD1 3.98Å; M292-L296 HydrophobicContact SD-CG 4.11Å
293	Q	95.6	Very high	96.6	Very high	3 Å²	3	31.9 Å²	31.9	1%	0.014	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-37.4	177.2	-71.4	-178.9	-48.4	0	0	113	C247 D252 L255 L289 N290 N291 A297	C247-Q293 PolarHBondContact O-NE2 3.37Å; D252-Q293 HydrophobicContact CB-CG 4.22Å; L255-Q293 WeakPolarHBondContact CD2-O 3.31Å; L289-Q293 HydrophobicContact CB-CB 4.26Å; N290-Q293 PolarHBondContact ND2-OE1 3.45Å; N290-Q293 PolarHBondContact O-N 3.23Å; N290-Q293 WeakPolarHBondContact OD1-CG 3.42Å; N290-Q293 PolarHBondContact OD1-N 3.3Å; N291-Q293 VanDerWaalsContact C-N 3.31Å; N291-Q293 PolarHBondContact O-N 3.36Å; Q293-A297 WeakPolarHBondContact O-CB 3.31Å; Q293-A297 PolarHBondContact O-N 2.89Å; Q293-A297 VanDerWaalsContact O-N 3.13Å
294	R	97.8	Very high	96.6	Very high	28 Å²	28	32 Å²	32	11%	0.106	18%	0.184	C	C	.	.	H	α-helix	trans	-71.8	-40.9	178.8	-68.9	170.3	60.3	-139.2	-6.7	111.3	C284 D286 L289 N290 N291 M292 A297 L298 N353	C284-R294 PolarHBondContact O-NE 3.29Å; C284-R294 VanDerWaalsContact O-NE 3.1Å; D286-R294 WeakPolarHBondContact O-CD 3.16Å; L289-R294 HydrophobicContact CB-CG 4.02Å; N290-R294 WeakPolarHBondContact O-CG 3.46Å; N290-R294 PolarHBondContact O-N 3.24Å; N290-R294 VanDerWaalsContact O-N 3.16Å; N291-R294 PolarHBondContact O-N 3.43Å; M292-R294 PolarHBondContact O-N 3.42Å; R294-A297 PolarHBondContact O-N 3.5Å; R294-L298 PolarHBondContact O-N 3Å; R294-N353 PolarHBondContact NH1-ND2 2.91Å
295	Q	96.4	Very high	96.5	Very high	29 Å²	29	31.9 Å²	31.9	14%	0.136	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-48.8	175.2	-70.1	163.2	-13.1	0	0	111	N291 M292 A297 L298 E299 M329 D351 A356	N291-Q295 WeakPolarHBondContact O-CB 3.38Å; N291-Q295 VanDerWaalsContact O-CG 3.29Å; N291-Q295 WeakPolarHBondContact O-CG 3.27Å; N291-Q295 PolarHBondContact O-N 3.28Å; M292-Q295 PolarHBondContact O-N 3.2Å; Q295-A297 PolarHBondContact O-N 3.09Å; Q295-L298 CarbonylContact O-C 3.27Å; Q295-L298 WeakPolarHBondContact O-CA 3.28Å; Q295-L298 WeakPolarHBondContact O-CB 2.92Å; Q295-L298 PolarHBondContact O-N 3.34Å; Q295-E299 PolarHBondContact O-N 2.99Å; Q295-M329 HydrophobicContact CG-CE 3.76Å; Q295-D351 PolarHBondContact NE2-O 2.91Å; Q295-A356 HydrophobicContact CG-CB 3.81Å
296	L	95.4	Very high	96.3	Very high	21 Å²	21	34.6 Å²	34.6	11%	0.11	19%	0.187	C	C	.	.	H	α-helix	trans	-59	-33.7	174.2	-81.3	164.5	0	0	0	113	D252 L255 K256 V259 M292 E299 V300	D252-L296 HydrophobicContact CB-CD1 3.92Å; L255-L296 HydrophobicContact CD2-CB 3.56Å; L255-L296 HydrophobicContact CG-CB 3.96Å; K256-L296 HydrophobicContact CG-CD1 4.05Å; K256-L296 HydrophobicContact CG-CD2 4.04Å; V259-L296 HydrophobicContact CG2-CD2 4.24Å; M292-L296 HydrophobicContact CE-CD1 3.98Å; M292-L296 HydrophobicContact CE-CG 4.32Å; M292-L296 HydrophobicContact CG-CD1 4.03Å; M292-L296 WeakPolarHBondContact O-CB 3.26Å; M292-L296 WeakPolarHBondContact O-CG 3.4Å; M292-L296 PolarHBondContact O-N 3.36Å; M292-L296 HydrophobicContact SD-CD1 3.98Å; M292-L296 HydrophobicContact SD-CG 4.11Å; L296-E299 WeakPolarHBondContact O-CB 3.42Å; L296-E299 PolarHBondContact O-N 3.33Å; L296-V300 PolarHBondContact O-N 3.42Å
297	A	98.2	Very high	96	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71.1	-37.3	176.1	0	0	0	0	0	112.2	L255 S280 L283 C284 Q293 R294 Q295	L255-A297 HydrophobicContact CD2-CB 4.23Å; S280-A297 WeakPolarHBondContact CB-O 3.34Å; L283-A297 HydrophobicContact CB-CB 3.62Å; C284-A297 HydrophobicContact CB-CB 4.15Å; Q293-A297 WeakPolarHBondContact O-CB 3.31Å; Q293-A297 PolarHBondContact O-N 2.89Å; Q293-A297 VanDerWaalsContact O-N 3.13Å; R294-A297 PolarHBondContact O-N 3.5Å; Q295-A297 PolarHBondContact O-N 3.09Å
298	L	98.3	Very high	95.9	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-43	170.5	176.8	59.7	0	0	0	110.9	R294 Q295 V300 I301 V302 T322 M326 M329 A360	R294-L298 PolarHBondContact O-N 3Å; Q295-L298 CarbonylContact O-C 3.27Å; Q295-L298 WeakPolarHBondContact O-CA 3.28Å; Q295-L298 WeakPolarHBondContact O-CB 2.92Å; Q295-L298 PolarHBondContact O-N 3.34Å; L298-V300 VanDerWaalsContact C-N 3.28Å; L298-V300 PolarHBondContact O-N 3.14Å; L298-I301 WeakPolarHBondContact O-CB 3.24Å; L298-I301 PolarHBondContact O-N 2.97Å; L298-V302 HydrophobicContact CD1-CG2 4.15Å; L298-V302 HydrophobicContact CG-CG2 4.06Å; L298-V302 PolarHBondContact O-N 3.41Å; L298-V302 VanDerWaalsContact O-N 3.11Å; L298-T322 HydrophobicContact CD1-CG2 3.73Å; L298-M326 HydrophobicContact CD1-CG 3.72Å; L298-M326 HydrophobicContact CD1-SD 4.11Å; L298-M326 HydrophobicContact CD2-CG 3.94Å; L298-M326 HydrophobicContact CG-CG 4.47Å; L298-M329 HydrophobicContact CD2-CE 4.16Å; L298-M329 HydrophobicContact CD2-SD 3.82Å; L298-A360 HydrophobicContact CD1-CB 4.49Å; L298-A360 HydrophobicContact CD2-CB 3.54Å; L298-A360 HydrophobicContact CG-CB 3.98Å
299	E	98.1	Very high	95.8	Very high	51 Å²	51	26.1 Å²	26.1	24%	0.238	14%	0.136	C	C	.	.	H	α-helix	trans	-54	-42.8	-179.3	-170.7	56.5	-146.7	0	0	111.4	V259 Q295 L296 I301 V302 T303 R363	V259-E299 HydrophobicContact CG1-CG 3.89Å; V259-E299 HydrophobicContact CG2-CB 4.34Å; V259-E299 HydrophobicContact CG2-CG 4.4Å; Q295-E299 PolarHBondContact O-N 2.99Å; L296-E299 WeakPolarHBondContact O-CB 3.42Å; L296-E299 PolarHBondContact O-N 3.33Å; E299-I301 PolarHBondContact O-N 3.36Å; E299-I301 VanDerWaalsContact O-N 3.08Å; E299-V302 PolarHBondContact O-N 2.97Å; E299-T303 WeakPolarHBondContact O-CB 3.43Å; E299-T303 PolarHBondContact O-N 3.33Å; E299-T303 PolarHBondContact O-OG1 3.37Å; E299-T303 PolarHBondContact OE1-OG1 3.04Å; E299-T303 VanDerWaalsContact OE1-OG1 3.08Å; E299-R363 IonicContact OE1-CZ 3.31Å; E299-R363 IonicContact OE1-NH1 2.88Å; E299-R363 PolarHBondContact OE1-NH1 3Å; E299-R363 VanDerWaalsContact OE1-NH1 3.07Å; E299-R363 IonicContact OE1-NH2 3.37Å; E299-R363 PolarHBondContact OE1-NH2 2.75Å; E299-R363 IonicContact OE2-CZ 3.93Å; E299-R363 IonicContact OE2-NH1 2.56Å; E299-R363 PolarHBondContact OE2-NH1 3.45Å; E299-R363 IonicContact OE2-NH2 3.79Å
300	V	98.4	Very high	95.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-51	-40.5	174.4	177.6	0	0	0	0	112.9	L255 L258 V259 A262 T276 S280 L296 L298 L304	L255-V300 HydrophobicContact CD1-CG2 4.15Å; L258-V300 HydrophobicContact CB-CG2 4.47Å; L258-V300 HydrophobicContact CD2-CG1 4.2Å; L258-V300 HydrophobicContact CD2-CG2 4.03Å; L258-V300 HydrophobicContact CG-CG1 4.06Å; L258-V300 HydrophobicContact CG-CG2 3.9Å; V259-V300 HydrophobicContact CG2-CG2 3.54Å; A262-V300 HydrophobicContact CB-CG1 4.35Å; T276-V300 HydrophobicContact CG2-CG1 4.43Å; S280-V300 WeakPolarHBondContact OG-CG1 3.42Å; L296-V300 PolarHBondContact O-N 3.42Å; L298-V300 VanDerWaalsContact C-N 3.28Å; L298-V300 PolarHBondContact O-N 3.14Å; V300-L304 HydrophobicContact CG1-CD1 4.37Å; V300-L304 WeakPolarHBondContact O-CB 3.4Å; V300-L304 WeakPolarHBondContact O-CD1 3.39Å; V300-L304 WeakPolarHBondContact O-CG 3.19Å; V300-L304 PolarHBondContact O-N 3.38Å
301	I	98.4	Very high	95.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-77.2	-39.9	-178.7	-53.8	174.1	0	0	0	110.4	L277 L281 L298 E299 L304 S305 L312 T322 M364	L277-I301 HydrophobicContact CD2-CG1 4.32Å; L277-I301 HydrophobicContact CD2-CG2 4.49Å; L281-I301 HydrophobicContact CB-CD1 4.42Å; L298-I301 WeakPolarHBondContact O-CB 3.24Å; L298-I301 PolarHBondContact O-N 2.97Å; E299-I301 PolarHBondContact O-N 3.36Å; E299-I301 VanDerWaalsContact O-N 3.08Å; I301-L304 PolarHBondContact O-N 2.96Å; I301-S305 PolarHBondContact O-N 3.49Å; I301-L312 HydrophobicContact CG2-CD2 4.3Å; I301-T322 HydrophobicContact CD1-CG2 3.98Å; I301-T322 HydrophobicContact CG2-CG2 4.17Å; I301-M364 HydrophobicContact CB-CE 4.49Å; I301-M364 HydrophobicContact CG2-CE 3.9Å
302	V	98.1	Very high	95.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.6	-50	178.3	-178.3	0	0	0	0	110.3	L298 E299 L304 S305 E306 A360 R363 M364	L298-V302 HydrophobicContact CD1-CG2 4.15Å; L298-V302 HydrophobicContact CG-CG2 4.06Å; L298-V302 PolarHBondContact O-N 3.41Å; L298-V302 VanDerWaalsContact O-N 3.11Å; E299-V302 PolarHBondContact O-N 2.97Å; V302-L304 VanDerWaalsContact C-N 3.29Å; V302-L304 PolarHBondContact O-N 3.04Å; V302-S305 WeakPolarHBondContact O-CA 3.39Å; V302-S305 WeakPolarHBondContact O-CB 3.31Å; V302-S305 PolarHBondContact O-N 3.41Å; V302-S305 PolarHBondContact O-OG 3.41Å; V302-E306 PolarHBondContact O-N 3.02Å; V302-A360 HydrophobicContact CG2-CB 3.6Å; V302-R363 HydrophobicContact CG1-CB 3.64Å; V302-R363 VanDerWaalsContact CG1-CZ 3.47Å; V302-M364 HydrophobicContact CG2-CE 3.87Å
303	T	97.2	Very high	95.8	Very high	4 Å²	4	17.6 Å²	17.6	3%	0.025	9%	0.09	C	C	.	.	H	α-helix	trans	-56.4	-41.7	175.4	-49.9	0	0	0	0	111.8	A262 D263 E299 S305 E306 T307	A262-T303 HydrophobicContact CB-CG2 4.25Å; D263-T303 VanDerWaalsContact CA-CG2 3.46Å; D263-T303 HydrophobicContact CB-CG2 3.64Å; E299-T303 WeakPolarHBondContact O-CB 3.43Å; E299-T303 PolarHBondContact O-N 3.33Å; E299-T303 PolarHBondContact O-OG1 3.37Å; E299-T303 PolarHBondContact OE1-OG1 3.04Å; E299-T303 VanDerWaalsContact OE1-OG1 3.08Å; T303-S305 PolarHBondContact O-N 2.93Å; T303-E306 PolarHBondContact O-N 3.29Å; T303-E306 VanDerWaalsContact O-N 3.11Å; T303-T307 HydrophobicContact CG2-CG2 4.02Å; T303-T307 WeakPolarHBondContact O-CB 3.34Å; T303-T307 WeakPolarHBondContact O-CG2 3.19Å; T303-T307 PolarHBondContact O-N 2.91Å; T303-T307 PolarHBondContact O-OG1 2.8Å
304	L	97.2	Very high	95.8	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-64.9	-24.5	175.2	-78.5	173.9	0	0	0	113.2	A262 P266 L269 L273 L277 V300 I301 V302 E306 A308 A309 L312	A262-L304 HydrophobicContact CB-CD2 4.01Å; A262-L304 HydrophobicContact CB-CG 3.9Å; P266-L304 HydrophobicContact CB-CD2 3.74Å; L269-L304 HydrophobicContact CD1-CD2 4.19Å; L273-L304 HydrophobicContact CD1-CD1 4Å; L277-L304 HydrophobicContact CD2-CD1 3.76Å; V300-L304 HydrophobicContact CG1-CD1 4.37Å; V300-L304 WeakPolarHBondContact O-CB 3.4Å; V300-L304 WeakPolarHBondContact O-CD1 3.39Å; V300-L304 WeakPolarHBondContact O-CG 3.19Å; V300-L304 PolarHBondContact O-N 3.38Å; I301-L304 PolarHBondContact O-N 2.96Å; V302-L304 VanDerWaalsContact C-N 3.29Å; V302-L304 PolarHBondContact O-N 3.04Å; L304-E306 VanDerWaalsContact C-N 3.29Å; L304-A308 HydrophobicContact CD2-CB 4.27Å; L304-A308 CarbonylContact O-C 3.54Å; L304-A308 WeakPolarHBondContact O-CA 3.18Å; L304-A308 PolarHBondContact O-N 3.38Å; L304-A308 VanDerWaalsContact O-N 3.13Å; L304-A309 PolarHBondContact O-N 3.37Å; L304-A309 VanDerWaalsContact O-N 3.13Å; L304-L312 HydrophobicContact CB-CD2 4.21Å
305	S	96.7	Very high	95.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-74.3	-21.9	175.5	84	0	0	0	0	113.1	I301 V302 T303 A309 M364 G367	I301-S305 PolarHBondContact O-N 3.49Å; V302-S305 WeakPolarHBondContact O-CA 3.39Å; V302-S305 WeakPolarHBondContact O-CB 3.31Å; V302-S305 PolarHBondContact O-N 3.41Å; V302-S305 PolarHBondContact O-OG 3.41Å; T303-S305 PolarHBondContact O-N 2.93Å; S305-A309 WeakPolarHBondContact O-CB 3.23Å; S305-M364 WeakPolarHBondContact OG-CA 3.39Å; S305-G367 CarbonylContact O-C 3.59Å; S305-G367 WeakPolarHBondContact O-CA 3.47Å
306	E	93.1	Very high	95.7	Very high	89 Å²	89	24.8 Å²	24.8	42%	0.416	13%	0.127	S	C	.	.	H	α-helix	trans	-94.3	-48.9	177.7	-63.3	164.6	153.3	0	0	110.4	V302 T303 L304 R363	V302-E306 PolarHBondContact O-N 3.02Å; T303-E306 PolarHBondContact O-N 3.29Å; T303-E306 VanDerWaalsContact O-N 3.11Å; L304-E306 VanDerWaalsContact C-N 3.29Å; E306-R363 WeakPolarHBondContact OE1-CB 3.42Å; E306-R363 IonicContact OE1-CZ 2.93Å; E306-R363 IonicContact OE1-NE 3.57Å; E306-R363 PolarHBondContact OE1-NE 3.14Å; E306-R363 IonicContact OE1-NH2 3.74Å; E306-R363 PolarHBondContact OE1-NH2 2.99Å; E306-R363 IonicContact OE2-CZ 3.67Å; E306-R363 IonicContact OE2-NE 2.71Å; E306-R363 IonicContact OE2-NH2 3.05Å; E306-R363 PolarHBondContact OE2-NH2 3.42Å
307	T	91.4	Very high	95.7	Very high	52 Å²	52	27.2 Å²	27.2	32%	0.319	14%	0.14	S	C	.	.	H	α-helix	trans	-87.4	-25.3	-170.4	61.4	0	0	0	0	114	A262 D263 T303	A262-T307 PolarHBondContact O-OG1 3.26Å; D263-T307 WeakPolarHBondContact O-CG2 3.38Å; T303-T307 HydrophobicContact CG2-CG2 4.02Å; T303-T307 WeakPolarHBondContact O-CB 3.34Å; T303-T307 WeakPolarHBondContact O-CG2 3.19Å; T303-T307 PolarHBondContact O-N 2.91Å; T303-T307 PolarHBondContact O-OG1 2.8Å
308	A	92.9	Very high	95.6	Very high	12 Å²	12	27.2 Å²	27.2	10%	0.099	14%	0.14	C	C	.	.	S	Bend	trans	-146	41.8	-178.6	0	0	0	0	0	112.5	P266 L304 A310 M311 L312	P266-A308 HydrophobicContact CB-CB 3.51Å; P266-A308 HydrophobicContact CG-CB 3.72Å; L304-A308 HydrophobicContact CD2-CB 4.27Å; L304-A308 CarbonylContact O-C 3.54Å; L304-A308 WeakPolarHBondContact O-CA 3.18Å; L304-A308 PolarHBondContact O-N 3.38Å; L304-A308 VanDerWaalsContact O-N 3.13Å; A308-A310 PolarHBondContact O-N 3.46Å; A308-A310 VanDerWaalsContact O-N 3.07Å; A308-M311 HydrophobicContact CB-CB 4.24Å; A308-M311 HydrophobicContact CB-CG 4.39Å; A308-M311 HydrophobicContact CB-SD 4.04Å; A308-M311 WeakPolarHBondContact O-CA 3.12Å; A308-M311 WeakPolarHBondContact O-CB 3.32Å; A308-M311 PolarHBondContact O-N 3.48Å; A308-L312 PolarHBondContact O-N 3.35Å; A308-L312 VanDerWaalsContact O-N 3.08Å
309	A	93.2	Very high	95.5	Very high	14 Å²	14	27 Å²	27	12%	0.116	14%	0.139	C	C	.	.	H	α-helix	trans	-46.1	-44.4	-179	0	0	0	0	0	112.5	L304 S305 M311 L312 R313 G367 L368	L304-A309 PolarHBondContact O-N 3.37Å; L304-A309 VanDerWaalsContact O-N 3.13Å; S305-A309 WeakPolarHBondContact O-CB 3.23Å; A309-M311 VanDerWaalsContact C-N 3.33Å; A309-M311 PolarHBondContact O-N 2.97Å; A309-L312 CarbonylContact O-C 3.57Å; A309-L312 PolarHBondContact O-N 3.2Å; A309-L312 VanDerWaalsContact O-N 3.1Å; A309-R313 WeakPolarHBondContact O-CB 3.37Å; A309-R313 WeakPolarHBondContact O-CG 3.34Å; A309-R313 PolarHBondContact O-N 2.91Å; A309-G367 WeakPolarHBondContact CB-O 3.46Å; A309-L368 HydrophobicContact CB-CD2 4.19Å
310	A	91.6	Very high	95.5	Very high	8 Å²	8	26.5 Å²	26.5	7%	0.066	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-31.2	-178.6	0	0	0	0	0	114	A308 D837 D839 V842	A308-A310 PolarHBondContact O-N 3.46Å; A308-A310 VanDerWaalsContact O-N 3.07Å; A310-D837 HydrophobicContact CB-CB 4.11Å; A310-D837 WeakPolarHBondContact CB-O 3.42Å; A310-D839 WeakPolarHBondContact CA-OD2 3.5Å; A310-D839 VanDerWaalsContact CB-OD2 3.26Å; A310-D839 WeakPolarHBondContact CB-OD2 3.49Å; A310-V842 HydrophobicContact CB-CG2 3.82Å
311	M	93.3	Very high	95.5	Very high	8 Å²	8	30.5 Å²	30.5	4%	0.039	16%	0.162	C	C	.	.	H	α-helix	trans	-70.1	-46	169.7	-69.8	174.9	44.2	0	0	110.2	K267 R270 L273 A308 A309 R313 K314 D837	K267-M311 HydrophobicContact CG-SD 4.25Å; R270-M311 HydrophobicContact CB-CE 3.66Å; R270-M311 HydrophobicContact CG-CE 4.1Å; L273-M311 HydrophobicContact CD2-CB 3.99Å; L273-M311 HydrophobicContact CD2-CE 3.89Å; A308-M311 HydrophobicContact CB-CB 4.24Å; A308-M311 HydrophobicContact CB-CG 4.39Å; A308-M311 HydrophobicContact CB-SD 4.04Å; A308-M311 WeakPolarHBondContact O-CA 3.12Å; A308-M311 WeakPolarHBondContact O-CB 3.32Å; A308-M311 PolarHBondContact O-N 3.48Å; A309-M311 VanDerWaalsContact C-N 3.33Å; A309-M311 PolarHBondContact O-N 2.97Å; M311-R313 PolarHBondContact O-N 3.01Å; M311-K314 WeakPolarHBondContact O-CB 3Å; M311-K314 PolarHBondContact O-N 3.4Å; M311-D837 HydrophobicContact CG-CB 4.41Å; M311-D837 WeakPolarHBondContact CG-OD2 3.24Å
312	L	96.1	Very high	95.5	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-67.3	-34.3	-177.4	-172.2	57	0	0	0	112.9	L277 I301 L304 A308 A309 K314 H315 V319 L368	L277-L312 HydrophobicContact CD1-CD1 3.63Å; L277-L312 HydrophobicContact CD2-CD1 3.7Å; L277-L312 HydrophobicContact CG-CD1 4.34Å; I301-L312 HydrophobicContact CG2-CD2 4.3Å; L304-L312 HydrophobicContact CB-CD2 4.21Å; A308-L312 PolarHBondContact O-N 3.35Å; A308-L312 VanDerWaalsContact O-N 3.08Å; A309-L312 CarbonylContact O-C 3.57Å; A309-L312 PolarHBondContact O-N 3.2Å; A309-L312 VanDerWaalsContact O-N 3.1Å; L312-K314 PolarHBondContact O-N 3.04Å; L312-H315 PolarHBondContact O-N 3.26Å; L312-V319 HydrophobicContact CD1-CG2 4.12Å; L312-V319 HydrophobicContact CD2-CG2 4.44Å; L312-V319 HydrophobicContact CG-CG2 3.94Å; L312-L368 HydrophobicContact CB-CD2 4.32Å; L312-L368 HydrophobicContact CD2-CD1 4.33Å; L312-L368 HydrophobicContact CD2-CD2 4.18Å; L312-L368 HydrophobicContact CG-CD2 4.35Å
313	R	94.8	Very high	95.5	Very high	43 Å²	43	30.6 Å²	30.6	16%	0.162	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20	174	-78.4	-168.7	-80	-94.8	-4.1	113.3	A309 M311 H315 T316 G367 L368 L372 D839	A309-R313 WeakPolarHBondContact O-CB 3.37Å; A309-R313 WeakPolarHBondContact O-CG 3.34Å; A309-R313 PolarHBondContact O-N 2.91Å; M311-R313 PolarHBondContact O-N 3.01Å; R313-H315 VanDerWaalsContact C-N 3.33Å; R313-T316 WeakPolarHBondContact O-CG2 3.46Å; R313-G367 PolarHBondContact NH1-O 3.37Å; R313-L368 HydrophobicContact CG-CD2 4.09Å; R313-L372 HydrophobicContact CG-CD2 4Å; R313-D839 IonicContact CZ-OD1 2.82Å; R313-D839 IonicContact CZ-OD2 2.76Å; R313-D839 IonicContact NE-OD2 2.68Å; R313-D839 PolarHBondContact NE-OD2 3.41Å; R313-D839 VanDerWaalsContact NH2-CG 3.27Å; R313-D839 IonicContact NH2-OD1 2.77Å; R313-D839 PolarHBondContact NH2-OD1 3.08Å; R313-D839 IonicContact NH2-OD2 3.04Å; R313-D839 PolarHBondContact NH2-OD2 3.22Å
314	K	94.6	Very high	95.5	Very high	112 Å²	112	32.4 Å²	32.4	49%	0.487	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-13.4	174.5	-61	172.9	-178	176.1	0	113.3	M311 L312 E836 D837	M311-K314 WeakPolarHBondContact O-CB 3Å; M311-K314 PolarHBondContact O-N 3.4Å; L312-K314 PolarHBondContact O-N 3.04Å; K314-E836 PolarHBondContact NZ-O 2.83Å; K314-D837 IonicContact NZ-OD1 3.49Å; K314-D837 PolarHBondContact NZ-OD1 3.16Å
315	H	96.7	Very high	95.5	Very high	39 Å²	39	34.9 Å²	34.9	18%	0.181	19%	0.186	C	C	.	.			trans	-115.4	47.2	-177.1	-66.2	-92.6	0	0	0	112	E274 L277 L312 R313 N317 I318 V319	E274-H315 IonicContact OE2-CE1 3.25Å; E274-H315 PolarHBondContact OE2-CE1 3.1Å; E274-H315 IonicContact OE2-CG 2.67Å; E274-H315 IonicContact OE2-ND1 2.92Å; E274-H315 PolarHBondContact OE2-ND1 3.05Å; L277-H315 HydrophobicContact CD1-CB 3.72Å; L312-H315 PolarHBondContact O-N 3.26Å; R313-H315 VanDerWaalsContact C-N 3.33Å; H315-N317 PolarHBondContact O-N 3.15Å; H315-I318 PolarHBondContact O-N 3Å; H315-V319 PolarHBondContact O-N 3.26Å
316	T	96.1	Very high	95.6	Very high	60 Å²	60	34.9 Å²	34.9	37%	0.368	19%	0.186	S	C	.	.	H	α-helix	trans	-57.6	-25.3	-175.9	59.9	0	0	0	0	114.1	R313 I318 V319 A320 L372 M376	R313-T316 WeakPolarHBondContact O-CG2 3.46Å; T316-I318 VanDerWaalsContact C-N 3.32Å; T316-I318 PolarHBondContact O-N 3.28Å; T316-V319 PolarHBondContact O-N 3.41Å; T316-A320 VanDerWaalsContact O-CB 3.32Å; T316-A320 WeakPolarHBondContact O-CB 3.23Å; T316-A320 PolarHBondContact O-N 3.25Å; T316-L372 HydrophobicContact CG2-CD1 3.77Å; T316-L372 HydrophobicContact CG2-CD2 4.36Å; T316-M376 HydrophobicContact CG2-CE 4.43Å
317	N	95.3	Very high	95.9	Very high	71 Å²	71	31 Å²	31	38%	0.38	17%	0.168	S	C	.	.	H	α-helix	trans	-62.1	-36.3	173.5	58.2	-60.7	0	0	0	112.8	E274 H315 Q321	E274-N317 PolarHBondContact OE1-ND2 2.83Å; H315-N317 PolarHBondContact O-N 3.15Å; N317-Q321 WeakPolarHBondContact O-CG 3.29Å; N317-Q321 PolarHBondContact O-N 3.11Å; N317-Q321 PolarHBondContact O-NE2 3.29Å
318	I	96.3	Very high	96.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-77.5	-44.4	176.9	-56.7	-62.1	0	0	0	110.5	E274 L277 Q278 L281 H315 T316 A320 Q321 T322	E274-I318 WeakPolarHBondContact OE1-CD1 3.31Å; L277-I318 HydrophobicContact CB-CB 4.33Å; L277-I318 HydrophobicContact CB-CG1 3.97Å; L277-I318 HydrophobicContact CB-CG2 3.91Å; L277-I318 HydrophobicContact CD1-CB 4.39Å; L277-I318 HydrophobicContact CD1-CG1 4.22Å; Q278-I318 VanDerWaalsContact CD-CD1 3.47Å; Q278-I318 HydrophobicContact CG-CD1 3.89Å; L281-I318 HydrophobicContact CD2-CG2 4.37Å; H315-I318 PolarHBondContact O-N 3Å; T316-I318 VanDerWaalsContact C-N 3.32Å; T316-I318 PolarHBondContact O-N 3.28Å; I318-A320 VanDerWaalsContact C-N 3.26Å; I318-A320 PolarHBondContact O-N 3.42Å; I318-Q321 CarbonylContact O-C 3.5Å; I318-Q321 WeakPolarHBondContact O-CA 3.28Å; I318-Q321 PolarHBondContact O-N 3.13Å; I318-T322 PolarHBondContact O-N 3.28Å; I318-T322 PolarHBondContact O-OG1 3.2Å
319	V	97.1	Very high	96.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-54.1	-46.9	176.8	179.7	0	0	0	0	110.3	L312 H315 T316 Q321 T322 I323 M364 L368 M376	L312-V319 HydrophobicContact CD1-CG2 4.12Å; L312-V319 HydrophobicContact CD2-CG2 4.44Å; L312-V319 HydrophobicContact CG-CG2 3.94Å; H315-V319 PolarHBondContact O-N 3.26Å; T316-V319 PolarHBondContact O-N 3.41Å; V319-Q321 VanDerWaalsContact C-N 3.26Å; V319-Q321 PolarHBondContact O-N 3.28Å; V319-T322 WeakPolarHBondContact O-CB 3.32Å; V319-T322 PolarHBondContact O-N 3.35Å; V319-I323 PolarHBondContact O-N 2.7Å; V319-M364 HydrophobicContact CG1-SD 4.3Å; V319-L368 HydrophobicContact CB-CD1 4.45Å; V319-L368 HydrophobicContact CG1-CD1 3.63Å; V319-L368 HydrophobicContact CG2-CD1 3.92Å; V319-M376 HydrophobicContact CB-SD 4.39Å; V319-M376 HydrophobicContact CG1-SD 3.96Å
320	A	97.4	Very high	96.5	Very high	40 Å²	40	30.2 Å²	30.2	33%	0.331	17%	0.166	S	C	.	.	H	α-helix	trans	-61.3	-30	176.9	0	0	0	0	0	114.1	T316 I318 P324 M376	T316-A320 VanDerWaalsContact O-CB 3.32Å; T316-A320 WeakPolarHBondContact O-CB 3.23Å; T316-A320 PolarHBondContact O-N 3.25Å; I318-A320 VanDerWaalsContact C-N 3.26Å; I318-A320 PolarHBondContact O-N 3.42Å; A320-P324 WeakPolarHBondContact O-CD 3.5Å; A320-M376 HydrophobicContact CB-CG 4.5Å; A320-M376 HydrophobicContact CB-SD 3.86Å
321	Q	97.9	Very high	96.7	Very high	84 Å²	84	30.7 Å²	30.7	39%	0.393	17%	0.168	S	C	.	.	H	α-helix	trans	-83.5	-21.7	175.6	-70.5	170.8	77.8	0	0	112.9	L281 N317 I318 V319 P324	L281-Q321 HydrophobicContact CD1-CB 4.26Å; L281-Q321 HydrophobicContact CD2-CB 3.59Å; L281-Q321 HydrophobicContact CD2-CG 4.4Å; N317-Q321 WeakPolarHBondContact O-CG 3.29Å; N317-Q321 PolarHBondContact O-N 3.11Å; N317-Q321 PolarHBondContact O-NE2 3.29Å; I318-Q321 CarbonylContact O-C 3.5Å; I318-Q321 WeakPolarHBondContact O-CA 3.28Å; I318-Q321 PolarHBondContact O-N 3.13Å; V319-Q321 VanDerWaalsContact C-N 3.26Å; V319-Q321 PolarHBondContact O-N 3.28Å; Q321-P324 WeakPolarHBondContact O-CD 3.35Å
322	T	98.3	Very high	96.7	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-75.8	-36.2	179.4	-50.3	0	0	0	0	111	L298 I301 I318 V319 Q325 M326 M364	L298-T322 HydrophobicContact CD1-CG2 3.73Å; I301-T322 HydrophobicContact CD1-CG2 3.98Å; I301-T322 HydrophobicContact CG2-CG2 4.17Å; I318-T322 PolarHBondContact O-N 3.28Å; I318-T322 PolarHBondContact O-OG1 3.2Å; V319-T322 WeakPolarHBondContact O-CB 3.32Å; V319-T322 PolarHBondContact O-N 3.35Å; T322-Q325 WeakPolarHBondContact O-CA 3.34Å; T322-Q325 WeakPolarHBondContact O-CB 3.44Å; T322-Q325 PolarHBondContact O-N 3.41Å; T322-M326 HydrophobicContact CG2-CE 4.44Å; T322-M326 PolarHBondContact O-N 2.98Å; T322-M326 VanDerWaalsContact O-N 3.08Å; T322-M364 HydrophobicContact CG2-CE 3.84Å
323	I	97.8	Very high	96.4	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-52.8	-51.5	176.8	-70.4	168.1	0	0	0	112	V319 Q325 M326 L327 V373 M376 I377	V319-I323 PolarHBondContact O-N 2.7Å; I323-Q325 VanDerWaalsContact C-N 3.26Å; I323-Q325 PolarHBondContact O-N 3.07Å; I323-M326 HydrophobicContact CG1-CE 4.14Å; I323-M326 PolarHBondContact O-N 2.98Å; I323-L327 HydrophobicContact CG2-CD1 3.82Å; I323-L327 HydrophobicContact CG2-CG 4.35Å; I323-L327 VanDerWaalsContact O-CG 3.29Å; I323-L327 WeakPolarHBondContact O-CG 3.31Å; I323-L327 PolarHBondContact O-N 3.37Å; I323-V373 HydrophobicContact CD1-CG1 4.49Å; I323-M376 HydrophobicContact CD1-CB 3.38Å; I323-M376 HydrophobicContact CD1-CG 4.33Å; I323-M376 HydrophobicContact CD1-SD 4.08Å; I323-I377 HydrophobicContact CD1-CB 4.3Å; I323-I377 HydrophobicContact CG2-CB 3.97Å; I323-I377 HydrophobicContact CG2-CD1 3.96Å; I323-I377 HydrophobicContact CG2-CG1 3.75Å
324	P	97.9	Very high	96	Very high	42 Å²	42	41.1 Å²	41.1	27%	0.273	22%	0.222	S	C	.	.	H	α-helix	trans	-59.6	-28.2	173.2	-27.3	34.2	0	0	0	115.5	A320 Q321 A328	A320-P324 WeakPolarHBondContact O-CD 3.5Å; Q321-P324 WeakPolarHBondContact O-CD 3.35Å; P324-A328 VanDerWaalsContact O-CB 3.25Å; P324-A328 WeakPolarHBondContact O-CB 3.2Å; P324-A328 PolarHBondContact O-N 3Å
325	Q	98.1	Very high	95.4	Very high	54 Å²	54	42.6 Å²	42.6	25%	0.252	23%	0.23	S	C	.	.	H	α-helix	trans	-69.3	-47.3	176.3	-58.5	-53.8	-42.8	0	0	110.8	L281 T322 I323 L327 A328 M329	L281-Q325 HydrophobicContact CD1-CG 3.76Å; T322-Q325 WeakPolarHBondContact O-CA 3.34Å; T322-Q325 WeakPolarHBondContact O-CB 3.44Å; T322-Q325 PolarHBondContact O-N 3.41Å; I323-Q325 VanDerWaalsContact C-N 3.26Å; I323-Q325 PolarHBondContact O-N 3.07Å; Q325-L327 PolarHBondContact O-N 3.44Å; Q325-A328 PolarHBondContact O-N 3.22Å; Q325-M329 WeakPolarHBondContact O-CG 3.45Å; Q325-M329 PolarHBondContact O-N 3.36Å
326	M	98.3	Very high	94.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-47.5	175.7	-63.5	-173.5	-69.7	0	0	110.7	L298 T322 I323 A328 M329 M330 A360 L361 M364	L298-M326 HydrophobicContact CD1-CG 3.72Å; L298-M326 HydrophobicContact CD1-SD 4.11Å; L298-M326 HydrophobicContact CD2-CG 3.94Å; L298-M326 HydrophobicContact CG-CG 4.47Å; T322-M326 HydrophobicContact CG2-CE 4.44Å; T322-M326 PolarHBondContact O-N 2.98Å; T322-M326 VanDerWaalsContact O-N 3.08Å; I323-M326 HydrophobicContact CG1-CE 4.14Å; I323-M326 PolarHBondContact O-N 2.98Å; M326-A328 VanDerWaalsContact C-N 3.3Å; M326-A328 PolarHBondContact O-N 3.01Å; M326-M329 WeakPolarHBondContact O-CB 3.39Å; M326-M329 PolarHBondContact O-N 2.87Å; M326-M329 VanDerWaalsContact O-N 3.09Å; M326-M330 VanDerWaalsContact O-CG 3.31Å; M326-M330 WeakPolarHBondContact O-CG 3.47Å; M326-M330 PolarHBondContact O-N 3.14Å; M326-A360 HydrophobicContact CG-CB 4.4Å; M326-A360 VanDerWaalsContact SD-C 3.6Å; M326-A360 HydrophobicContact SD-CB 3.78Å; M326-L361 HydrophobicContact CE-CB 4.22Å; M326-L361 HydrophobicContact CE-CD1 3.71Å; M326-L361 HydrophobicContact SD-CB 4Å; M326-M364 HydrophobicContact CE-CE 3.93Å; M326-M364 HydrophobicContact CE-SD 3.82Å; M326-M364 HydrophobicContact SD-CE 3.99Å
327	L	98	Very high	93.8	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-35.5	176.9	-66.2	174.7	0	0	0	113	I323 Q325 M330 V331 L361 I377 H380 M384 A399	I323-L327 HydrophobicContact CG2-CD1 3.82Å; I323-L327 HydrophobicContact CG2-CG 4.35Å; I323-L327 VanDerWaalsContact O-CG 3.29Å; I323-L327 WeakPolarHBondContact O-CG 3.31Å; I323-L327 PolarHBondContact O-N 3.37Å; Q325-L327 PolarHBondContact O-N 3.44Å; L327-M330 HydrophobicContact CD2-SD 4.17Å; L327-M330 PolarHBondContact O-N 3.46Å; L327-V331 VanDerWaalsContact O-CG2 3.32Å; L327-V331 WeakPolarHBondContact O-CG2 3.45Å; L327-V331 PolarHBondContact O-N 3.27Å; L327-L361 HydrophobicContact CD2-CD2 4.46Å; L327-I377 HydrophobicContact CD1-CG1 4.4Å; L327-I377 HydrophobicContact CD2-CD1 4.31Å; L327-H380 HydrophobicContact CD1-CB 3.57Å; L327-M384 HydrophobicContact CB-CE 4.21Å; L327-M384 HydrophobicContact CB-SD 4.02Å; L327-M384 HydrophobicContact CD1-SD 3.82Å; L327-M384 HydrophobicContact CD2-CE 4.21Å; L327-M384 HydrophobicContact CD2-SD 3.82Å; L327-M384 HydrophobicContact CG-SD 4.1Å; L327-A399 HydrophobicContact CD2-CB 3.54Å
328	A	97.5	Very high	93.2	Very high	56 Å²	56	51.6 Å²	51.6	46%	0.463	27%	0.272	S	S	.	.	H	α-helix	trans	-68.4	-37.2	175	0	0	0	0	0	111.9	P324 Q325 M326 V331	P324-A328 VanDerWaalsContact O-CB 3.25Å; P324-A328 WeakPolarHBondContact O-CB 3.2Å; P324-A328 PolarHBondContact O-N 3Å; Q325-A328 PolarHBondContact O-N 3.22Å; M326-A328 VanDerWaalsContact C-N 3.3Å; M326-A328 PolarHBondContact O-N 3.01Å; A328-V331 PolarHBondContact O-N 3.09Å
329	M	96.9	Very high	92.6	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-41.3	173.1	-69.8	175.5	65.2	0	0	111.5	Q295 L298 Q325 M326 V331 D332 N353 A354 A356	Q295-M329 HydrophobicContact CG-CE 3.76Å; L298-M329 HydrophobicContact CD2-CE 4.16Å; L298-M329 HydrophobicContact CD2-SD 3.82Å; Q325-M329 WeakPolarHBondContact O-CG 3.45Å; Q325-M329 PolarHBondContact O-N 3.36Å; M326-M329 WeakPolarHBondContact O-CB 3.39Å; M326-M329 PolarHBondContact O-N 2.87Å; M326-M329 VanDerWaalsContact O-N 3.09Å; M329-V331 PolarHBondContact O-N 3.1Å; M329-D332 WeakPolarHBondContact O-CB 3.47Å; M329-D332 PolarHBondContact O-N 3.04Å; M329-N353 HydrophobicContact CB-CB 4.09Å; M329-N353 WeakPolarHBondContact CB-O 3.47Å; M329-N353 HydrophobicContact CE-CB 4.22Å; M329-N353 HydrophobicContact CG-CB 4.39Å; M329-N353 CarbonylContact O-C 3.56Å; M329-A354 WeakPolarHBondContact O-CA 3.36Å; M329-A354 PolarHBondContact O-N 3.15Å; M329-A356 HydrophobicContact CE-CB 4.27Å
330	M	96.3	Very high	91.8	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.02	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-23.5	175.1	-65.2	175.4	79	0	0	114.5	M326 L327 D332 E358 L361 A395 M398 A399	M326-M330 VanDerWaalsContact O-CG 3.31Å; M326-M330 WeakPolarHBondContact O-CG 3.47Å; M326-M330 PolarHBondContact O-N 3.14Å; L327-M330 HydrophobicContact CD2-SD 4.17Å; L327-M330 PolarHBondContact O-N 3.46Å; M330-D332 VanDerWaalsContact C-N 3.35Å; M330-E358 HydrophobicContact CE-CB 3.75Å; M330-E358 HydrophobicContact CE-CG 3.84Å; M330-E358 HydrophobicContact CG-CB 4.38Å; M330-E358 HydrophobicContact SD-CB 4.38Å; M330-L361 HydrophobicContact SD-CD2 4.18Å; M330-A395 HydrophobicContact CB-CB 3.79Å; M330-M398 HydrophobicContact CE-CB 3.55Å; M330-A399 HydrophobicContact CE-CB 3.85Å; M330-A399 HydrophobicContact SD-CB 4.05Å
331	V	96.9	Very high	90.8	Very high	19 Å²	19	57 Å²	57	12%	0.115	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-13.4	176.9	172.2	0	0	0	0	112.1	L327 A328 M329 L333 M384 K391 Y392 A395	L327-V331 VanDerWaalsContact O-CG2 3.32Å; L327-V331 WeakPolarHBondContact O-CG2 3.45Å; L327-V331 PolarHBondContact O-N 3.27Å; A328-V331 PolarHBondContact O-N 3.09Å; M329-V331 PolarHBondContact O-N 3.1Å; V331-L333 PolarHBondContact O-N 3.24Å; V331-M384 HydrophobicContact CG2-CE 3.76Å; V331-K391 HydrophobicContact CG1-CB 3.98Å; V331-Y392 HydrophobicContact CG1-CD2 3.88Å; V331-Y392 HydrophobicContact CG1-CE2 3.69Å; V331-Y392 HydrophobicContact CG1-CG 4.48Å; V331-Y392 HydrophobicContact CG2-CD1 4.2Å; V331-Y392 HydrophobicContact CG2-CD2 4.42Å; V331-Y392 HydrophobicContact CG2-CE1 4.37Å; V331-Y392 HydrophobicContact CG2-CG 4.23Å; V331-A395 HydrophobicContact CG2-CB 3.57Å
332	D	93.4	Very high	89.8	Confident	88 Å²	88	54.1 Å²	54.1	47%	0.471	29%	0.288	S	S	.	.			trans	-76.6	63.4	-178.2	-162.5	23.8	0	0	0	111.8	M329 M330 N353	M329-D332 WeakPolarHBondContact O-CB 3.47Å; M329-D332 PolarHBondContact O-N 3.04Å; M330-D332 VanDerWaalsContact C-N 3.35Å; D332-N353 HydrophobicContact CB-CB 4.13Å; D332-N353 PolarHBondContact OD2-ND2 3.49Å
333	L	89.1	Confident	88.4	Confident	15 Å²	15	56 Å²	56	8%	0.079	30%	0.298	C	S	.	.			trans	-103.8	137.4	-179.3	-62.7	168.9	0	0	0	110.7	V331 A354 W390 K391 H394	V331-L333 PolarHBondContact O-N 3.24Å; L333-A354 HydrophobicContact CD2-CB 3.58Å; L333-A354 HydrophobicContact CG-CB 4.45Å; L333-W390 HydrophobicContact CB-CH2 4.24Å; L333-W390 HydrophobicContact CD1-CH2 4.33Å; L333-W390 HydrophobicContact CD1-CZ3 4Å; L333-K391 HydrophobicContact CB-CD 4.37Å; L333-K391 HydrophobicContact CB-CG 4.49Å; L333-K391 WeakPolarHBondContact O-CE 3.31Å; L333-K391 PolarHBondContact O-NZ 3.32Å; L333-H394 HydrophobicContact CD1-CB 4.2Å; L333-H394 WeakPolarHBondContact CD1-ND1 3.27Å
334	E	85.7	Confident	86.7	Confident	169 Å²	169	61.8 Å²	61.8	79%	0.79	33%	0.325	S	S	*	.			trans	-80.5	147.3	170.6	-57.2	-163.8	164.8	0	0	111.3	R432	E334-R432 PolarHBondContact O-NH1 3.33Å
335	E	82.7	Confident	84.9	Confident	142 Å²	142	63.8 Å²	63.8	66%	0.664	33%	0.333	S	S	*	.			trans	-93	105	175.9	-172.7	165.4	-157.1	0	0	108.7
336	D	80.7	Confident	83	Confident	63 Å²	63	66.7 Å²	66.7	34%	0.337	35%	0.346	S	S	.	.			trans	-99.7	119.5	173.5	172.5	24.2	0	0	0	109.9	D338 W339	D336-D338 VanDerWaalsContact C-N 3.3Å; D336-D338 PolarHBondContact OD1-N 3.24Å; D336-W339 HydrophobicContact CB-CB 4.15Å; D336-W339 WeakPolarHBondContact O-CB 3.49Å; D336-W339 VanDerWaalsContact OD2-CA 3.28Å; D336-W339 WeakPolarHBondContact OD2-CA 3.47Å; D336-W339 WeakPolarHBondContact OD2-CB 3.27Å; D336-W339 PolarHBondContact OD2-N 2.99Å
337	E	78.6	Confident	80.8	Confident	182 Å²	182	74 Å²	74	85%	0.85	39%	0.385	S	S	*	.	S	Bend	trans	-70.9	-25.1	-179.1	-67.2	-171.4	173.8	0	0	112.4
338	D	81.9	Confident	78.5	Confident	115 Å²	115	78 Å²	78	62%	0.615	41%	0.407	S	S	*	.	S	Bend	trans	-96.5	-6.5	-177	-75.9	-40.2	0	0	0	113.6	D336 A340 N341 A342	D336-D338 VanDerWaalsContact C-N 3.3Å; D336-D338 PolarHBondContact OD1-N 3.24Å; D338-A340 PolarHBondContact O-N 3.34Å; D338-N341 PolarHBondContact O-N 3.41Å; D338-A342 PolarHBondContact O-N 2.92Å
339	W	84.8	Confident	76.8	Confident	15 Å²	15	80.7 Å²	80.7	6%	0.057	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-45.1	-41.2	-179.5	-178.6	90.2	0	0	0	113.9	D336 N341 P431 R432 Y435 R475	D336-W339 HydrophobicContact CB-CB 4.15Å; D336-W339 WeakPolarHBondContact O-CB 3.49Å; D336-W339 VanDerWaalsContact OD2-CA 3.28Å; D336-W339 WeakPolarHBondContact OD2-CA 3.47Å; D336-W339 WeakPolarHBondContact OD2-CB 3.27Å; D336-W339 PolarHBondContact OD2-N 2.99Å; W339-N341 VanDerWaalsContact C-N 3.3Å; W339-N341 PolarHBondContact O-N 3.48Å; W339-P431 HydrophobicContact CZ3-CB 4.07Å; W339-R432 HydrophobicContact CD2-CG 3.66Å; W339-R432 HydrophobicContact CE3-CG 3.76Å; W339-R432 HydrophobicContact CG-CG 4.31Å; W339-R432 HydrophobicContact CH2-CG 4.07Å; W339-R432 HydrophobicContact CZ2-CG 3.92Å; W339-R432 HydrophobicContact CZ3-CG 3.98Å; W339-Y435 AromaticContact CH2-CD2 3.83Å; W339-Y435 HydrophobicContact CH2-CD2 3.83Å; W339-Y435 AromaticContact CH2-CG 3.9Å; W339-Y435 HydrophobicContact CH2-CG 3.9Å; W339-Y435 HydrophobicContact CZ2-CD1 4.45Å; W339-Y435 AromaticContact CZ2-CD2 3.88Å; W339-Y435 HydrophobicContact CZ2-CD2 3.88Å; W339-Y435 HydrophobicContact CZ2-CE2 4.38Å; W339-Y435 AromaticContact CZ2-CG 3.91Å; W339-Y435 HydrophobicContact CZ2-CG 3.91Å; W339-R475 HydrophobicContact CH2-CB 3.69Å; W339-R475 HydrophobicContact CH2-CG 4.47Å; W339-R475 HydrophobicContact CZ2-CB 4.2Å; W339-R475 HydrophobicContact CZ3-CB 3.98Å; W339-R475 WeakPolarHBondContact O-CD 3.44Å
340	A	80.1	Confident	75.2	Confident	23 Å²	23	86.3 Å²	86.3	19%	0.19	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-71.2	-21.5	-176.3	0	0	0	0	0	114.5	D338 N473	D338-A340 PolarHBondContact O-N 3.34Å; A340-N473 VanDerWaalsContact CB-ND2 3.32Å; A340-N473 WeakPolarHBondContact CB-ND2 3.44Å
341	N	75.1	Confident	74	Confident	115 Å²	115	92 Å²	92	62%	0.615	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-105.9	-3	-175	-59.7	-49.7	0	0	0	113	D338 W339 D343	D338-N341 PolarHBondContact O-N 3.41Å; W339-N341 VanDerWaalsContact C-N 3.3Å; W339-N341 PolarHBondContact O-N 3.48Å; N341-D343 PolarHBondContact O-N 2.94Å
342	A	77.3	Confident	73.6	Confident	24 Å²	24	92.2 Å²	92.2	20%	0.198	47%	0.471	C	S	.	.			trans	-63.6	122.5	174.6	0	0	0	0	0	110.2	D338 E344	D338-A342 PolarHBondContact O-N 2.92Å; A342-E344 VanDerWaalsContact C-N 3.29Å
343	D	68.9	Low	73.6	Confident	39 Å²	39	88.1 Å²	88.1	21%	0.209	45%	0.449	C	S	.	.	S	Bend	trans	-93.7	7.8	176.8	-170.6	46.1	0	0	0	112.2	N341 T523 K524 L525	N341-D343 PolarHBondContact O-N 2.94Å; D343-T523 WeakPolarHBondContact OD2-CA 3.44Å; D343-K524 PolarHBondContact O-NZ 3.25Å; D343-K524 VanDerWaalsContact O-NZ 3.13Å; D343-K524 PolarHBondContact OD1-N 3.15Å; D343-K524 PolarHBondContact OD2-N 3.48Å; D343-L525 WeakPolarHBondContact OD1-CB 3.36Å; D343-L525 PolarHBondContact OD1-N 3.07Å
344	E	63.1	Low	73.7	Confident	125 Å²	125	88 Å²	88	58%	0.584	45%	0.45	S	S	*	.	S	Bend	trans	-128.5	141.2	169.5	-72.4	178.8	173	0	0	107.2	A342 E346 K524	A342-E344 VanDerWaalsContact C-N 3.29Å; E344-E346 PolarHBondContact O-N 3.37Å; E344-K524 IonicContact OE1-NZ 3.86Å; E344-K524 PolarHBondContact OE1-NZ 3.34Å
345	L	60.5	Low	74	Confident	84 Å²	84	82.2 Å²	82.2	44%	0.44	43%	0.426	S	S	.	.			trans	-68.3	120.4	162.3	-60.7	170.3	0	0	0	103.9	D347 L525	L345-D347 PolarHBondContact O-N 2.95Å; L345-L525 HydrophobicContact CD2-CD1 4.38Å; L345-L525 HydrophobicContact CG-CD1 4.13Å
346	E	56.4	Low	74.4	Confident	115 Å²	115	76.6 Å²	76.6	54%	0.537	40%	0.404	S	S	.	.			trans	-53.8	132.9	163.4	-68.6	172.8	154.8	0	0	106	E344 D348	E344-E346 PolarHBondContact O-N 3.37Å; E346-D348 PolarHBondContact O-N 3.09Å
347	D	51.9	Low	75.2	Confident	153 Å²	153	73.6 Å²	73.6	82%	0.818	39%	0.388	S	S	*	.			trans	-48.3	114.1	166.4	-67.5	-36	0	0	0	104.7	L345 D349	L345-D347 PolarHBondContact O-N 2.95Å; D347-D349 PolarHBondContact O-N 2.81Å; D347-D349 VanDerWaalsContact O-N 3.17Å
348	D	51.3	Low	76	Confident	90 Å²	90	67.4 Å²	67.4	48%	0.481	36%	0.359	S	S	.	.			trans	-51	132	-174.7	-76.3	-48.8	0	0	0	106	E346 F350	E346-D348 PolarHBondContact O-N 3.09Å; D348-F350 HydrophobicContact CB-CZ 4.47Å; D348-F350 WeakPolarHBondContact O-CD2 3.46Å; D348-F350 WeakPolarHBondContact O-CG 3.13Å; D348-F350 PolarHBondContact O-N 3.27Å
349	D	60.9	Low	76.6	Confident	114 Å²	114	64.7 Å²	64.7	61%	0.61	35%	0.349	S	S	*	.			trans	-65.4	82.1	175.8	-168.9	14.3	0	0	0	106.2	D347 D351 S352	D347-D349 PolarHBondContact O-N 2.81Å; D347-D349 VanDerWaalsContact O-N 3.17Å; D349-D351 PolarHBondContact O-N 3.03Å; D349-D351 VanDerWaalsContact O-N 3.1Å; D349-S352 WeakPolarHBondContact O-CA 3.43Å; D349-S352 WeakPolarHBondContact O-CB 3.26Å; D349-S352 PolarHBondContact O-N 3.32Å; D349-S352 PolarHBondContact O-OG 3.02Å
350	F	62.9	Low	77.2	Confident	118 Å²	118	64.1 Å²	64.1	52%	0.518	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.8	-171.4	-75.3	-77.6	0	0	0	110.2	D348 S352	D348-F350 HydrophobicContact CB-CZ 4.47Å; D348-F350 WeakPolarHBondContact O-CD2 3.46Å; D348-F350 WeakPolarHBondContact O-CG 3.13Å; D348-F350 PolarHBondContact O-N 3.27Å; F350-S352 VanDerWaalsContact C-N 3.33Å
351	D	72.8	Confident	78.1	Confident	124 Å²	124	63 Å²	63	66%	0.663	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.6	175.7	-66.5	-30.7	0	0	0	114	Q295 D349	Q295-D351 PolarHBondContact NE2-O 2.91Å; D349-D351 PolarHBondContact O-N 3.03Å; D349-D351 VanDerWaalsContact O-N 3.1Å
352	S	88.6	Confident	79.1	Confident	24 Å²	24	59.8 Å²	59.8	17%	0.168	32%	0.321	C	S	.	.	S	Bend	trans	-69.6	149.7	179.8	72.3	0	0	0	0	111.9	D349 F350 A354 V355 A356	D349-S352 WeakPolarHBondContact O-CA 3.43Å; D349-S352 WeakPolarHBondContact O-CB 3.26Å; D349-S352 PolarHBondContact O-N 3.32Å; D349-S352 PolarHBondContact O-OG 3.02Å; F350-S352 VanDerWaalsContact C-N 3.33Å; S352-A354 PolarHBondContact O-N 3.25Å; S352-V355 PolarHBondContact O-N 3.09Å; S352-V355 WeakPolarHBondContact OG-CG2 3.45Å; S352-A356 WeakPolarHBondContact O-CB 3.29Å; S352-A356 PolarHBondContact O-N 3.19Å; S352-A356 VanDerWaalsContact O-N 3.12Å
353	N	92.1	Very high	80.1	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.011	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-32.7	174.8	-76.9	-30.7	0	0	0	112	N291 R294 M329 D332 G357	N291-N353 PolarHBondContact OD1-ND2 3.4Å; R294-N353 PolarHBondContact NH1-ND2 2.91Å; M329-N353 HydrophobicContact CB-CB 4.09Å; M329-N353 WeakPolarHBondContact CB-O 3.47Å; M329-N353 HydrophobicContact CE-CB 4.22Å; M329-N353 HydrophobicContact CG-CB 4.39Å; M329-N353 CarbonylContact O-C 3.56Å; D332-N353 HydrophobicContact CB-CB 4.13Å; D332-N353 PolarHBondContact OD2-ND2 3.49Å; N353-G357 PolarHBondContact O-N 2.69Å
354	A	92.1	Very high	81.5	Confident	11 Å²	11	60 Å²	60	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-47.5	-175.5	0	0	0	0	0	112.3	M329 L333 S352 E358	M329-A354 WeakPolarHBondContact O-CA 3.36Å; M329-A354 PolarHBondContact O-N 3.15Å; L333-A354 HydrophobicContact CD2-CB 3.58Å; L333-A354 HydrophobicContact CG-CB 4.45Å; S352-A354 PolarHBondContact O-N 3.25Å; A354-E358 WeakPolarHBondContact O-CB 3.31Å; A354-E358 PolarHBondContact O-N 3.25Å; A354-E358 VanDerWaalsContact O-N 3.1Å
355	V	90.7	Very high	83.1	Confident	48 Å²	48	54 Å²	54	29%	0.291	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-46.5	177.6	177.4	0	0	0	0	110.6	S352 G357 E358 S359	S352-V355 PolarHBondContact O-N 3.09Å; S352-V355 WeakPolarHBondContact OG-CG2 3.45Å; V355-G357 VanDerWaalsContact C-N 3.31Å; V355-G357 PolarHBondContact O-N 2.9Å; V355-E358 PolarHBondContact O-N 3.24Å; V355-E358 VanDerWaalsContact O-N 3.17Å; V355-S359 PolarHBondContact O-N 2.87Å
356	A	92.3	Very high	84.7	Confident	24 Å²	24	52.5 Å²	52.5	20%	0.198	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-40.5	177.9	0	0	0	0	0	112.6	Q295 M329 S352 A360	Q295-A356 HydrophobicContact CG-CB 3.81Å; M329-A356 HydrophobicContact CE-CB 4.27Å; S352-A356 WeakPolarHBondContact O-CB 3.29Å; S352-A356 PolarHBondContact O-N 3.19Å; S352-A356 VanDerWaalsContact O-N 3.12Å; A356-A360 WeakPolarHBondContact O-CB 3.37Å; A356-A360 PolarHBondContact O-N 3.29Å
357	G	96.6	Very high	86.5	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-68.5	-34.8	177.2	0	0	0	0	0	113.5	N353 V355 L361	N353-G357 PolarHBondContact O-N 2.69Å; V355-G357 VanDerWaalsContact C-N 3.31Å; V355-G357 PolarHBondContact O-N 2.9Å; G357-L361 WeakPolarHBondContact O-CB 3.39Å; G357-L361 PolarHBondContact O-N 3.37Å
358	E	95.3	Very high	88.5	Confident	52 Å²	52	40.9 Å²	40.9	24%	0.243	23%	0.228	C	C	.	.	H	α-helix	trans	-68.5	-52.1	175.3	-173.8	177.4	155	0	0	111.7	M330 A354 V355 A360 L361 D362 M398 A402	M330-E358 HydrophobicContact CE-CB 3.75Å; M330-E358 HydrophobicContact CE-CG 3.84Å; M330-E358 HydrophobicContact CG-CB 4.38Å; M330-E358 HydrophobicContact SD-CB 4.38Å; A354-E358 WeakPolarHBondContact O-CB 3.31Å; A354-E358 PolarHBondContact O-N 3.25Å; A354-E358 VanDerWaalsContact O-N 3.1Å; V355-E358 PolarHBondContact O-N 3.24Å; V355-E358 VanDerWaalsContact O-N 3.17Å; E358-A360 VanDerWaalsContact C-N 3.34Å; E358-A360 PolarHBondContact O-N 2.75Å; E358-L361 WeakPolarHBondContact O-CB 3.35Å; E358-L361 PolarHBondContact O-N 2.91Å; E358-L361 VanDerWaalsContact O-N 3.08Å; E358-D362 PolarHBondContact O-N 3.35Å; E358-D362 VanDerWaalsContact O-N 3.11Å; E358-M398 WeakPolarHBondContact OE1-CE 3.46Å; E358-M398 WeakPolarHBondContact OE2-CE 3.35Å; E358-A402 HydrophobicContact CG-CB 3.97Å
359	S	95	Very high	90.5	Very high	58 Å²	58	37.2 Å²	37.2	41%	0.406	21%	0.211	S	C	.	.	H	α-helix	trans	-59.9	-43.4	178.5	175.4	0	0	0	0	111.9	V355 L361 D362 R363	V355-S359 PolarHBondContact O-N 2.87Å; S359-L361 VanDerWaalsContact C-N 3.26Å; S359-L361 PolarHBondContact O-N 2.91Å; S359-D362 PolarHBondContact O-N 2.93Å; S359-R363 WeakPolarHBondContact O-CB 3.27Å; S359-R363 WeakPolarHBondContact O-CG 3.49Å; S359-R363 PolarHBondContact O-N 3.08Å
360	A	97.3	Very high	92	Very high	3 Å²	3	31.9 Å²	31.9	3%	0.025	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-35.8	175.1	0	0	0	0	0	113.1	L298 V302 M326 A356 E358 M364	L298-A360 HydrophobicContact CD1-CB 4.49Å; L298-A360 HydrophobicContact CD2-CB 3.54Å; L298-A360 HydrophobicContact CG-CB 3.98Å; V302-A360 HydrophobicContact CG2-CB 3.6Å; M326-A360 HydrophobicContact CG-CB 4.4Å; M326-A360 VanDerWaalsContact SD-C 3.6Å; M326-A360 HydrophobicContact SD-CB 3.78Å; A356-A360 WeakPolarHBondContact O-CB 3.37Å; A356-A360 PolarHBondContact O-N 3.29Å; E358-A360 VanDerWaalsContact C-N 3.34Å; E358-A360 PolarHBondContact O-N 2.75Å; A360-M364 WeakPolarHBondContact O-CB 3.39Å; A360-M364 PolarHBondContact O-N 2.8Å
361	L	98.3	Very high	93.5	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-70.8	-42.8	-179.8	173.4	61.5	0	0	0	111.5	M326 L327 M330 G357 E358 S359 A365 I377 A399 A402 I403	M326-L361 HydrophobicContact CE-CB 4.22Å; M326-L361 HydrophobicContact CE-CD1 3.71Å; M326-L361 HydrophobicContact SD-CB 4Å; L327-L361 HydrophobicContact CD2-CD2 4.46Å; M330-L361 HydrophobicContact SD-CD2 4.18Å; G357-L361 WeakPolarHBondContact O-CB 3.39Å; G357-L361 PolarHBondContact O-N 3.37Å; E358-L361 WeakPolarHBondContact O-CB 3.35Å; E358-L361 PolarHBondContact O-N 2.91Å; E358-L361 VanDerWaalsContact O-N 3.08Å; S359-L361 VanDerWaalsContact C-N 3.26Å; S359-L361 PolarHBondContact O-N 2.91Å; L361-A365 VanDerWaalsContact O-CB 3.3Å; L361-A365 WeakPolarHBondContact O-CB 3.25Å; L361-A365 PolarHBondContact O-N 3.12Å; L361-I377 HydrophobicContact CD1-CD1 3.53Å; L361-I377 HydrophobicContact CD2-CD1 3.57Å; L361-I377 HydrophobicContact CG-CD1 4.17Å; L361-A399 HydrophobicContact CD2-CB 3.69Å; L361-A402 HydrophobicContact CB-CB 4.45Å; L361-A402 HydrophobicContact CD2-CB 4.19Å; L361-A402 HydrophobicContact CG-CB 4.28Å; L361-I403 HydrophobicContact CD1-CG2 3.85Å; L361-I403 HydrophobicContact CD2-CG2 3.96Å; L361-I403 HydrophobicContact CG-CG2 3.8Å
362	D	97.8	Very high	94.5	Very high	47 Å²	47	27.7 Å²	27.7	25%	0.251	16%	0.161	S	C	.	.	H	α-helix	trans	-60.4	-57.7	175.3	176.3	29	0	0	0	111.1	E358 S359 M364 A365 C366 A402	E358-D362 PolarHBondContact O-N 3.35Å; E358-D362 VanDerWaalsContact O-N 3.11Å; S359-D362 PolarHBondContact O-N 2.93Å; D362-M364 VanDerWaalsContact C-N 3.27Å; D362-M364 PolarHBondContact O-N 3.47Å; D362-M364 VanDerWaalsContact O-N 3.16Å; D362-A365 WeakPolarHBondContact O-CA 3.27Å; D362-A365 WeakPolarHBondContact O-CB 3.37Å; D362-A365 PolarHBondContact O-N 3.04Å; D362-C366 PolarHBondContact O-N 3.36Å; D362-A402 WeakPolarHBondContact CA-O 3.34Å; D362-A402 HydrophobicContact CB-CB 4.05Å; D362-A402 WeakPolarHBondContact CB-O 3.16Å
363	R	97.3	Very high	95	Very high	66 Å²	66	26.6 Å²	26.6	25%	0.249	15%	0.153	C	C	.	.	H	α-helix	trans	-52.1	-43.3	177.4	-72.9	171.8	59.6	-153	-2	112.9	E299 V302 E306 S359 C366 G367	E299-R363 IonicContact OE1-CZ 3.31Å; E299-R363 IonicContact OE1-NH1 2.88Å; E299-R363 PolarHBondContact OE1-NH1 3Å; E299-R363 VanDerWaalsContact OE1-NH1 3.07Å; E299-R363 IonicContact OE1-NH2 3.37Å; E299-R363 PolarHBondContact OE1-NH2 2.75Å; E299-R363 IonicContact OE2-CZ 3.93Å; E299-R363 IonicContact OE2-NH1 2.56Å; E299-R363 PolarHBondContact OE2-NH1 3.45Å; E299-R363 IonicContact OE2-NH2 3.79Å; V302-R363 HydrophobicContact CG1-CB 3.64Å; V302-R363 VanDerWaalsContact CG1-CZ 3.47Å; E306-R363 WeakPolarHBondContact OE1-CB 3.42Å; E306-R363 IonicContact OE1-CZ 2.93Å; E306-R363 IonicContact OE1-NE 3.57Å; E306-R363 PolarHBondContact OE1-NE 3.14Å; E306-R363 IonicContact OE1-NH2 3.74Å; E306-R363 PolarHBondContact OE1-NH2 2.99Å; E306-R363 IonicContact OE2-CZ 3.67Å; E306-R363 IonicContact OE2-NE 2.71Å; E306-R363 IonicContact OE2-NH2 3.05Å; E306-R363 PolarHBondContact OE2-NH2 3.42Å; S359-R363 WeakPolarHBondContact O-CB 3.27Å; S359-R363 WeakPolarHBondContact O-CG 3.49Å; S359-R363 PolarHBondContact O-N 3.08Å; R363-C366 PolarHBondContact O-N 3.25Å; R363-G367 PolarHBondContact O-N 2.93Å
364	M	97.8	Very high	95.2	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-70.8	-33.9	177	-170.2	-178.5	-55.3	0	0	113.4	I301 V302 S305 V319 T322 M326 A360 D362 L368	I301-M364 HydrophobicContact CB-CE 4.49Å; I301-M364 HydrophobicContact CG2-CE 3.9Å; V302-M364 HydrophobicContact CG2-CE 3.87Å; S305-M364 WeakPolarHBondContact OG-CA 3.39Å; V319-M364 HydrophobicContact CG1-SD 4.3Å; T322-M364 HydrophobicContact CG2-CE 3.84Å; M326-M364 HydrophobicContact CE-CE 3.93Å; M326-M364 HydrophobicContact CE-SD 3.82Å; M326-M364 HydrophobicContact SD-CE 3.99Å; A360-M364 WeakPolarHBondContact O-CB 3.39Å; A360-M364 PolarHBondContact O-N 2.8Å; D362-M364 VanDerWaalsContact C-N 3.27Å; D362-M364 PolarHBondContact O-N 3.47Å; D362-M364 VanDerWaalsContact O-N 3.16Å; M364-L368 HydrophobicContact CG-CD1 3.81Å; M364-L368 HydrophobicContact CG-CG 4.25Å; M364-L368 WeakPolarHBondContact O-CB 3.35Å; M364-L368 PolarHBondContact O-N 3.06Å; M364-L368 HydrophobicContact SD-CD1 4.38Å
365	A	97.3	Very high	95.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-42.6	173.8	0	0	0	0	0	111.2	L361 D362 G369 V373 I403	L361-A365 VanDerWaalsContact O-CB 3.3Å; L361-A365 WeakPolarHBondContact O-CB 3.25Å; L361-A365 PolarHBondContact O-N 3.12Å; D362-A365 WeakPolarHBondContact O-CA 3.27Å; D362-A365 WeakPolarHBondContact O-CB 3.37Å; D362-A365 PolarHBondContact O-N 3.04Å; A365-G369 VanDerWaalsContact O-CA 3.25Å; A365-G369 WeakPolarHBondContact O-CA 3.44Å; A365-G369 PolarHBondContact O-N 3.31Å; A365-V373 HydrophobicContact CB-CG1 4.21Å; A365-I403 HydrophobicContact CB-CB 4.43Å; A365-I403 HydrophobicContact CB-CG2 4.29Å
366	C	94	Very high	95.7	Very high	51 Å²	51	30.7 Å²	30.7	35%	0.345	18%	0.176	S	C	.	.	H	α-helix	trans	-65.8	-49	175.2	-69.1	0	0	0	0	111.8	D362 R363 G406	D362-C366 PolarHBondContact O-N 3.36Å; R363-C366 PolarHBondContact O-N 3.25Å; C366-G406 PolarHBondContact SG-N 3.38Å
367	G	93.4	Very high	95.9	Very high	20 Å²	20	29.6 Å²	29.6	21%	0.206	17%	0.167	C	C	.	.	H	α-helix	trans	-67.4	-37.9	-178	0	0	0	0	0	114.9	S305 A309 R313 R363	S305-G367 CarbonylContact O-C 3.59Å; S305-G367 WeakPolarHBondContact O-CA 3.47Å; A309-G367 WeakPolarHBondContact CB-O 3.46Å; R313-G367 PolarHBondContact NH1-O 3.37Å; R363-G367 PolarHBondContact O-N 2.93Å
368	L	94.5	Very high	95.8	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-92.8	-19.5	-179.5	-61.3	-176.5	0	0	0	114.3	A309 L312 R313 V319 M364 L372 V373	A309-L368 HydrophobicContact CB-CD2 4.19Å; L312-L368 HydrophobicContact CB-CD2 4.32Å; L312-L368 HydrophobicContact CD2-CD1 4.33Å; L312-L368 HydrophobicContact CD2-CD2 4.18Å; L312-L368 HydrophobicContact CG-CD2 4.35Å; R313-L368 HydrophobicContact CG-CD2 4.09Å; V319-L368 HydrophobicContact CB-CD1 4.45Å; V319-L368 HydrophobicContact CG1-CD1 3.63Å; V319-L368 HydrophobicContact CG2-CD1 3.92Å; M364-L368 HydrophobicContact CG-CD1 3.81Å; M364-L368 HydrophobicContact CG-CG 4.25Å; M364-L368 WeakPolarHBondContact O-CB 3.35Å; M364-L368 PolarHBondContact O-N 3.06Å; M364-L368 HydrophobicContact SD-CD1 4.38Å; L368-L372 HydrophobicContact CB-CD2 4.37Å; L368-L372 HydrophobicContact CD1-CD2 4.32Å; L368-V373 HydrophobicContact CB-CG2 3.88Å; L368-V373 HydrophobicContact CD1-CG2 4.42Å
369	G	93.1	Very high	95.7	Very high	12 Å²	12	36.6 Å²	36.6	12%	0.124	20%	0.198	C	C	.	.			trans	78.1	147.6	-177.8	0	0	0	0	0	114.5	A365 K371 L372 V373	A365-G369 VanDerWaalsContact O-CA 3.25Å; A365-G369 WeakPolarHBondContact O-CA 3.44Å; A365-G369 PolarHBondContact O-N 3.31Å; G369-K371 PolarHBondContact O-N 2.93Å; G369-K371 VanDerWaalsContact O-N 3.13Å; G369-L372 PolarHBondContact O-N 3Å; G369-L372 VanDerWaalsContact O-N 3.08Å; G369-V373 PolarHBondContact O-N 3.49Å
370	G	93.3	Very high	95.8	Very high	3 Å²	3	37 Å²	37	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-66.2	-15.3	-175.9	0	0	0	0	0	116.4	L372 L374 G406 C407 Q410	G370-L372 PolarHBondContact O-N 2.73Å; G370-L374 VanDerWaalsContact O-CB 3.22Å; G370-L374 WeakPolarHBondContact O-CB 3.49Å; G370-L374 PolarHBondContact O-N 3.11Å; G370-G406 WeakPolarHBondContact CA-O 3.4Å; G370-G406 PolarHBondContact N-O 3.27Å; G370-C407 WeakPolarHBondContact CA-SG 3.23Å; G370-Q410 VanDerWaalsContact CA-OE1 3.22Å
371	K	93.8	Very high	95.7	Very high	117 Å²	117	37 Å²	37	51%	0.509	19%	0.193	S	C	.	.	H	α-helix	trans	-58.1	-35.8	169.8	-73.6	176.4	-178	160.9	0	111.4	G369 Q410 E840	G369-K371 PolarHBondContact O-N 2.93Å; G369-K371 VanDerWaalsContact O-N 3.13Å; K371-Q410 HydrophobicContact CG-CG 4.36Å; K371-E840 IonicContact NZ-OE1 3.8Å; K371-E840 PolarHBondContact NZ-OE1 3.15Å; K371-E840 IonicContact NZ-OE2 3.73Å; K371-E840 PolarHBondContact NZ-OE2 3.4Å
372	L	94.9	Very high	95.5	Very high	36 Å²	36	39.4 Å²	39.4	19%	0.188	21%	0.205	C	C	.	.	H	α-helix	trans	-94.8	-45.5	-179.2	-176.3	64.8	0	0	0	112.4	R313 T316 L368 G369 G370 P375 M376	R313-L372 HydrophobicContact CG-CD2 4Å; T316-L372 HydrophobicContact CG2-CD1 3.77Å; T316-L372 HydrophobicContact CG2-CD2 4.36Å; L368-L372 HydrophobicContact CB-CD2 4.37Å; L368-L372 HydrophobicContact CD1-CD2 4.32Å; G369-L372 PolarHBondContact O-N 3Å; G369-L372 VanDerWaalsContact O-N 3.08Å; G370-L372 PolarHBondContact O-N 2.73Å; L372-P375 WeakPolarHBondContact O-CD 3.46Å; L372-M376 HydrophobicContact CD1-CE 3.37Å; L372-M376 HydrophobicContact CD2-CE 4.48Å; L372-M376 HydrophobicContact CG-CE 3.73Å; L372-M376 WeakPolarHBondContact O-CG 3.13Å
373	V	97.3	Very high	95.5	Very high	2 Å²	2	43 Å²	43	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-77.2	-46.1	-169.4	176.4	0	0	0	0	112.4	I323 A365 L368 G369 M376 I377	I323-V373 HydrophobicContact CD1-CG1 4.49Å; A365-V373 HydrophobicContact CB-CG1 4.21Å; L368-V373 HydrophobicContact CB-CG2 3.88Å; L368-V373 HydrophobicContact CD1-CG2 4.42Å; G369-V373 PolarHBondContact O-N 3.49Å; V373-M376 WeakPolarHBondContact O-CB 3.47Å; V373-M376 PolarHBondContact O-N 2.78Å; V373-I377 HydrophobicContact CG1-CG2 4.42Å; V373-I377 PolarHBondContact O-N 3.5Å; V373-I377 VanDerWaalsContact O-N 3.09Å
374	L	96.5	Very high	95.5	Very high	16 Å²	16	40.5 Å²	40.5	8%	0.084	21%	0.211	C	C	.	.	H	α-helix	trans	-55.7	-45.5	-176	-176.9	67.2	0	0	0	113.4	G370 M376 I377 K378 I403 C407 Q410 M411	G370-L374 VanDerWaalsContact O-CB 3.22Å; G370-L374 WeakPolarHBondContact O-CB 3.49Å; G370-L374 PolarHBondContact O-N 3.11Å; L374-M376 PolarHBondContact O-N 3.04Å; L374-I377 PolarHBondContact O-N 3.47Å; L374-K378 VanDerWaalsContact O-CB 3.22Å; L374-K378 WeakPolarHBondContact O-CB 3.39Å; L374-K378 PolarHBondContact O-N 3.5Å; L374-I403 HydrophobicContact CD1-CD1 3.98Å; L374-C407 HydrophobicContact CB-CB 4.25Å; L374-C407 HydrophobicContact CD1-CB 4.49Å; L374-Q410 HydrophobicContact CD2-CB 3.63Å; L374-M411 HydrophobicContact CD1-CG 3.61Å; L374-M411 HydrophobicContact CD1-SD 4.07Å; L374-M411 HydrophobicContact CD2-CG 3.62Å; L374-M411 HydrophobicContact CG-CG 4.26Å
375	P	96.5	Very high	95.4	Very high	91 Å²	91	40.6 Å²	40.6	59%	0.591	21%	0.212	S	C	*	.	H	α-helix	trans	-60.6	-29.7	176.6	-24.5	34.9	0	0	0	114.3	L372	L372-P375 WeakPolarHBondContact O-CD 3.46Å
376	M	97.3	Very high	95.4	Very high	40 Å²	40	47.1 Å²	47.1	20%	0.197	24%	0.242	C	C	.	.	H	α-helix	trans	-79.1	-42	-179.4	-61.2	-178.5	-173.5	0	0	111.4	T316 V319 A320 I323 L372 V373 L374 H380	T316-M376 HydrophobicContact CG2-CE 4.43Å; V319-M376 HydrophobicContact CB-SD 4.39Å; V319-M376 HydrophobicContact CG1-SD 3.96Å; A320-M376 HydrophobicContact CB-CG 4.5Å; A320-M376 HydrophobicContact CB-SD 3.86Å; I323-M376 HydrophobicContact CD1-CB 3.38Å; I323-M376 HydrophobicContact CD1-CG 4.33Å; I323-M376 HydrophobicContact CD1-SD 4.08Å; L372-M376 HydrophobicContact CD1-CE 3.37Å; L372-M376 HydrophobicContact CD2-CE 4.48Å; L372-M376 HydrophobicContact CG-CE 3.73Å; L372-M376 WeakPolarHBondContact O-CG 3.13Å; V373-M376 WeakPolarHBondContact O-CB 3.47Å; V373-M376 PolarHBondContact O-N 2.78Å; L374-M376 PolarHBondContact O-N 3.04Å; M376-H380 PolarHBondContact O-CD2 2.93Å
377	I	97.2	Very high	95.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-87.9	-26.8	-173.1	-165.7	164.6	0	0	0	114.2	I323 L327 L361 V373 L374 E379 H380 I381 I403	I323-I377 HydrophobicContact CD1-CB 4.3Å; I323-I377 HydrophobicContact CG2-CB 3.97Å; I323-I377 HydrophobicContact CG2-CD1 3.96Å; I323-I377 HydrophobicContact CG2-CG1 3.75Å; L327-I377 HydrophobicContact CD1-CG1 4.4Å; L327-I377 HydrophobicContact CD2-CD1 4.31Å; L361-I377 HydrophobicContact CD1-CD1 3.53Å; L361-I377 HydrophobicContact CD2-CD1 3.57Å; L361-I377 HydrophobicContact CG-CD1 4.17Å; V373-I377 HydrophobicContact CG1-CG2 4.42Å; V373-I377 PolarHBondContact O-N 3.5Å; V373-I377 VanDerWaalsContact O-N 3.09Å; L374-I377 PolarHBondContact O-N 3.47Å; I377-E379 PolarHBondContact O-N 3.05Å; I377-H380 WeakPolarHBondContact O-CA 3.26Å; I377-H380 WeakPolarHBondContact O-CB 3.32Å; I377-H380 PolarHBondContact O-N 3.42Å; I377-I381 HydrophobicContact CD1-CD1 4.01Å; I377-I381 HydrophobicContact CD1-CG1 4.37Å; I377-I381 HydrophobicContact CG1-CD1 3.77Å; I377-I381 HydrophobicContact CG1-CG1 3.9Å; I377-I381 HydrophobicContact CG2-CD1 4.36Å; I377-I381 PolarHBondContact O-N 3.18Å; I377-I403 HydrophobicContact CD1-CG2 3.94Å; I377-I403 HydrophobicContact CG2-CD1 3.81Å; I377-I403 HydrophobicContact CG2-CG2 4.38Å
378	K	93.6	Very high	95.7	Very high	82 Å²	82	51.8 Å²	51.8	36%	0.357	27%	0.266	S	S	.	.	H	α-helix	trans	-50.4	-49.5	-172.5	178.3	-179.1	178.7	-179	0	113.6	L374 H380 I381 M382 I414	L374-K378 VanDerWaalsContact O-CB 3.22Å; L374-K378 WeakPolarHBondContact O-CB 3.39Å; L374-K378 PolarHBondContact O-N 3.5Å; K378-H380 VanDerWaalsContact C-N 3.34Å; K378-I381 PolarHBondContact O-N 2.77Å; K378-M382 WeakPolarHBondContact O-CG 3.43Å; K378-M382 PolarHBondContact O-N 2.76Å; K378-M382 VanDerWaalsContact O-N 3.11Å; K378-I414 HydrophobicContact CD-CD1 4.33Å
379	E	93.5	Very high	95.8	Very high	117 Å²	117	54.7 Å²	54.7	55%	0.547	28%	0.281	S	S	.	.	H	α-helix	trans	-68.6	-33.6	-179	-73.1	-64.6	143.4	0	0	112.3	I377 M382 Q383	I377-E379 PolarHBondContact O-N 3.05Å; E379-M382 PolarHBondContact O-N 3.06Å; E379-Q383 VanDerWaalsContact O-CG 3.27Å; E379-Q383 WeakPolarHBondContact O-CG 3.19Å; E379-Q383 PolarHBondContact O-N 3.39Å
380	H	96.9	Very high	96	Very high	67 Å²	67	55.4 Å²	55.4	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-64.5	-49.3	175.5	-73.5	-82.8	0	0	0	111	L327 M376 I377 K378 M382 Q383 M384	L327-H380 HydrophobicContact CD1-CB 3.57Å; M376-H380 PolarHBondContact O-CD2 2.93Å; I377-H380 WeakPolarHBondContact O-CA 3.26Å; I377-H380 WeakPolarHBondContact O-CB 3.32Å; I377-H380 PolarHBondContact O-N 3.42Å; K378-H380 VanDerWaalsContact C-N 3.34Å; H380-M382 VanDerWaalsContact C-N 3.31Å; H380-M382 PolarHBondContact O-N 3.38Å; H380-Q383 PolarHBondContact O-N 3.37Å; H380-Q383 VanDerWaalsContact O-N 3.15Å; H380-M384 WeakPolarHBondContact O-CG 3.48Å; H380-M384 PolarHBondContact O-N 2.9Å
381	I	96.1	Very high	96.2	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-57	-46.6	176.6	-70.2	169.8	0	0	0	110.3	I377 K378 Q383 M384 L385 A399 L400 I403	I377-I381 HydrophobicContact CD1-CD1 4.01Å; I377-I381 HydrophobicContact CD1-CG1 4.37Å; I377-I381 HydrophobicContact CG1-CD1 3.77Å; I377-I381 HydrophobicContact CG1-CG1 3.9Å; I377-I381 HydrophobicContact CG2-CD1 4.36Å; I377-I381 PolarHBondContact O-N 3.18Å; K378-I381 PolarHBondContact O-N 2.77Å; I381-Q383 VanDerWaalsContact C-N 3.31Å; I381-Q383 PolarHBondContact O-N 2.85Å; I381-M384 PolarHBondContact O-N 2.93Å; I381-M384 VanDerWaalsContact O-N 3.14Å; I381-L385 HydrophobicContact CG2-CD1 3.7Å; I381-L385 HydrophobicContact CG2-CG 4Å; I381-L385 WeakPolarHBondContact O-CB 3.33Å; I381-L385 VanDerWaalsContact O-CG 3.28Å; I381-L385 WeakPolarHBondContact O-CG 3.29Å; I381-L385 PolarHBondContact O-N 2.98Å; I381-A399 HydrophobicContact CD1-CB 4.23Å; I381-A399 HydrophobicContact CG1-CB 4.17Å; I381-L400 HydrophobicContact CD1-CB 4.5Å; I381-I403 HydrophobicContact CD1-CD1 3.71Å
382	M	94.1	Very high	96.4	Very high	51 Å²	51	56.7 Å²	56.7	25%	0.251	28%	0.283	S	S	.	.	H	α-helix	trans	-60.2	-39	179.3	-69.6	-59.9	114.1	0	0	113.1	K378 E379 H380 L385 Q386	K378-M382 WeakPolarHBondContact O-CG 3.43Å; K378-M382 PolarHBondContact O-N 2.76Å; K378-M382 VanDerWaalsContact O-N 3.11Å; E379-M382 PolarHBondContact O-N 3.06Å; H380-M382 VanDerWaalsContact C-N 3.31Å; H380-M382 PolarHBondContact O-N 3.38Å; M382-L385 HydrophobicContact CE-CD1 3.9Å; M382-Q386 WeakPolarHBondContact O-CG 3.46Å; M382-Q386 PolarHBondContact O-N 2.89Å
383	Q	96.6	Very high	96.6	Very high	123 Å²	123	56.1 Å²	56.1	58%	0.575	28%	0.278	S	S	*	.	H	α-helix	trans	-68.1	-39.6	175.5	-71.1	169.6	28	0	0	112	E379 H380 I381 Q386 N387	E379-Q383 VanDerWaalsContact O-CG 3.27Å; E379-Q383 WeakPolarHBondContact O-CG 3.19Å; E379-Q383 PolarHBondContact O-N 3.39Å; H380-Q383 PolarHBondContact O-N 3.37Å; H380-Q383 VanDerWaalsContact O-N 3.15Å; I381-Q383 VanDerWaalsContact C-N 3.31Å; I381-Q383 PolarHBondContact O-N 2.85Å; Q383-Q386 PolarHBondContact O-N 3.08Å; Q383-N387 PolarHBondContact O-N 3.42Å
384	M	97.9	Very high	96.6	Very high	13 Å²	13	56.9 Å²	56.9	6%	0.064	28%	0.282	C	S	.	.	H	α-helix	trans	-66.6	-45.2	178.7	-68.3	177.3	73.3	0	0	111.8	L327 V331 H380 I381 Q386 N387 Y392 A395	L327-M384 HydrophobicContact CB-CE 4.21Å; L327-M384 HydrophobicContact CB-SD 4.02Å; L327-M384 HydrophobicContact CD1-SD 3.82Å; L327-M384 HydrophobicContact CD2-CE 4.21Å; L327-M384 HydrophobicContact CD2-SD 3.82Å; L327-M384 HydrophobicContact CG-SD 4.1Å; V331-M384 HydrophobicContact CG2-CE 3.76Å; H380-M384 WeakPolarHBondContact O-CG 3.48Å; H380-M384 PolarHBondContact O-N 2.9Å; I381-M384 PolarHBondContact O-N 2.93Å; I381-M384 VanDerWaalsContact O-N 3.14Å; M384-Q386 PolarHBondContact O-N 3.32Å; M384-N387 WeakPolarHBondContact O-CB 3.41Å; M384-N387 PolarHBondContact O-N 3.46Å; M384-N387 VanDerWaalsContact O-N 3.09Å; M384-Y392 WeakPolarHBondContact CB-O 3.42Å; M384-Y392 HydrophobicContact CE-CD1 4.44Å; M384-Y392 HydrophobicContact CG-CD1 4.08Å; M384-Y392 CarbonylContact O-C 3.59Å; M384-A395 HydrophobicContact CE-CB 3.44Å; M384-A395 VanDerWaalsContact CE-CB 3.44Å
385	L	96.4	Very high	96.7	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-29.5	178.2	-69	178.2	0	0	0	113	I381 M382 R393 L397 F421 F425	I381-L385 HydrophobicContact CG2-CD1 3.7Å; I381-L385 HydrophobicContact CG2-CG 4Å; I381-L385 WeakPolarHBondContact O-CB 3.33Å; I381-L385 VanDerWaalsContact O-CG 3.28Å; I381-L385 WeakPolarHBondContact O-CG 3.29Å; I381-L385 PolarHBondContact O-N 2.98Å; M382-L385 HydrophobicContact CE-CD1 3.9Å; L385-R393 WeakPolarHBondContact O-CD 3.27Å; L385-R393 WeakPolarHBondContact O-CG 3.23Å; L385-L397 HydrophobicContact CD2-CD2 3.82Å; L385-L397 HydrophobicContact CD2-CG 3.65Å; L385-F421 HydrophobicContact CB-CE1 4Å; L385-F421 HydrophobicContact CD1-CD1 4Å; L385-F421 HydrophobicContact CD1-CE1 4.04Å; L385-F425 HydrophobicContact CB-CE2 4.25Å; L385-F425 HydrophobicContact CB-CZ 3.91Å; L385-F425 HydrophobicContact CD1-CE2 4.48Å; L385-F425 HydrophobicContact CD2-CE2 4.11Å; L385-F425 HydrophobicContact CD2-CZ 4.25Å; L385-F425 WeakPolarHBondContact O-CE1 3.2Å; L385-F425 VanDerWaalsContact O-CZ 3.31Å; L385-F425 WeakPolarHBondContact O-CZ 3.34Å
386	Q	95.8	Very high	96.7	Very high	138 Å²	138	51.8 Å²	51.8	65%	0.645	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	0.7	178.4	-65.3	175.4	35.9	0	0	113.4	M382 Q383 M384 F421	M382-Q386 WeakPolarHBondContact O-CG 3.46Å; M382-Q386 PolarHBondContact O-N 2.89Å; Q383-Q386 PolarHBondContact O-N 3.08Å; M384-Q386 PolarHBondContact O-N 3.32Å; Q386-F421 HydrophobicContact CG-CZ 4.23Å
387	N	97.8	Very high	96.8	Very high	45 Å²	45	49.9 Å²	49.9	24%	0.241	24%	0.24	C	C	.	.			trans	-75	137.9	-176.6	-164.8	-49.3	0	0	0	111.3	Q383 M384 D389 Y392 R393	Q383-N387 PolarHBondContact O-N 3.42Å; M384-N387 WeakPolarHBondContact O-CB 3.41Å; M384-N387 PolarHBondContact O-N 3.46Å; M384-N387 VanDerWaalsContact O-N 3.09Å; N387-D389 PolarHBondContact O-N 2.91Å; N387-D389 WeakPolarHBondContact OD1-CB 3.2Å; N387-D389 PolarHBondContact OD1-N 2.94Å; N387-Y392 HydrophobicContact CB-CG 4.21Å; N387-R393 VanDerWaalsContact O-CD 3.26Å; N387-R393 WeakPolarHBondContact O-CD 3.29Å; N387-R393 WeakPolarHBondContact O-CG 3.43Å; N387-R393 PolarHBondContact O-NH1 3.29Å
388	P	96.8	Very high	96.8	Very high	123 Å²	123	50.5 Å²	50.5	80%	0.799	24%	0.244	S	C	*	.	S	Bend	trans	-63.9	-24.8	174.8	26.4	-37.3	0	0	0	114	R393	P388-R393 PolarHBondContact O-NH1 3.3Å
389	D	97.4	Very high	97	Very high	66 Å²	66	46.6 Å²	46.6	35%	0.353	23%	0.227	S	C	.	.	S	Bend	trans	-73.3	125.8	174.8	-168	-29.1	0	0	0	110.4	N387 K391 Y392 R393	N387-D389 PolarHBondContact O-N 2.91Å; N387-D389 WeakPolarHBondContact OD1-CB 3.2Å; N387-D389 PolarHBondContact OD1-N 2.94Å; D389-K391 VanDerWaalsContact C-N 3.27Å; D389-K391 PolarHBondContact O-N 2.74Å; D389-K391 PolarHBondContact OD1-N 3.14Å; D389-Y392 HydrophobicContact CB-CD2 3.76Å; D389-Y392 PolarHBondContact O-N 3.33Å; D389-R393 PolarHBondContact O-N 3.33Å; D389-R393 PolarHBondContact O-NH1 2.66Å
390	W	97	Very high	97.1	Very high	27 Å²	27	41.4 Å²	41.4	10%	0.102	20%	0.202	C	C	.	.	H	α-helix	trans	-66.5	-29.7	-176.9	73.1	-97.1	0	0	0	112.3	L333 Y392 R393 H394 H430 R432 V433	L333-W390 HydrophobicContact CB-CH2 4.24Å; L333-W390 HydrophobicContact CD1-CH2 4.33Å; L333-W390 HydrophobicContact CD1-CZ3 4Å; W390-Y392 VanDerWaalsContact C-N 3.32Å; W390-Y392 PolarHBondContact O-N 3.09Å; W390-R393 PolarHBondContact O-N 3.09Å; W390-H394 HydrophobicContact CE3-CB 4.33Å; W390-H394 HydrophobicContact CZ3-CB 4.46Å; W390-H394 WeakPolarHBondContact O-CB 3.32Å; W390-H394 PolarHBondContact O-N 3.1Å; W390-H430 HydrophobicContact CB-CB 3.79Å; W390-H430 AromaticContact CD1-CD2 3.68Å; W390-H430 AromaticContact CD1-NE2 3.8Å; W390-H430 AromaticContact CD2-CD2 3.75Å; W390-H430 AromaticContact CD2-CE1 3.33Å; W390-H430 AromaticContact CD2-CG 3.83Å; W390-H430 AromaticContact CD2-ND1 3.58Å; W390-H430 AromaticContact CD2-NE2 3.46Å; W390-H430 AromaticContact CE2-CE1 3.57Å; W390-H430 AromaticContact CE2-NE2 3.43Å; W390-H430 AromaticContact CE3-CE1 3.36Å; W390-H430 AromaticContact CE3-ND1 3.43Å; W390-H430 AromaticContact CE3-NE2 3.99Å; W390-H430 HydrophobicContact CG-CB 4.34Å; W390-H430 AromaticContact CG-CD2 3.49Å; W390-H430 VanDerWaalsContact CG-CD2 3.49Å; W390-H430 AromaticContact CG-CE1 3.94Å; W390-H430 AromaticContact CG-CG 3.65Å; W390-H430 AromaticContact CG-ND1 3.93Å; W390-H430 AromaticContact CG-NE2 3.71Å; W390-H430 AromaticContact CH2-CE1 3.89Å; W390-H430 AromaticContact CZ2-CE1 3.85Å; W390-H430 AromaticContact CZ2-NE2 3.95Å; W390-H430 AromaticContact CZ3-CE1 3.65Å; W390-H430 AromaticContact NE1-CD2 3.98Å; W390-H430 AromaticContact NE1-NE2 3.61Å; W390-R432 HydrophobicContact CE3-CB 4.29Å; W390-R432 HydrophobicContact CZ3-CB 3.84Å; W390-R432 HydrophobicContact CZ3-CG 4.38Å; W390-V433 HydrophobicContact CB-CG2 3.94Å; W390-V433 HydrophobicContact CE3-CG2 4.4Å; W390-V433 WeakPolarHBondContact O-CG2 3.47Å
391	K	97.4	Very high	97.1	Very high	53 Å²	53	38.5 Å²	38.5	23%	0.23	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-38.1	179.6	-60.6	-174.2	-175.1	-172.3	0	111.3	V331 L333 D389 A395	V331-K391 HydrophobicContact CG1-CB 3.98Å; L333-K391 HydrophobicContact CB-CD 4.37Å; L333-K391 HydrophobicContact CB-CG 4.49Å; L333-K391 WeakPolarHBondContact O-CE 3.31Å; L333-K391 PolarHBondContact O-NZ 3.32Å; D389-K391 VanDerWaalsContact C-N 3.27Å; D389-K391 PolarHBondContact O-N 2.74Å; D389-K391 PolarHBondContact OD1-N 3.14Å; K391-A395 VanDerWaalsContact O-CB 3.3Å; K391-A395 WeakPolarHBondContact O-CB 3.46Å; K391-A395 PolarHBondContact O-N 2.96Å
392	Y	98.1	Very high	97.1	Very high	94 Å²	94	38.7 Å²	38.7	37%	0.369	19%	0.192	S	C	.	.	H	α-helix	trans	-66	-43.2	173.6	-80.1	-99.5	0	0	0	111.8	V331 M384 N387 D389 W390 A395 G396	V331-Y392 HydrophobicContact CG1-CD2 3.88Å; V331-Y392 HydrophobicContact CG1-CE2 3.69Å; V331-Y392 HydrophobicContact CG1-CG 4.48Å; V331-Y392 HydrophobicContact CG2-CD1 4.2Å; V331-Y392 HydrophobicContact CG2-CD2 4.42Å; V331-Y392 HydrophobicContact CG2-CE1 4.37Å; V331-Y392 HydrophobicContact CG2-CG 4.23Å; M384-Y392 WeakPolarHBondContact CB-O 3.42Å; M384-Y392 HydrophobicContact CE-CD1 4.44Å; M384-Y392 HydrophobicContact CG-CD1 4.08Å; M384-Y392 CarbonylContact O-C 3.59Å; N387-Y392 HydrophobicContact CB-CG 4.21Å; D389-Y392 HydrophobicContact CB-CD2 3.76Å; D389-Y392 PolarHBondContact O-N 3.33Å; W390-Y392 VanDerWaalsContact C-N 3.32Å; W390-Y392 PolarHBondContact O-N 3.09Å; Y392-A395 PolarHBondContact O-N 2.63Å; Y392-G396 PolarHBondContact O-N 2.64Å
393	R	98.3	Very high	97.3	Very high	24 Å²	24	36.3 Å²	36.3	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-64.9	-41.7	177.5	-59.8	-162.2	-59.6	-73	-1.3	111.9	L385 N387 P388 D389 W390 G396 L397 D428 V433	L385-R393 WeakPolarHBondContact O-CD 3.27Å; L385-R393 WeakPolarHBondContact O-CG 3.23Å; N387-R393 VanDerWaalsContact O-CD 3.26Å; N387-R393 WeakPolarHBondContact O-CD 3.29Å; N387-R393 WeakPolarHBondContact O-CG 3.43Å; N387-R393 PolarHBondContact O-NH1 3.29Å; P388-R393 PolarHBondContact O-NH1 3.3Å; D389-R393 PolarHBondContact O-N 3.33Å; D389-R393 PolarHBondContact O-NH1 2.66Å; W390-R393 PolarHBondContact O-N 3.09Å; R393-G396 PolarHBondContact O-N 2.94Å; R393-L397 WeakPolarHBondContact O-CG 3.24Å; R393-L397 PolarHBondContact O-N 3.26Å; R393-L397 VanDerWaalsContact O-N 3.15Å; R393-D428 IonicContact CZ-OD1 3.77Å; R393-D428 IonicContact CZ-OD2 2.8Å; R393-D428 IonicContact NE-OD1 3.97Å; R393-D428 IonicContact NE-OD2 3.59Å; R393-D428 PolarHBondContact NE-OD2 2.95Å; R393-D428 IonicContact NH2-OD1 3.65Å; R393-D428 PolarHBondContact NH2-OD1 2.99Å; R393-D428 IonicContact NH2-OD2 3.48Å; R393-D428 PolarHBondContact NH2-OD2 2.95Å; R393-V433 HydrophobicContact CB-CG1 3.97Å; R393-V433 HydrophobicContact CB-CG2 4.1Å
394	H	97.5	Very high	97.1	Very high	18 Å²	18	30.5 Å²	30.5	8%	0.083	15%	0.153	C	C	.	.	H	α-helix	trans	-57.3	-58	172.9	178.5	-73.5	0	0	0	111.1	L333 W390 G396 L397 M398 R432 V433	L333-H394 HydrophobicContact CD1-CB 4.2Å; L333-H394 WeakPolarHBondContact CD1-ND1 3.27Å; W390-H394 HydrophobicContact CE3-CB 4.33Å; W390-H394 HydrophobicContact CZ3-CB 4.46Å; W390-H394 WeakPolarHBondContact O-CB 3.32Å; W390-H394 PolarHBondContact O-N 3.1Å; H394-G396 PolarHBondContact O-N 3.4Å; H394-L397 WeakPolarHBondContact O-CB 3.26Å; H394-L397 PolarHBondContact O-N 3.07Å; H394-M398 VanDerWaalsContact CE1-CG 3.48Å; H394-M398 WeakPolarHBondContact CE1-CG 3.47Å; H394-M398 PolarHBondContact O-N 2.93Å; H394-R432 PolarHBondContact CD2-O 2.84Å; H394-R432 VanDerWaalsContact CD2-O 3.31Å; H394-V433 HydrophobicContact CB-CG2 4.32Å
395	A	97.4	Very high	96.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-35.1	179.8	0	0	0	0	0	112.6	M330 V331 M384 K391 Y392 L397 M398 A399	M330-A395 HydrophobicContact CB-CB 3.79Å; V331-A395 HydrophobicContact CG2-CB 3.57Å; M384-A395 HydrophobicContact CE-CB 3.44Å; M384-A395 VanDerWaalsContact CE-CB 3.44Å; K391-A395 VanDerWaalsContact O-CB 3.3Å; K391-A395 WeakPolarHBondContact O-CB 3.46Å; K391-A395 PolarHBondContact O-N 2.96Å; Y392-A395 PolarHBondContact O-N 2.63Å; A395-L397 VanDerWaalsContact C-N 3.34Å; A395-L397 PolarHBondContact O-N 3.28Å; A395-M398 PolarHBondContact O-N 3.07Å; A395-A399 WeakPolarHBondContact O-CB 3.48Å; A395-A399 PolarHBondContact O-N 2.88Å
396	G	98.1	Very high	96.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.8	-34.2	174.3	0	0	0	0	0	113.7	Y392 R393 H394 L400	Y392-G396 PolarHBondContact O-N 2.64Å; R393-G396 PolarHBondContact O-N 2.94Å; H394-G396 PolarHBondContact O-N 3.4Å; G396-L400 WeakPolarHBondContact O-CB 3.34Å; G396-L400 PolarHBondContact O-N 3.28Å
397	L	98.3	Very high	96.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-75.4	-43.4	175.3	-69.7	163.2	0	0	0	111.6	L385 R393 H394 A395 L400 S401 V422 F425 V433 A436 A437 A440	L385-L397 HydrophobicContact CD2-CD2 3.82Å; L385-L397 HydrophobicContact CD2-CG 3.65Å; R393-L397 WeakPolarHBondContact O-CG 3.24Å; R393-L397 PolarHBondContact O-N 3.26Å; R393-L397 VanDerWaalsContact O-N 3.15Å; H394-L397 WeakPolarHBondContact O-CB 3.26Å; H394-L397 PolarHBondContact O-N 3.07Å; A395-L397 VanDerWaalsContact C-N 3.34Å; A395-L397 PolarHBondContact O-N 3.28Å; L397-L400 WeakPolarHBondContact O-CB 3.09Å; L397-L400 PolarHBondContact O-N 3.48Å; L397-S401 PolarHBondContact O-N 3Å; L397-S401 VanDerWaalsContact O-N 3.1Å; L397-S401 PolarHBondContact O-OG 2.81Å; L397-V422 HydrophobicContact CD2-CG1 4.22Å; L397-V422 HydrophobicContact CD2-CG2 4.18Å; L397-F425 HydrophobicContact CD1-CB 3.99Å; L397-F425 HydrophobicContact CD1-CG 4.19Å; L397-F425 HydrophobicContact CD2-CB 4.45Å; L397-F425 HydrophobicContact CD2-CD2 4.06Å; L397-F425 HydrophobicContact CD2-CG 4.38Å; L397-V433 HydrophobicContact CD1-CG1 3.73Å; L397-V433 WeakPolarHBondContact CD1-O 3.26Å; L397-A436 HydrophobicContact CB-CB 3.82Å; L397-A436 HydrophobicContact CD1-CB 4.01Å; L397-A437 HydrophobicContact CD1-CB 3.99Å; L397-A440 HydrophobicContact CD2-CB 4.49Å
398	M	97.4	Very high	96.5	Very high	14 Å²	14	30.8 Å²	30.8	7%	0.069	16%	0.157	C	C	.	.	H	α-helix	trans	-63.9	-41.8	175.5	-60.5	-50.1	-62.6	0	0	111.1	M330 E358 H394 A395 L400 S401 A402 A436 N439	M330-M398 HydrophobicContact CE-CB 3.55Å; E358-M398 WeakPolarHBondContact OE1-CE 3.46Å; E358-M398 WeakPolarHBondContact OE2-CE 3.35Å; H394-M398 VanDerWaalsContact CE1-CG 3.48Å; H394-M398 WeakPolarHBondContact CE1-CG 3.47Å; H394-M398 PolarHBondContact O-N 2.93Å; A395-M398 PolarHBondContact O-N 3.07Å; M398-L400 VanDerWaalsContact C-N 3.27Å; M398-L400 PolarHBondContact O-N 3.4Å; M398-S401 WeakPolarHBondContact O-CA 3.3Å; M398-S401 WeakPolarHBondContact O-CB 3.44Å; M398-S401 PolarHBondContact O-N 3.03Å; M398-A402 PolarHBondContact O-N 3.34Å; M398-A436 HydrophobicContact CG-CB 4.19Å; M398-A436 HydrophobicContact SD-CB 3.67Å; M398-N439 HydrophobicContact CE-CB 4.46Å; M398-N439 HydrophobicContact SD-CB 4.18Å
399	A	97.9	Very high	96.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.7	-33.1	176.1	0	0	0	0	0	112.8	L327 M330 L361 I381 A395 S401 I403	L327-A399 HydrophobicContact CD2-CB 3.54Å; M330-A399 HydrophobicContact CE-CB 3.85Å; M330-A399 HydrophobicContact SD-CB 4.05Å; L361-A399 HydrophobicContact CD2-CB 3.69Å; I381-A399 HydrophobicContact CD1-CB 4.23Å; I381-A399 HydrophobicContact CG1-CB 4.17Å; A395-A399 WeakPolarHBondContact O-CB 3.48Å; A395-A399 PolarHBondContact O-N 2.88Å; A399-S401 VanDerWaalsContact C-N 3.31Å; A399-I403 WeakPolarHBondContact O-CG1 3.39Å; A399-I403 WeakPolarHBondContact O-CG2 3.23Å; A399-I403 PolarHBondContact O-N 3.05Å; A399-I403 VanDerWaalsContact O-N 3.16Å
400	L	96.9	Very high	96.1	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-68.1	-34.1	173.8	-177.8	67.8	0	0	0	111.9	I381 G396 L397 M398 I403 M411 I418 V422	I381-L400 HydrophobicContact CD1-CB 4.5Å; G396-L400 WeakPolarHBondContact O-CB 3.34Å; G396-L400 PolarHBondContact O-N 3.28Å; L397-L400 WeakPolarHBondContact O-CB 3.09Å; L397-L400 PolarHBondContact O-N 3.48Å; M398-L400 VanDerWaalsContact C-N 3.27Å; M398-L400 PolarHBondContact O-N 3.4Å; L400-I403 HydrophobicContact CD1-CD1 4.49Å; L400-M411 HydrophobicContact CD1-CE 3.56Å; L400-I418 HydrophobicContact CD1-CD1 4.38Å; L400-I418 HydrophobicContact CD1-CG2 4.11Å; L400-I418 HydrophobicContact CD2-CG2 3.54Å; L400-I418 HydrophobicContact CG-CG2 4.31Å; L400-V422 HydrophobicContact CD2-CG2 3.47Å; L400-V422 VanDerWaalsContact CD2-CG2 3.47Å
401	S	95.8	Very high	96	Very high	6 Å²	6	29.6 Å²	29.6	4%	0.042	14%	0.139	C	C	.	.	H	α-helix	trans	-69.6	-49.4	176	-45.7	0	0	0	0	110	L397 M398 A399 I403 G404 N439 A440	L397-S401 PolarHBondContact O-N 3Å; L397-S401 VanDerWaalsContact O-N 3.1Å; L397-S401 PolarHBondContact O-OG 2.81Å; M398-S401 WeakPolarHBondContact O-CA 3.3Å; M398-S401 WeakPolarHBondContact O-CB 3.44Å; M398-S401 PolarHBondContact O-N 3.03Å; A399-S401 VanDerWaalsContact C-N 3.31Å; S401-I403 PolarHBondContact O-N 3.05Å; S401-G404 PolarHBondContact O-N 3.26Å; S401-N439 WeakPolarHBondContact CB-OD1 3.38Å; S401-N439 PolarHBondContact OG-OD1 3.35Å; S401-A440 WeakPolarHBondContact OG-CA 3.38Å; S401-A440 WeakPolarHBondContact OG-CB 3.26Å
402	A	96.2	Very high	95.7	Very high	8 Å²	8	31.9 Å²	31.9	7%	0.066	15%	0.151	C	C	.	.	H	α-helix	trans	-58.6	-40.1	178.7	0	0	0	0	0	113.8	E358 L361 D362 M398 G404	E358-A402 HydrophobicContact CG-CB 3.97Å; L361-A402 HydrophobicContact CB-CB 4.45Å; L361-A402 HydrophobicContact CD2-CB 4.19Å; L361-A402 HydrophobicContact CG-CB 4.28Å; D362-A402 WeakPolarHBondContact CA-O 3.34Å; D362-A402 HydrophobicContact CB-CB 4.05Å; D362-A402 WeakPolarHBondContact CB-O 3.16Å; M398-A402 PolarHBondContact O-N 3.34Å; A402-G404 PolarHBondContact O-N 2.74Å
403	I	97.5	Very high	95.4	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-5.2	178.6	67.8	174.7	0	0	0	113.8	L361 A365 L374 I377 I381 A399 L400 S401 C407 M411	L361-I403 HydrophobicContact CD1-CG2 3.85Å; L361-I403 HydrophobicContact CD2-CG2 3.96Å; L361-I403 HydrophobicContact CG-CG2 3.8Å; A365-I403 HydrophobicContact CB-CB 4.43Å; A365-I403 HydrophobicContact CB-CG2 4.29Å; L374-I403 HydrophobicContact CD1-CD1 3.98Å; I377-I403 HydrophobicContact CD1-CG2 3.94Å; I377-I403 HydrophobicContact CG2-CD1 3.81Å; I377-I403 HydrophobicContact CG2-CG2 4.38Å; I381-I403 HydrophobicContact CD1-CD1 3.71Å; A399-I403 WeakPolarHBondContact O-CG1 3.39Å; A399-I403 WeakPolarHBondContact O-CG2 3.23Å; A399-I403 PolarHBondContact O-N 3.05Å; A399-I403 VanDerWaalsContact O-N 3.16Å; L400-I403 HydrophobicContact CD1-CD1 4.49Å; S401-I403 PolarHBondContact O-N 3.05Å; I403-C407 HydrophobicContact CB-CB 4.5Å; I403-C407 WeakPolarHBondContact O-CA 3.43Å; I403-C407 WeakPolarHBondContact O-CB 3.39Å; I403-C407 PolarHBondContact O-N 3.24Å; I403-C407 PolarHBondContact O-SG 3.44Å; I403-M411 HydrophobicContact CD1-CE 4.44Å; I403-M411 HydrophobicContact CD1-SD 4.09Å; I403-M411 HydrophobicContact CG1-CE 4.43Å; I403-M411 HydrophobicContact CG1-SD 4.05Å
404	G	93.7	Very high	95.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-54.1	-172.2	0	0	0	0	0	111.6	S401 A402 C407 H408 D447	S401-G404 PolarHBondContact O-N 3.26Å; A402-G404 PolarHBondContact O-N 2.74Å; G404-C407 PolarHBondContact O-N 2.97Å; G404-H408 VanDerWaalsContact O-CA 3.31Å; G404-H408 WeakPolarHBondContact O-CA 3.43Å; G404-H408 WeakPolarHBondContact O-CB 3.43Å; G404-H408 PolarHBondContact O-N 3.11Å; G404-D447 VanDerWaalsContact CA-OD2 3.23Å; G404-D447 WeakPolarHBondContact CA-OD2 3.44Å
405	E	92.8	Very high	94.9	Very high	111 Å²	111	30.9 Å²	30.9	52%	0.519	17%	0.172	S	C	.	.	H	α-helix	trans	-56.9	-58.7	-179.4	-171.3	173.9	157.3	0	0	112.3	C407 H408 D447	E405-C407 VanDerWaalsContact C-N 3.32Å; E405-C407 PolarHBondContact O-N 3.25Å; E405-H408 PolarHBondContact O-ND1 3.48Å; E405-D447 PolarHBondContact N-OD2 3Å
406	G	91.7	Very high	94.8	Very high	15 Å²	15	34.8 Å²	34.8	16%	0.155	19%	0.193	C	C	.	.	H	α-helix	trans	-72.3	-16	-177.2	0	0	0	0	0	115.9	C366 G370	C366-G406 PolarHBondContact SG-N 3.38Å; G370-G406 WeakPolarHBondContact CA-O 3.4Å; G370-G406 PolarHBondContact N-O 3.27Å
407	C	96.3	Very high	94.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-121.4	3.3	-176.4	-53.2	0	0	0	0	115.4	G370 L374 I403 G404 E405 Q409 Q410 M411	G370-C407 WeakPolarHBondContact CA-SG 3.23Å; L374-C407 HydrophobicContact CB-CB 4.25Å; L374-C407 HydrophobicContact CD1-CB 4.49Å; I403-C407 HydrophobicContact CB-CB 4.5Å; I403-C407 WeakPolarHBondContact O-CA 3.43Å; I403-C407 WeakPolarHBondContact O-CB 3.39Å; I403-C407 PolarHBondContact O-N 3.24Å; I403-C407 PolarHBondContact O-SG 3.44Å; G404-C407 PolarHBondContact O-N 2.97Å; E405-C407 VanDerWaalsContact C-N 3.32Å; E405-C407 PolarHBondContact O-N 3.25Å; C407-Q409 VanDerWaalsContact C-N 3.3Å; C407-Q409 PolarHBondContact O-N 3.33Å; C407-Q410 PolarHBondContact O-N 3.31Å; C407-Q410 VanDerWaalsContact O-N 3.08Å; C407-M411 HydrophobicContact CB-CG 4.17Å; C407-M411 HydrophobicContact CB-SD 3.77Å; C407-M411 WeakPolarHBondContact O-CG 3.15Å; C407-M411 PolarHBondContact O-N 3.02Å
408	H	93.4	Very high	94.3	Very high	78 Å²	78	41.9 Å²	41.9	36%	0.361	23%	0.227	S	C	.	.	H	α-helix	trans	-53.1	-46.1	-171.4	68.5	-81.2	0	0	0	112.3	G404 E405 Q410 M411 E412 F448	G404-H408 VanDerWaalsContact O-CA 3.31Å; G404-H408 WeakPolarHBondContact O-CA 3.43Å; G404-H408 WeakPolarHBondContact O-CB 3.43Å; G404-H408 PolarHBondContact O-N 3.11Å; E405-H408 PolarHBondContact O-ND1 3.48Å; H408-Q410 VanDerWaalsContact C-N 3.29Å; H408-Q410 PolarHBondContact O-N 2.71Å; H408-M411 PolarHBondContact O-N 3.34Å; H408-E412 WeakPolarHBondContact O-CG 3.46Å; H408-E412 PolarHBondContact O-N 2.93Å; H408-F448 VanDerWaalsContact CA-CE1 3.47Å; H408-F448 HydrophobicContact CB-CD1 3.92Å; H408-F448 HydrophobicContact CB-CE1 3.6Å; H408-F448 HydrophobicContact CB-CE2 4.28Å; H408-F448 HydrophobicContact CB-CG 4.43Å; H408-F448 HydrophobicContact CB-CZ 3.78Å; H408-F448 VanDerWaalsContact O-CE1 3.26Å; H408-F448 WeakPolarHBondContact O-CE1 3.41Å
409	Q	91.4	Very high	94.3	Very high	130 Å²	130	41.3 Å²	41.3	61%	0.607	22%	0.224	S	C	*	.	H	α-helix	trans	-59.7	-38.4	-177	-165.7	-172.3	31.4	0	0	112.3	C407	C407-Q409 VanDerWaalsContact C-N 3.3Å; C407-Q409 PolarHBondContact O-N 3.33Å
410	Q	94.6	Very high	94.1	Very high	60 Å²	60	43.8 Å²	43.8	28%	0.28	24%	0.237	S	C	.	.	H	α-helix	trans	-81.6	-24.1	177.9	-62.9	77.5	34.3	0	0	112.3	G370 K371 L374 C407 H408	G370-Q410 VanDerWaalsContact CA-OE1 3.22Å; K371-Q410 HydrophobicContact CG-CG 4.36Å; L374-Q410 HydrophobicContact CD2-CB 3.63Å; C407-Q410 PolarHBondContact O-N 3.31Å; C407-Q410 VanDerWaalsContact O-N 3.08Å; H408-Q410 VanDerWaalsContact C-N 3.29Å; H408-Q410 PolarHBondContact O-N 2.71Å
411	M	94.4	Very high	93.9	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-78.1	-20.7	177.6	-71.8	172.8	67.8	0	0	113.4	L374 L400 I403 C407 H408 G413 I414 L415 I418 F448	L374-M411 HydrophobicContact CD1-CG 3.61Å; L374-M411 HydrophobicContact CD1-SD 4.07Å; L374-M411 HydrophobicContact CD2-CG 3.62Å; L374-M411 HydrophobicContact CG-CG 4.26Å; L400-M411 HydrophobicContact CD1-CE 3.56Å; I403-M411 HydrophobicContact CD1-CE 4.44Å; I403-M411 HydrophobicContact CD1-SD 4.09Å; I403-M411 HydrophobicContact CG1-CE 4.43Å; I403-M411 HydrophobicContact CG1-SD 4.05Å; C407-M411 HydrophobicContact CB-CG 4.17Å; C407-M411 HydrophobicContact CB-SD 3.77Å; C407-M411 WeakPolarHBondContact O-CG 3.15Å; C407-M411 PolarHBondContact O-N 3.02Å; H408-M411 PolarHBondContact O-N 3.34Å; M411-G413 PolarHBondContact O-N 2.92Å; M411-I414 CarbonylContact O-C 3.47Å; M411-I414 VanDerWaalsContact O-CG1 3.24Å; M411-I414 WeakPolarHBondContact O-CG1 3.34Å; M411-I414 PolarHBondContact O-N 2.87Å; M411-L415 PolarHBondContact O-N 3.16Å; M411-I418 HydrophobicContact CE-CD1 3.72Å; M411-F448 HydrophobicContact CB-CE1 3.83Å; M411-F448 HydrophobicContact CB-CZ 3.74Å; M411-F448 HydrophobicContact CE-CZ 4.08Å; M411-F448 HydrophobicContact SD-CZ 4.19Å
412	E	92.8	Very high	94	Very high	102 Å²	102	46.4 Å²	46.4	48%	0.477	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-38	-177.9	-68	-161.2	133.2	0	0	113.9	H408 I414 L415	H408-E412 WeakPolarHBondContact O-CG 3.46Å; H408-E412 PolarHBondContact O-N 2.93Å; E412-I414 VanDerWaalsContact C-N 3.29Å; E412-I414 PolarHBondContact O-N 3.42Å; E412-L415 WeakPolarHBondContact O-CB 3.5Å; E412-L415 PolarHBondContact O-N 3.32Å
413	G	90.1	Very high	94	Very high	76 Å²	76	47.1 Å²	47.1	78%	0.784	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-25	-179.3	0	0	0	0	0	114.4	M411	M411-G413 PolarHBondContact O-N 2.92Å
414	I	91.9	Very high	94	Very high	36 Å²	36	52.7 Å²	52.7	19%	0.185	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-0.5	178.5	55.9	171.6	0	0	0	112.7	K378 M411 E412 N416 E417 I418	K378-I414 HydrophobicContact CD-CD1 4.33Å; M411-I414 CarbonylContact O-C 3.47Å; M411-I414 VanDerWaalsContact O-CG1 3.24Å; M411-I414 WeakPolarHBondContact O-CG1 3.34Å; M411-I414 PolarHBondContact O-N 2.87Å; E412-I414 VanDerWaalsContact C-N 3.29Å; E412-I414 PolarHBondContact O-N 3.42Å; I414-N416 VanDerWaalsContact C-N 3.32Å; I414-N416 PolarHBondContact O-N 3.47Å; I414-E417 WeakPolarHBondContact O-CA 3.47Å; I414-E417 WeakPolarHBondContact O-CB 3.45Å; I414-E417 PolarHBondContact O-N 3.43Å; I414-I418 HydrophobicContact CB-CD1 4.46Å; I414-I418 HydrophobicContact CD1-CD1 3.76Å; I414-I418 HydrophobicContact CD1-CG1 4.42Å; I414-I418 HydrophobicContact CG1-CD1 3.7Å; I414-I418 HydrophobicContact CG1-CG1 4.35Å; I414-I418 WeakPolarHBondContact O-CG1 3.21Å; I414-I418 PolarHBondContact O-N 3.44Å
415	L	93.8	Very high	94.1	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-56.7	-40.7	-172.5	-175.1	62.2	0	0	0	113.1	M411 E412 E417 I418 V419 M444 F448 F452 F456	M411-L415 PolarHBondContact O-N 3.16Å; E412-L415 WeakPolarHBondContact O-CB 3.5Å; E412-L415 PolarHBondContact O-N 3.32Å; L415-E417 VanDerWaalsContact C-N 3.31Å; L415-E417 PolarHBondContact O-N 3.32Å; L415-I418 PolarHBondContact O-N 2.93Å; L415-V419 HydrophobicContact CD1-CG2 4.15Å; L415-V419 HydrophobicContact CG-CG2 4.33Å; L415-V419 WeakPolarHBondContact O-CB 3.36Å; L415-V419 VanDerWaalsContact O-CG2 3.29Å; L415-V419 WeakPolarHBondContact O-CG2 3.18Å; L415-V419 PolarHBondContact O-N 2.63Å; L415-M444 HydrophobicContact CD1-SD 4.18Å; L415-F448 HydrophobicContact CD1-CD1 4Å; L415-F448 HydrophobicContact CD1-CD2 4.19Å; L415-F448 HydrophobicContact CD1-CE1 3.88Å; L415-F448 HydrophobicContact CD1-CE2 4.12Å; L415-F448 HydrophobicContact CD1-CG 4.14Å; L415-F448 HydrophobicContact CD1-CZ 3.96Å; L415-F448 HydrophobicContact CD2-CB 4.16Å; L415-F448 HydrophobicContact CD2-CD1 3.62Å; L415-F448 HydrophobicContact CD2-CE1 4.15Å; L415-F448 HydrophobicContact CD2-CG 3.96Å; L415-F448 HydrophobicContact CG-CD1 4.4Å; L415-F452 HydrophobicContact CD2-CD2 4.47Å; L415-F456 HydrophobicContact CD2-CE2 3.76Å; L415-F456 HydrophobicContact CD2-CZ 4.39Å; L415-F456 HydrophobicContact CG-CE2 3.79Å; L415-F456 HydrophobicContact CG-CZ 4.12Å
416	N	94.9	Very high	94.3	Very high	82 Å²	82	48.3 Å²	48.3	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-38.1	176.4	172.4	78.4	0	0	0	112.2	I414 N420 F456	I414-N416 VanDerWaalsContact C-N 3.32Å; I414-N416 PolarHBondContact O-N 3.47Å; N416-N420 PolarHBondContact ND2-ND2 3.38Å; N416-N420 WeakPolarHBondContact O-CB 3.41Å; N416-N420 VanDerWaalsContact O-CG 3.24Å; N416-N420 PolarHBondContact O-N 2.92Å; N416-N420 VanDerWaalsContact O-N 3.14Å; N416-N420 PolarHBondContact O-ND2 3.38Å; N416-N420 PolarHBondContact OD1-ND2 3.07Å; N416-N420 VanDerWaalsContact OD1-ND2 3.15Å; N416-F456 HydrophobicContact CB-CE1 3.84Å; N416-F456 HydrophobicContact CB-CZ 3.98Å
417	E	93.2	Very high	94.4	Very high	135 Å²	135	53 Å²	53	63%	0.631	28%	0.276	S	S	*	.	H	α-helix	trans	-67.7	-45.4	177	-62.8	177.4	-176.5	0	0	110.4	I414 L415 N420 F421	I414-E417 WeakPolarHBondContact O-CA 3.47Å; I414-E417 WeakPolarHBondContact O-CB 3.45Å; I414-E417 PolarHBondContact O-N 3.43Å; L415-E417 VanDerWaalsContact C-N 3.31Å; L415-E417 PolarHBondContact O-N 3.32Å; E417-N420 PolarHBondContact O-N 3.1Å; E417-F421 WeakPolarHBondContact O-CB 3.34Å; E417-F421 PolarHBondContact O-N 2.91Å
418	I	94	Very high	94.4	Very high	14 Å²	14	53.7 Å²	53.7	7%	0.072	28%	0.28	C	S	.	.	H	α-helix	trans	-55.6	-55.4	176.2	-66.5	173.3	0	0	0	110.5	L400 M411 I414 L415 N420 F421 V422 M444	L400-I418 HydrophobicContact CD1-CD1 4.38Å; L400-I418 HydrophobicContact CD1-CG2 4.11Å; L400-I418 HydrophobicContact CD2-CG2 3.54Å; L400-I418 HydrophobicContact CG-CG2 4.31Å; M411-I418 HydrophobicContact CE-CD1 3.72Å; I414-I418 HydrophobicContact CB-CD1 4.46Å; I414-I418 HydrophobicContact CD1-CD1 3.76Å; I414-I418 HydrophobicContact CD1-CG1 4.42Å; I414-I418 HydrophobicContact CG1-CD1 3.7Å; I414-I418 HydrophobicContact CG1-CG1 4.35Å; I414-I418 WeakPolarHBondContact O-CG1 3.21Å; I414-I418 PolarHBondContact O-N 3.44Å; L415-I418 PolarHBondContact O-N 2.93Å; I418-N420 PolarHBondContact O-N 2.94Å; I418-F421 WeakPolarHBondContact O-CB 3.3Å; I418-F421 PolarHBondContact O-N 3.29Å; I418-V422 HydrophobicContact CG2-CG2 4.05Å; I418-V422 WeakPolarHBondContact O-CG2 3.36Å; I418-V422 PolarHBondContact O-N 3.49Å; I418-M444 HydrophobicContact CG2-SD 3.8Å
419	V	96.3	Very high	94.4	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-58	-48.3	-178.2	171.6	0	0	0	0	111.2	L415 F421 V422 L423 M444 F452 F456 V460	L415-V419 HydrophobicContact CD1-CG2 4.15Å; L415-V419 HydrophobicContact CG-CG2 4.33Å; L415-V419 WeakPolarHBondContact O-CB 3.36Å; L415-V419 VanDerWaalsContact O-CG2 3.29Å; L415-V419 WeakPolarHBondContact O-CG2 3.18Å; L415-V419 PolarHBondContact O-N 2.63Å; V419-F421 PolarHBondContact O-N 3.09Å; V419-V422 PolarHBondContact O-N 3.13Å; V419-L423 HydrophobicContact CG1-CD1 3.97Å; V419-L423 HydrophobicContact CG1-CG 4.26Å; V419-L423 WeakPolarHBondContact O-CB 3.42Å; V419-L423 VanDerWaalsContact O-CG 3.23Å; V419-L423 WeakPolarHBondContact O-CG 3.15Å; V419-L423 PolarHBondContact O-N 2.99Å; V419-M444 HydrophobicContact CG2-CE 4.27Å; V419-M444 HydrophobicContact CG2-SD 4.11Å; V419-F452 HydrophobicContact CG2-CD2 4.3Å; V419-F452 HydrophobicContact CG2-CE2 3.44Å; V419-F452 VanDerWaalsContact CG2-CE2 3.44Å; V419-F452 HydrophobicContact CG2-CZ 4.12Å; V419-F456 HydrophobicContact CG1-CB 4.42Å; V419-F456 HydrophobicContact CG1-CD1 4.22Å; V419-F456 HydrophobicContact CG1-CG 4.17Å; V419-F456 HydrophobicContact CG2-CD2 4.13Å; V419-F456 HydrophobicContact CG2-CE2 4.07Å; V419-F456 HydrophobicContact CG2-CG 4.47Å; V419-F456 HydrophobicContact CG2-CZ 4.36Å; V419-V460 HydrophobicContact CG1-CG2 4.27Å
420	N	94.3	Very high	94.5	Very high	52 Å²	52	50.8 Å²	50.8	28%	0.278	28%	0.276	S	S	.	.	H	α-helix	trans	-61.8	-31.7	179.2	-70.6	-49.5	0	0	0	112.3	N416 E417 I418 K459	N416-N420 PolarHBondContact ND2-ND2 3.38Å; N416-N420 WeakPolarHBondContact O-CB 3.41Å; N416-N420 VanDerWaalsContact O-CG 3.24Å; N416-N420 PolarHBondContact O-N 2.92Å; N416-N420 VanDerWaalsContact O-N 3.14Å; N416-N420 PolarHBondContact O-ND2 3.38Å; N416-N420 PolarHBondContact OD1-ND2 3.07Å; N416-N420 VanDerWaalsContact OD1-ND2 3.15Å; E417-N420 PolarHBondContact O-N 3.1Å; I418-N420 PolarHBondContact O-N 2.94Å; N420-K459 PolarHBondContact OD1-NZ 3.05Å
421	F	93.3	Very high	94.4	Very high	67 Å²	67	49.3 Å²	49.3	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-77.1	-45.5	178.4	-156.1	-119	0	0	0	111.8	L385 Q386 E417 I418 V419 L423 L424 F425	L385-F421 HydrophobicContact CB-CE1 4Å; L385-F421 HydrophobicContact CD1-CD1 4Å; L385-F421 HydrophobicContact CD1-CE1 4.04Å; Q386-F421 HydrophobicContact CG-CZ 4.23Å; E417-F421 WeakPolarHBondContact O-CB 3.34Å; E417-F421 PolarHBondContact O-N 2.91Å; I418-F421 WeakPolarHBondContact O-CB 3.3Å; I418-F421 PolarHBondContact O-N 3.29Å; V419-F421 PolarHBondContact O-N 3.09Å; F421-L423 VanDerWaalsContact C-N 3.34Å; F421-L423 PolarHBondContact O-N 3Å; F421-L424 HydrophobicContact CD2-CD1 4.38Å; F421-L424 WeakPolarHBondContact O-CB 3.42Å; F421-L424 PolarHBondContact O-N 3.13Å; F421-L424 VanDerWaalsContact O-N 3.17Å; F421-F425 AromaticContact CD1-CE2 3.83Å; F421-F425 HydrophobicContact CD1-CE2 3.83Å; F421-F425 HydrophobicContact CD1-CZ 4.5Å; F421-F425 AromaticContact CE1-CE2 3.83Å; F421-F425 HydrophobicContact CE1-CE2 3.83Å; F421-F425 HydrophobicContact CE1-CZ 4.05Å; F421-F425 HydrophobicContact CG-CE2 4.48Å; F421-F425 HydrophobicContact CZ-CE2 4.48Å; F421-F425 HydrophobicContact CZ-CZ 4.45Å; F421-F425 WeakPolarHBondContact O-CD2 3.34Å
422	V	97.2	Very high	94.3	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-43.6	176.6	172.7	0	0	0	0	111.4	L397 L400 I418 V419 L424 F425 A440 V441 M444	L397-V422 HydrophobicContact CD2-CG1 4.22Å; L397-V422 HydrophobicContact CD2-CG2 4.18Å; L400-V422 HydrophobicContact CD2-CG2 3.47Å; L400-V422 VanDerWaalsContact CD2-CG2 3.47Å; I418-V422 HydrophobicContact CG2-CG2 4.05Å; I418-V422 WeakPolarHBondContact O-CG2 3.36Å; I418-V422 PolarHBondContact O-N 3.49Å; V419-V422 PolarHBondContact O-N 3.13Å; V422-L424 PolarHBondContact O-N 3.12Å; V422-L424 VanDerWaalsContact O-N 3.09Å; V422-F425 WeakPolarHBondContact O-CB 3.38Å; V422-F425 PolarHBondContact O-N 3.36Å; V422-A440 HydrophobicContact CG1-CB 4.01Å; V422-V441 HydrophobicContact CG1-CG2 3.79Å; V422-M444 HydrophobicContact CB-CE 4.15Å; V422-M444 HydrophobicContact CG1-CE 4.03Å; V422-M444 HydrophobicContact CG2-CE 4.06Å
423	L	97	Very high	94.4	Very high	24 Å²	24	46.4 Å²	46.4	13%	0.126	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-23.5	179.9	-70.4	178.7	0	0	0	113.6	V419 F421 F425 L426 V441 K459 A463	V419-L423 HydrophobicContact CG1-CD1 3.97Å; V419-L423 HydrophobicContact CG1-CG 4.26Å; V419-L423 WeakPolarHBondContact O-CB 3.42Å; V419-L423 VanDerWaalsContact O-CG 3.23Å; V419-L423 WeakPolarHBondContact O-CG 3.15Å; V419-L423 PolarHBondContact O-N 2.99Å; F421-L423 VanDerWaalsContact C-N 3.34Å; F421-L423 PolarHBondContact O-N 3Å; L423-F425 VanDerWaalsContact C-N 3.33Å; L423-L426 HydrophobicContact CD2-CD1 3.72Å; L423-L426 WeakPolarHBondContact O-CB 3.24Å; L423-V441 HydrophobicContact CD2-CG2 3.96Å; L423-K459 HydrophobicContact CD1-CB 3.94Å; L423-A463 HydrophobicContact CD2-CB 3.75Å
424	L	95.9	Very high	94.7	Very high	117 Å²	117	44.8 Å²	44.8	61%	0.613	23%	0.226	S	C	*	.	H	α-helix	trans	-70.7	-30.7	174.6	-61.8	173.2	0	0	0	112.1	F421 V422 L426 Q427	F421-L424 HydrophobicContact CD2-CD1 4.38Å; F421-L424 WeakPolarHBondContact O-CB 3.42Å; F421-L424 PolarHBondContact O-N 3.13Å; F421-L424 VanDerWaalsContact O-N 3.17Å; V422-L424 PolarHBondContact O-N 3.12Å; V422-L424 VanDerWaalsContact O-N 3.09Å; L424-L426 PolarHBondContact O-N 2.84Å; L424-Q427 PolarHBondContact O-N 3.1Å; L424-Q427 VanDerWaalsContact O-N 3.1Å
425	F	97.4	Very high	94.7	Very high	19 Å²	19	44.6 Å²	44.6	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-73.6	-13.1	180	-67.7	-73.7	0	0	0	113.4	L385 L397 F421 V422 L423 Q427 D428 V433 R434 A437	L385-F425 HydrophobicContact CB-CE2 4.25Å; L385-F425 HydrophobicContact CB-CZ 3.91Å; L385-F425 HydrophobicContact CD1-CE2 4.48Å; L385-F425 HydrophobicContact CD2-CE2 4.11Å; L385-F425 HydrophobicContact CD2-CZ 4.25Å; L385-F425 WeakPolarHBondContact O-CE1 3.2Å; L385-F425 VanDerWaalsContact O-CZ 3.31Å; L385-F425 WeakPolarHBondContact O-CZ 3.34Å; L397-F425 HydrophobicContact CD1-CB 3.99Å; L397-F425 HydrophobicContact CD1-CG 4.19Å; L397-F425 HydrophobicContact CD2-CB 4.45Å; L397-F425 HydrophobicContact CD2-CD2 4.06Å; L397-F425 HydrophobicContact CD2-CG 4.38Å; F421-F425 AromaticContact CD1-CE2 3.83Å; F421-F425 HydrophobicContact CD1-CE2 3.83Å; F421-F425 HydrophobicContact CD1-CZ 4.5Å; F421-F425 AromaticContact CE1-CE2 3.83Å; F421-F425 HydrophobicContact CE1-CE2 3.83Å; F421-F425 HydrophobicContact CE1-CZ 4.05Å; F421-F425 HydrophobicContact CG-CE2 4.48Å; F421-F425 HydrophobicContact CZ-CE2 4.48Å; F421-F425 HydrophobicContact CZ-CZ 4.45Å; F421-F425 WeakPolarHBondContact O-CD2 3.34Å; V422-F425 WeakPolarHBondContact O-CB 3.38Å; V422-F425 PolarHBondContact O-N 3.36Å; L423-F425 VanDerWaalsContact C-N 3.33Å; F425-Q427 PolarHBondContact O-N 3.23Å; F425-Q427 VanDerWaalsContact O-N 3.14Å; F425-D428 VanDerWaalsContact O-CB 3.27Å; F425-D428 WeakPolarHBondContact O-CB 3.39Å; F425-D428 PolarHBondContact O-N 2.91Å; F425-V433 HydrophobicContact CB-CG1 4.35Å; F425-V433 HydrophobicContact CD1-CG1 4Å; F425-R434 WeakPolarHBondContact O-CG 3.13Å; F425-A437 HydrophobicContact CB-CB 3.71Å
426	L	95.9	Very high	94.8	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.2	166.4	-65	173	0	0	0	112.5	L423 L424 R434 A437 C438 A463 T467	L423-L426 HydrophobicContact CD2-CD1 3.72Å; L423-L426 WeakPolarHBondContact O-CB 3.24Å; L424-L426 PolarHBondContact O-N 2.84Å; L426-R434 VanDerWaalsContact O-CD 3.23Å; L426-R434 WeakPolarHBondContact O-CD 3.42Å; L426-R434 WeakPolarHBondContact O-CG 3.35Å; L426-A437 HydrophobicContact CD2-CB 3.93Å; L426-A437 HydrophobicContact CG-CB 4.29Å; L426-C438 HydrophobicContact CD2-CB 4.5Å; L426-C438 WeakPolarHBondContact CD2-SG 3.46Å; L426-A463 HydrophobicContact CD1-CB 3.8Å; L426-T467 HydrophobicContact CD2-CG2 4.46Å
427	Q	94.5	Very high	94.9	Very high	114 Å²	114	40.6 Å²	40.6	53%	0.533	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	16.3	176.1	-55.8	-61.3	-37.8	0	0	112.3	L424 F425	L424-Q427 PolarHBondContact O-N 3.1Å; L424-Q427 VanDerWaalsContact O-N 3.1Å; F425-Q427 PolarHBondContact O-N 3.23Å; F425-Q427 VanDerWaalsContact O-N 3.14Å
428	D	96.1	Very high	95.1	Very high	14 Å²	14	34.1 Å²	34.1	8%	0.075	17%	0.172	C	C	.	.			trans	-61.3	142.1	177.8	-167.3	-80.9	0	0	0	110.9	R393 F425 H430 V433 R434	R393-D428 IonicContact CZ-OD1 3.77Å; R393-D428 IonicContact CZ-OD2 2.8Å; R393-D428 IonicContact NE-OD1 3.97Å; R393-D428 IonicContact NE-OD2 3.59Å; R393-D428 PolarHBondContact NE-OD2 2.95Å; R393-D428 IonicContact NH2-OD1 3.65Å; R393-D428 PolarHBondContact NH2-OD1 2.99Å; R393-D428 IonicContact NH2-OD2 3.48Å; R393-D428 PolarHBondContact NH2-OD2 2.95Å; F425-D428 VanDerWaalsContact O-CB 3.27Å; F425-D428 WeakPolarHBondContact O-CB 3.39Å; F425-D428 PolarHBondContact O-N 2.91Å; D428-H430 PolarHBondContact O-N 3.12Å; D428-H430 VanDerWaalsContact O-N 3.17Å; D428-H430 WeakPolarHBondContact OD1-CB 3.13Å; D428-H430 PolarHBondContact OD1-N 2.74Å; D428-V433 HydrophobicContact CB-CB 3.93Å; D428-V433 HydrophobicContact CB-CG1 3.7Å; D428-V433 VanDerWaalsContact CG-CG1 3.48Å; D428-R434 HydrophobicContact CB-CG 4.14Å; D428-R434 VanDerWaalsContact O-CD 3.26Å; D428-R434 WeakPolarHBondContact O-CD 3.47Å; D428-R434 WeakPolarHBondContact O-CG 3.37Å; D428-R434 PolarHBondContact O-NE 3.19Å
429	P	93.8	Very high	95.2	Very high	110 Å²	110	35.2 Å²	35.2	71%	0.714	18%	0.178	S	C	*	.	S	Bend	trans	-55.4	-33.7	176.4	21.9	-35.3	0	0	0	113	R434	P429-R434 PolarHBondContact O-NH2 2.92Å
430	H	93.3	Very high	95.2	Very high	36 Å²	36	35.2 Å²	35.2	17%	0.167	18%	0.178	C	C	.	.	S	Bend	trans	-88.1	124.8	-177.1	-161.7	-85.6	0	0	0	111.7	W390 D428 R432 V433 R434	W390-H430 HydrophobicContact CB-CB 3.79Å; W390-H430 AromaticContact CD1-CD2 3.68Å; W390-H430 AromaticContact CD1-NE2 3.8Å; W390-H430 AromaticContact CD2-CD2 3.75Å; W390-H430 AromaticContact CD2-CE1 3.33Å; W390-H430 AromaticContact CD2-CG 3.83Å; W390-H430 AromaticContact CD2-ND1 3.58Å; W390-H430 AromaticContact CD2-NE2 3.46Å; W390-H430 AromaticContact CE2-CE1 3.57Å; W390-H430 AromaticContact CE2-NE2 3.43Å; W390-H430 AromaticContact CE3-CE1 3.36Å; W390-H430 AromaticContact CE3-ND1 3.43Å; W390-H430 AromaticContact CE3-NE2 3.99Å; W390-H430 HydrophobicContact CG-CB 4.34Å; W390-H430 AromaticContact CG-CD2 3.49Å; W390-H430 VanDerWaalsContact CG-CD2 3.49Å; W390-H430 AromaticContact CG-CE1 3.94Å; W390-H430 AromaticContact CG-CG 3.65Å; W390-H430 AromaticContact CG-ND1 3.93Å; W390-H430 AromaticContact CG-NE2 3.71Å; W390-H430 AromaticContact CH2-CE1 3.89Å; W390-H430 AromaticContact CZ2-CE1 3.85Å; W390-H430 AromaticContact CZ2-NE2 3.95Å; W390-H430 AromaticContact CZ3-CE1 3.65Å; W390-H430 AromaticContact NE1-CD2 3.98Å; W390-H430 AromaticContact NE1-NE2 3.61Å; D428-H430 PolarHBondContact O-N 3.12Å; D428-H430 VanDerWaalsContact O-N 3.17Å; D428-H430 WeakPolarHBondContact OD1-CB 3.13Å; D428-H430 PolarHBondContact OD1-N 2.74Å; H430-R432 PolarHBondContact ND1-N 3.3Å; H430-R432 PolarHBondContact O-N 3.22Å; H430-V433 HydrophobicContact CB-CB 4.32Å; H430-V433 HydrophobicContact CB-CG2 3.9Å; H430-V433 PolarHBondContact O-N 3.46Å; H430-V433 VanDerWaalsContact O-N 3.14Å; H430-R434 PolarHBondContact O-N 3.32Å
431	P	91.8	Very high	95.4	Very high	30 Å²	30	32.8 Å²	32.8	20%	0.195	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-35.9	-175.6	25	-33.8	0	0	0	113.8	W339 V433 R434 Y435 N473 V476	W339-P431 HydrophobicContact CZ3-CB 4.07Å; P431-V433 VanDerWaalsContact C-N 3.27Å; P431-V433 PolarHBondContact O-N 3.36Å; P431-R434 WeakPolarHBondContact O-CB 3.48Å; P431-R434 PolarHBondContact O-N 2.93Å; P431-Y435 PolarHBondContact O-N 3.17Å; P431-N473 WeakPolarHBondContact CB-ND2 3.17Å; P431-V476 HydrophobicContact CB-CG2 4.37Å; P431-V476 WeakPolarHBondContact O-CG2 3.36Å
432	R	92.6	Very high	95.5	Very high	42 Å²	42	29.8 Å²	29.8	16%	0.158	15%	0.153	C	C	.	.	H	α-helix	trans	-65.7	-29.4	175.7	-62.8	-174.2	66.9	172.8	5.4	112.9	E334 W339 W390 H394 H430 Y435 A436	E334-R432 PolarHBondContact O-NH1 3.33Å; W339-R432 HydrophobicContact CD2-CG 3.66Å; W339-R432 HydrophobicContact CE3-CG 3.76Å; W339-R432 HydrophobicContact CG-CG 4.31Å; W339-R432 HydrophobicContact CH2-CG 4.07Å; W339-R432 HydrophobicContact CZ2-CG 3.92Å; W339-R432 HydrophobicContact CZ3-CG 3.98Å; W390-R432 HydrophobicContact CE3-CB 4.29Å; W390-R432 HydrophobicContact CZ3-CB 3.84Å; W390-R432 HydrophobicContact CZ3-CG 4.38Å; H394-R432 PolarHBondContact CD2-O 2.84Å; H394-R432 VanDerWaalsContact CD2-O 3.31Å; H430-R432 PolarHBondContact ND1-N 3.3Å; H430-R432 PolarHBondContact O-N 3.22Å; R432-Y435 WeakPolarHBondContact O-CB 3.39Å; R432-Y435 PolarHBondContact O-N 3.22Å; R432-A436 PolarHBondContact O-N 3.43Å
433	V	96	Very high	95.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-72.2	-38.9	174.8	179.6	0	0	0	0	110.2	W390 R393 H394 L397 F425 D428 H430 P431 Y435 A436 A437	W390-V433 HydrophobicContact CB-CG2 3.94Å; W390-V433 HydrophobicContact CE3-CG2 4.4Å; W390-V433 WeakPolarHBondContact O-CG2 3.47Å; R393-V433 HydrophobicContact CB-CG1 3.97Å; R393-V433 HydrophobicContact CB-CG2 4.1Å; H394-V433 HydrophobicContact CB-CG2 4.32Å; L397-V433 HydrophobicContact CD1-CG1 3.73Å; L397-V433 WeakPolarHBondContact CD1-O 3.26Å; F425-V433 HydrophobicContact CB-CG1 4.35Å; F425-V433 HydrophobicContact CD1-CG1 4Å; D428-V433 HydrophobicContact CB-CB 3.93Å; D428-V433 HydrophobicContact CB-CG1 3.7Å; D428-V433 VanDerWaalsContact CG-CG1 3.48Å; H430-V433 HydrophobicContact CB-CB 4.32Å; H430-V433 HydrophobicContact CB-CG2 3.9Å; H430-V433 PolarHBondContact O-N 3.46Å; H430-V433 VanDerWaalsContact O-N 3.14Å; P431-V433 VanDerWaalsContact C-N 3.27Å; P431-V433 PolarHBondContact O-N 3.36Å; V433-Y435 VanDerWaalsContact C-N 3.3Å; V433-Y435 PolarHBondContact O-N 3.46Å; V433-A436 PolarHBondContact O-N 3.3Å; V433-A437 WeakPolarHBondContact O-CB 3.45Å; V433-A437 PolarHBondContact O-N 3.31Å
434	R	95.3	Very high	95.5	Very high	41 Å²	41	31.6 Å²	31.6	16%	0.155	16%	0.16	C	C	.	.	H	α-helix	trans	-61.2	-38.7	171.8	-67.2	-177.6	-98.7	164.6	-4.3	112.3	F425 L426 D428 P429 H430 P431 A437 C438 D470 V476	F425-R434 WeakPolarHBondContact O-CG 3.13Å; L426-R434 VanDerWaalsContact O-CD 3.23Å; L426-R434 WeakPolarHBondContact O-CD 3.42Å; L426-R434 WeakPolarHBondContact O-CG 3.35Å; D428-R434 HydrophobicContact CB-CG 4.14Å; D428-R434 VanDerWaalsContact O-CD 3.26Å; D428-R434 WeakPolarHBondContact O-CD 3.47Å; D428-R434 WeakPolarHBondContact O-CG 3.37Å; D428-R434 PolarHBondContact O-NE 3.19Å; P429-R434 PolarHBondContact O-NH2 2.92Å; H430-R434 PolarHBondContact O-N 3.32Å; P431-R434 WeakPolarHBondContact O-CB 3.48Å; P431-R434 PolarHBondContact O-N 2.93Å; R434-A437 PolarHBondContact O-N 3.04Å; R434-C438 PolarHBondContact O-N 3.13Å; R434-C438 PolarHBondContact O-SG 3.06Å; R434-D470 IonicContact NH1-OD2 3.51Å; R434-D470 PolarHBondContact NH1-OD2 3.38Å; R434-V476 HydrophobicContact CB-CG1 3.93Å; R434-V476 HydrophobicContact CB-CG2 3.95Å
435	Y	92.9	Very high	95.6	Very high	33 Å²	33	26 Å²	26	13%	0.129	13%	0.131	C	C	.	.	H	α-helix	trans	-61.8	-52.8	173.5	179.3	-84.6	0	0	0	111.7	W339 P431 R432 V433 A437 C438 N439 H479	W339-Y435 AromaticContact CH2-CD2 3.83Å; W339-Y435 HydrophobicContact CH2-CD2 3.83Å; W339-Y435 AromaticContact CH2-CG 3.9Å; W339-Y435 HydrophobicContact CH2-CG 3.9Å; W339-Y435 HydrophobicContact CZ2-CD1 4.45Å; W339-Y435 AromaticContact CZ2-CD2 3.88Å; W339-Y435 HydrophobicContact CZ2-CD2 3.88Å; W339-Y435 HydrophobicContact CZ2-CE2 4.38Å; W339-Y435 AromaticContact CZ2-CG 3.91Å; W339-Y435 HydrophobicContact CZ2-CG 3.91Å; P431-Y435 PolarHBondContact O-N 3.17Å; R432-Y435 WeakPolarHBondContact O-CB 3.39Å; R432-Y435 PolarHBondContact O-N 3.22Å; V433-Y435 VanDerWaalsContact C-N 3.3Å; V433-Y435 PolarHBondContact O-N 3.46Å; Y435-A437 PolarHBondContact O-N 2.93Å; Y435-C438 WeakPolarHBondContact O-CA 3.41Å; Y435-C438 WeakPolarHBondContact O-CB 3.29Å; Y435-C438 PolarHBondContact O-N 3.13Å; Y435-N439 PolarHBondContact O-N 3.1Å; Y435-H479 HydrophobicContact CD2-CB 3.58Å; Y435-H479 AromaticContact CD2-CD2 3.9Å; Y435-H479 AromaticContact CD2-CG 3.6Å; Y435-H479 AromaticContact CE1-CD2 3.89Å; Y435-H479 AromaticContact CE1-CE1 3.87Å; Y435-H479 AromaticContact CE1-NE2 3.64Å; Y435-H479 HydrophobicContact CE2-CB 3.61Å; Y435-H479 AromaticContact CE2-CD2 3.73Å; Y435-H479 AromaticContact CE2-CE1 3.75Å; Y435-H479 AromaticContact CE2-CG 3.27Å; Y435-H479 AromaticContact CE2-ND1 3.28Å; Y435-H479 VanDerWaalsContact CE2-ND1 3.28Å; Y435-H479 WeakPolarHBondContact CE2-ND1 3.28Å; Y435-H479 HydrophobicContact CG-CB 4.41Å; Y435-H479 AromaticContact CZ-CD2 3.73Å; Y435-H479 AromaticContact CZ-CE1 3.3Å; Y435-H479 AromaticContact CZ-CG 3.63Å; Y435-H479 AromaticContact CZ-ND1 3.35Å; Y435-H479 AromaticContact CZ-NE2 3.53Å; Y435-H479 PolarHBondContact O-CD2 3.37Å; Y435-H479 PolarHBondContact OH-CE1 3.31Å; Y435-H479 PolarHBondContact OH-ND1 2.85Å
436	A	95.2	Very high	95.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.3	-30.4	176.3	0	0	0	0	0	112.6	L397 M398 R432 V433 N439 A440	L397-A436 HydrophobicContact CB-CB 3.82Å; L397-A436 HydrophobicContact CD1-CB 4.01Å; M398-A436 HydrophobicContact CG-CB 4.19Å; M398-A436 HydrophobicContact SD-CB 3.67Å; R432-A436 PolarHBondContact O-N 3.43Å; V433-A436 PolarHBondContact O-N 3.3Å; A436-N439 WeakPolarHBondContact O-CB 3.08Å; A436-N439 PolarHBondContact O-N 3.42Å; A436-A440 WeakPolarHBondContact O-CB 3.37Å; A436-A440 PolarHBondContact O-N 3.46Å
437	A	97.7	Very high	95.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.5	-35.5	173.3	0	0	0	0	0	112.3	L397 F425 L426 V433 R434 Y435 V441	L397-A437 HydrophobicContact CD1-CB 3.99Å; F425-A437 HydrophobicContact CB-CB 3.71Å; L426-A437 HydrophobicContact CD2-CB 3.93Å; L426-A437 HydrophobicContact CG-CB 4.29Å; V433-A437 WeakPolarHBondContact O-CB 3.45Å; V433-A437 PolarHBondContact O-N 3.31Å; R434-A437 PolarHBondContact O-N 3.04Å; Y435-A437 PolarHBondContact O-N 2.93Å; A437-V441 VanDerWaalsContact O-CG2 3.27Å; A437-V441 WeakPolarHBondContact O-CG2 3.2Å; A437-V441 PolarHBondContact O-N 2.86Å; A437-V441 VanDerWaalsContact O-N 3.1Å
438	C	96.4	Very high	95.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.9	-44.6	171.1	-62	0	0	0	0	110.6	L426 R434 Y435 A440 V441 G442 H479 A483	L426-C438 HydrophobicContact CD2-CB 4.5Å; L426-C438 WeakPolarHBondContact CD2-SG 3.46Å; R434-C438 PolarHBondContact O-N 3.13Å; R434-C438 PolarHBondContact O-SG 3.06Å; Y435-C438 WeakPolarHBondContact O-CA 3.41Å; Y435-C438 WeakPolarHBondContact O-CB 3.29Å; Y435-C438 PolarHBondContact O-N 3.13Å; C438-A440 PolarHBondContact O-N 3.08Å; C438-V441 PolarHBondContact O-N 3.23Å; C438-G442 PolarHBondContact O-N 3.29Å; C438-H479 HydrophobicContact CB-CB 4.05Å; C438-A483 VanDerWaalsContact O-CB 3.27Å; C438-A483 WeakPolarHBondContact O-CB 3.5Å
439	N	95.4	Very high	95.4	Very high	37 Å²	37	25 Å²	25	20%	0.198	14%	0.137	C	C	.	.	H	α-helix	trans	-55.1	-54	175.7	-176.9	-78.7	0	0	0	110.8	M398 S401 Y435 A436 V441 G442 Q443 H479	M398-N439 HydrophobicContact CE-CB 4.46Å; M398-N439 HydrophobicContact SD-CB 4.18Å; S401-N439 WeakPolarHBondContact CB-OD1 3.38Å; S401-N439 PolarHBondContact OG-OD1 3.35Å; Y435-N439 PolarHBondContact O-N 3.1Å; A436-N439 WeakPolarHBondContact O-CB 3.08Å; A436-N439 PolarHBondContact O-N 3.42Å; N439-V441 VanDerWaalsContact C-N 3.29Å; N439-V441 PolarHBondContact O-N 3.27Å; N439-G442 PolarHBondContact O-N 2.81Å; N439-Q443 PolarHBondContact O-N 3.16Å; N439-H479 WeakPolarHBondContact CB-NE2 3.4Å
440	A	97.3	Very high	95.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.6	-37.4	178.9	0	0	0	0	0	113.6	L397 S401 V422 A436 C438 M444	L397-A440 HydrophobicContact CD2-CB 4.49Å; S401-A440 WeakPolarHBondContact OG-CA 3.38Å; S401-A440 WeakPolarHBondContact OG-CB 3.26Å; V422-A440 HydrophobicContact CG1-CB 4.01Å; A436-A440 WeakPolarHBondContact O-CB 3.37Å; A436-A440 PolarHBondContact O-N 3.46Å; C438-A440 PolarHBondContact O-N 3.08Å; A440-M444 VanDerWaalsContact O-CB 3.29Å; A440-M444 WeakPolarHBondContact O-CB 3.48Å; A440-M444 WeakPolarHBondContact O-CE 3.19Å; A440-M444 WeakPolarHBondContact O-CG 3.29Å; A440-M444 PolarHBondContact O-N 3.21Å
441	V	98.1	Very high	95.5	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.012	13%	0.125	C	C	.	.	H	α-helix	trans	-67.2	-42.6	175.2	171.5	0	0	0	0	111.5	V422 L423 A437 C438 N439 A445 V460 L464	V422-V441 HydrophobicContact CG1-CG2 3.79Å; L423-V441 HydrophobicContact CD2-CG2 3.96Å; A437-V441 VanDerWaalsContact O-CG2 3.27Å; A437-V441 WeakPolarHBondContact O-CG2 3.2Å; A437-V441 PolarHBondContact O-N 2.86Å; A437-V441 VanDerWaalsContact O-N 3.1Å; C438-V441 PolarHBondContact O-N 3.23Å; N439-V441 VanDerWaalsContact C-N 3.29Å; N439-V441 PolarHBondContact O-N 3.27Å; V441-A445 PolarHBondContact O-N 3.16Å; V441-A445 VanDerWaalsContact O-N 3.16Å; V441-V460 HydrophobicContact CG1-CG1 3.69Å; V441-L464 HydrophobicContact CG1-CD1 4.01Å; V441-L464 HydrophobicContact CG1-CD2 4.04Å; V441-L464 HydrophobicContact CG1-CG 4.22Å
442	G	96.7	Very high	95.8	Very high	3 Å²	3	20.5 Å²	20.5	3%	0.031	12%	0.115	C	C	.	.	H	α-helix	trans	-64.3	-50.1	177.6	0	0	0	0	0	111.9	C438 N439 M444 A445 T446	C438-G442 PolarHBondContact O-N 3.29Å; N439-G442 PolarHBondContact O-N 2.81Å; G442-M444 PolarHBondContact O-N 3.16Å; G442-A445 WeakPolarHBondContact O-CA 3.41Å; G442-A445 VanDerWaalsContact O-CB 3.27Å; G442-A445 WeakPolarHBondContact O-CB 3.49Å; G442-A445 PolarHBondContact O-N 3.42Å; G442-T446 PolarHBondContact O-N 2.95Å; G442-T446 PolarHBondContact O-OG1 3.1Å
443	Q	96.4	Very high	96	Very high	61 Å²	61	18.5 Å²	18.5	29%	0.285	11%	0.108	S	C	.	.	H	α-helix	trans	-61.5	-45.3	179.5	-164.6	60.8	45.5	0	0	111.7	N439 A445 T446 D447	N439-Q443 PolarHBondContact O-N 3.16Å; Q443-A445 PolarHBondContact O-N 3.11Å; Q443-T446 WeakPolarHBondContact O-CB 3.21Å; Q443-T446 PolarHBondContact O-N 3.31Å; Q443-D447 PolarHBondContact NE2-OD1 3.45Å; Q443-D447 VanDerWaalsContact O-CG 3.26Å; Q443-D447 PolarHBondContact O-N 3.32Å
444	M	97.3	Very high	95.9	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-61.8	-26.2	173.8	-75.2	-172.8	-69.5	0	0	113.2	L415 I418 V419 V422 A440 G442 T446 F448 F452	L415-M444 HydrophobicContact CD1-SD 4.18Å; I418-M444 HydrophobicContact CG2-SD 3.8Å; V419-M444 HydrophobicContact CG2-CE 4.27Å; V419-M444 HydrophobicContact CG2-SD 4.11Å; V422-M444 HydrophobicContact CB-CE 4.15Å; V422-M444 HydrophobicContact CG1-CE 4.03Å; V422-M444 HydrophobicContact CG2-CE 4.06Å; A440-M444 VanDerWaalsContact O-CB 3.29Å; A440-M444 WeakPolarHBondContact O-CB 3.48Å; A440-M444 WeakPolarHBondContact O-CE 3.19Å; A440-M444 WeakPolarHBondContact O-CG 3.29Å; A440-M444 PolarHBondContact O-N 3.21Å; G442-M444 PolarHBondContact O-N 3.16Å; M444-T446 VanDerWaalsContact C-N 3.34Å; M444-F448 HydrophobicContact CB-CD2 4.1Å; M444-F448 HydrophobicContact CB-CE2 4.42Å; M444-F448 HydrophobicContact CG-CD2 4.25Å; M444-F448 HydrophobicContact CG-CE2 4.06Å; M444-F448 WeakPolarHBondContact O-CB 3.44Å; M444-F448 WeakPolarHBondContact O-CD2 3.46Å; M444-F448 PolarHBondContact O-N 2.91Å; M444-F452 HydrophobicContact CB-CD2 4.12Å; M444-F452 HydrophobicContact CB-CE2 3.63Å; M444-F452 HydrophobicContact CB-CZ 4.13Å; M444-F452 WeakPolarHBondContact O-CD2 3.22Å; M444-F452 HydrophobicContact SD-CE2 4.35Å
445	A	97.1	Very high	95.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-71.6	-32.5	176.5	0	0	0	0	0	111.8	V441 G442 Q443 A449 F452 Q453 N486 F487	V441-A445 PolarHBondContact O-N 3.16Å; V441-A445 VanDerWaalsContact O-N 3.16Å; G442-A445 WeakPolarHBondContact O-CA 3.41Å; G442-A445 VanDerWaalsContact O-CB 3.27Å; G442-A445 WeakPolarHBondContact O-CB 3.49Å; G442-A445 PolarHBondContact O-N 3.42Å; Q443-A445 PolarHBondContact O-N 3.11Å; A445-A449 WeakPolarHBondContact O-CB 3.28Å; A445-F452 HydrophobicContact CB-CD1 3.97Å; A445-F452 HydrophobicContact CB-CE1 4.01Å; A445-Q453 PolarHBondContact O-NE2 3.49Å; A445-N486 HydrophobicContact CB-CB 4.46Å; A445-F487 HydrophobicContact CB-CB 4.14Å; A445-F487 HydrophobicContact CB-CD2 4.1Å
446	T	95.1	Very high	96.1	Very high	53 Å²	53	26.9 Å²	26.9	33%	0.325	15%	0.146	S	C	.	.	H	α-helix	trans	-73.5	-60.5	171.6	-43.5	0	0	0	0	110.8	G442 Q443 M444 F448 A449 N486	G442-T446 PolarHBondContact O-N 2.95Å; G442-T446 PolarHBondContact O-OG1 3.1Å; Q443-T446 WeakPolarHBondContact O-CB 3.21Å; Q443-T446 PolarHBondContact O-N 3.31Å; M444-T446 VanDerWaalsContact C-N 3.34Å; T446-F448 VanDerWaalsContact C-N 3.26Å; T446-F448 PolarHBondContact O-N 3.17Å; T446-F448 VanDerWaalsContact O-N 3.14Å; T446-A449 WeakPolarHBondContact O-CB 3.37Å; T446-A449 PolarHBondContact O-N 3.49Å; T446-A449 VanDerWaalsContact O-N 3.07Å; T446-N486 PolarHBondContact OG1-ND2 3.22Å
447	D	94.8	Very high	96.1	Very high	26 Å²	26	28.8 Å²	28.8	14%	0.139	16%	0.155	C	C	.	.	H	α-helix	trans	-65.5	-28.6	-167.5	-50.2	-20.1	0	0	0	113.5	G404 E405 Q443	G404-D447 VanDerWaalsContact CA-OD2 3.23Å; G404-D447 WeakPolarHBondContact CA-OD2 3.44Å; E405-D447 PolarHBondContact N-OD2 3Å; Q443-D447 PolarHBondContact NE2-OD1 3.45Å; Q443-D447 VanDerWaalsContact O-CG 3.26Å; Q443-D447 PolarHBondContact O-N 3.32Å
448	F	96	Very high	95.9	Very high	10 Å²	10	35.2 Å²	35.2	4%	0.044	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	15.1	-178.6	-60.4	-96.1	0	0	0	112.5	H408 M411 L415 M444 T446 G451 F452	H408-F448 VanDerWaalsContact CA-CE1 3.47Å; H408-F448 HydrophobicContact CB-CD1 3.92Å; H408-F448 HydrophobicContact CB-CE1 3.6Å; H408-F448 HydrophobicContact CB-CE2 4.28Å; H408-F448 HydrophobicContact CB-CG 4.43Å; H408-F448 HydrophobicContact CB-CZ 3.78Å; H408-F448 VanDerWaalsContact O-CE1 3.26Å; H408-F448 WeakPolarHBondContact O-CE1 3.41Å; M411-F448 HydrophobicContact CB-CE1 3.83Å; M411-F448 HydrophobicContact CB-CZ 3.74Å; M411-F448 HydrophobicContact CE-CZ 4.08Å; M411-F448 HydrophobicContact SD-CZ 4.19Å; L415-F448 HydrophobicContact CD1-CD1 4Å; L415-F448 HydrophobicContact CD1-CD2 4.19Å; L415-F448 HydrophobicContact CD1-CE1 3.88Å; L415-F448 HydrophobicContact CD1-CE2 4.12Å; L415-F448 HydrophobicContact CD1-CG 4.14Å; L415-F448 HydrophobicContact CD1-CZ 3.96Å; L415-F448 HydrophobicContact CD2-CB 4.16Å; L415-F448 HydrophobicContact CD2-CD1 3.62Å; L415-F448 HydrophobicContact CD2-CE1 4.15Å; L415-F448 HydrophobicContact CD2-CG 3.96Å; L415-F448 HydrophobicContact CG-CD1 4.4Å; M444-F448 HydrophobicContact CB-CD2 4.1Å; M444-F448 HydrophobicContact CB-CE2 4.42Å; M444-F448 HydrophobicContact CG-CD2 4.25Å; M444-F448 HydrophobicContact CG-CE2 4.06Å; M444-F448 WeakPolarHBondContact O-CB 3.44Å; M444-F448 WeakPolarHBondContact O-CD2 3.46Å; M444-F448 PolarHBondContact O-N 2.91Å; T446-F448 VanDerWaalsContact C-N 3.26Å; T446-F448 PolarHBondContact O-N 3.17Å; T446-F448 VanDerWaalsContact O-N 3.14Å; F448-G451 CarbonylContact O-C 3.39Å; F448-G451 WeakPolarHBondContact O-CA 3.47Å; F448-G451 PolarHBondContact O-N 3.28Å; F448-F452 HydrophobicContact CB-CB 3.88Å; F448-F452 HydrophobicContact CB-CD2 4.35Å; F448-F452 PolarHBondContact O-N 3.03Å
449	A	94.8	Very high	95.8	Very high	38 Å²	38	40 Å²	40	31%	0.314	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	148.4	175.5	0	0	0	0	0	112.5	A445 T446 D490	A445-A449 WeakPolarHBondContact O-CB 3.28Å; T446-A449 WeakPolarHBondContact O-CB 3.37Å; T446-A449 PolarHBondContact O-N 3.49Å; T446-A449 VanDerWaalsContact O-N 3.07Å; A449-D490 HydrophobicContact CB-CB 3.63Å
450	P	94.6	Very high	95.8	Very high	59 Å²	59	38.2 Å²	38.2	38%	0.383	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85	10.1	-15.6	36.1	-36	0	0	0	112.1	F452 Q453 K454 P492	P450-F452 VanDerWaalsContact C-N 3.35Å; P450-Q453 VanDerWaalsContact CA-OE1 3.3Å; P450-K454 WeakPolarHBondContact O-CD 3.19Å; P450-K454 WeakPolarHBondContact O-CG 3.47Å; P450-K454 PolarHBondContact O-N 2.91Å; P450-P492 HydrophobicContact CB-CG 4.04Å
451	G	94.7	Very high	95.6	Very high	23 Å²	23	38.5 Å²	38.5	24%	0.237	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-34.8	-175.5	0	0	0	0	0	113	F448 K455	F448-G451 CarbonylContact O-C 3.39Å; F448-G451 WeakPolarHBondContact O-CA 3.47Å; F448-G451 PolarHBondContact O-N 3.28Å; G451-K455 WeakPolarHBondContact O-CG 3.15Å; G451-K455 PolarHBondContact O-N 3.19Å
452	F	97.1	Very high	95.2	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-51.8	176.1	-171.5	-93.8	0	0	0	111.8	L415 V419 M444 A445 F448 P450 K454 K455 F456 V460 F487	L415-F452 HydrophobicContact CD2-CD2 4.47Å; V419-F452 HydrophobicContact CG2-CD2 4.3Å; V419-F452 HydrophobicContact CG2-CE2 3.44Å; V419-F452 VanDerWaalsContact CG2-CE2 3.44Å; V419-F452 HydrophobicContact CG2-CZ 4.12Å; M444-F452 HydrophobicContact CB-CD2 4.12Å; M444-F452 HydrophobicContact CB-CE2 3.63Å; M444-F452 HydrophobicContact CB-CZ 4.13Å; M444-F452 WeakPolarHBondContact O-CD2 3.22Å; M444-F452 HydrophobicContact SD-CE2 4.35Å; A445-F452 HydrophobicContact CB-CD1 3.97Å; A445-F452 HydrophobicContact CB-CE1 4.01Å; F448-F452 HydrophobicContact CB-CB 3.88Å; F448-F452 HydrophobicContact CB-CD2 4.35Å; F448-F452 PolarHBondContact O-N 3.03Å; P450-F452 VanDerWaalsContact C-N 3.35Å; F452-K454 VanDerWaalsContact C-N 3.33Å; F452-K454 PolarHBondContact O-N 3.16Å; F452-K455 PolarHBondContact O-N 3.3Å; F452-K455 VanDerWaalsContact O-N 3.11Å; F452-F456 AromaticContact CD2-CD2 3.69Å; F452-F456 HydrophobicContact CD2-CD2 3.69Å; F452-F456 HydrophobicContact CD2-CE2 4.11Å; F452-F456 AromaticContact CE2-CD2 3.96Å; F452-F456 HydrophobicContact CE2-CD2 3.96Å; F452-F456 HydrophobicContact CE2-CE2 4.49Å; F452-F456 HydrophobicContact CG-CD2 4.03Å; F452-F456 WeakPolarHBondContact O-CD2 3.36Å; F452-F456 PolarHBondContact O-N 2.92Å; F452-V460 HydrophobicContact CE1-CG1 4.24Å; F452-V460 HydrophobicContact CE1-CG2 3.84Å; F452-V460 HydrophobicContact CZ-CG2 3.87Å; F452-F487 AromaticContact CD1-CD2 3.93Å; F452-F487 HydrophobicContact CD1-CD2 3.93Å; F452-F487 AromaticContact CD1-CE2 3.73Å; F452-F487 HydrophobicContact CD1-CE2 3.73Å; F452-F487 AromaticContact CE1-CD2 3.8Å; F452-F487 HydrophobicContact CE1-CD2 3.8Å; F452-F487 AromaticContact CE1-CE2 3.79Å; F452-F487 HydrophobicContact CE1-CE2 3.79Å
453	Q	96.8	Very high	95.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.4	-44.6	-179.6	-65.2	79.9	-5.7	0	0	110.1	A445 P450 K455 H457 F487 C491	A445-Q453 PolarHBondContact O-NE2 3.49Å; P450-Q453 VanDerWaalsContact CA-OE1 3.3Å; Q453-K455 VanDerWaalsContact C-N 3.28Å; Q453-K455 PolarHBondContact O-N 3.22Å; Q453-H457 VanDerWaalsContact O-CB 3.31Å; Q453-H457 WeakPolarHBondContact O-CB 3.27Å; Q453-H457 PolarHBondContact O-CD2 3.18Å; Q453-H457 VanDerWaalsContact O-CD2 3.26Å; Q453-H457 PolarHBondContact O-N 3.41Å; Q453-F487 HydrophobicContact CB-CE1 4.35Å; Q453-F487 HydrophobicContact CB-CE2 4.28Å; Q453-F487 HydrophobicContact CB-CZ 3.87Å; Q453-F487 HydrophobicContact CG-CD1 4.36Å; Q453-F487 HydrophobicContact CG-CD2 4.2Å; Q453-F487 HydrophobicContact CG-CE1 4.01Å; Q453-F487 HydrophobicContact CG-CE2 3.88Å; Q453-F487 HydrophobicContact CG-CG 4.43Å; Q453-F487 HydrophobicContact CG-CZ 3.75Å; Q453-F487 WeakPolarHBondContact CG-O 3.28Å; Q453-C491 HydrophobicContact CB-CB 4.43Å; Q453-C491 HydrophobicContact CG-CB 4Å
454	K	94.9	Very high	95	Very high	118 Å²	118	38.9 Å²	38.9	51%	0.513	21%	0.211	S	C	.	.	H	α-helix	trans	-57.1	-35.7	176.1	-77.2	167.3	-173.5	175.9	0	114	P450 F452 L495	P450-K454 WeakPolarHBondContact O-CD 3.19Å; P450-K454 WeakPolarHBondContact O-CG 3.47Å; P450-K454 PolarHBondContact O-N 2.91Å; F452-K454 VanDerWaalsContact C-N 3.33Å; F452-K454 PolarHBondContact O-N 3.16Å; K454-L495 HydrophobicContact CB-CD1 4.25Å; K454-L495 HydrophobicContact CG-CD1 3.47Å; K454-L495 VanDerWaalsContact CG-CD1 3.47Å
455	K	95.8	Very high	94.5	Very high	121 Å²	121	39.1 Å²	39.1	53%	0.526	21%	0.212	S	C	.	.	H	α-helix	trans	-96.6	-33.4	-171.6	-69.1	171.7	-174.2	167.9	0	113.4	G451 F452 Q453	G451-K455 WeakPolarHBondContact O-CG 3.15Å; G451-K455 PolarHBondContact O-N 3.19Å; F452-K455 PolarHBondContact O-N 3.3Å; F452-K455 VanDerWaalsContact O-N 3.11Å; Q453-K455 VanDerWaalsContact C-N 3.28Å; Q453-K455 PolarHBondContact O-N 3.22Å
456	F	96.9	Very high	94.2	Very high	10 Å²	10	44.5 Å²	44.5	4%	0.044	24%	0.238	C	C	.	.	H	α-helix	trans	-121.4	1.6	-164.1	-52.1	-62.8	0	0	0	115.1	L415 N416 V419 F452 E458 K459 V460	L415-F456 HydrophobicContact CD2-CE2 3.76Å; L415-F456 HydrophobicContact CD2-CZ 4.39Å; L415-F456 HydrophobicContact CG-CE2 3.79Å; L415-F456 HydrophobicContact CG-CZ 4.12Å; N416-F456 HydrophobicContact CB-CE1 3.84Å; N416-F456 HydrophobicContact CB-CZ 3.98Å; V419-F456 HydrophobicContact CG1-CB 4.42Å; V419-F456 HydrophobicContact CG1-CD1 4.22Å; V419-F456 HydrophobicContact CG1-CG 4.17Å; V419-F456 HydrophobicContact CG2-CD2 4.13Å; V419-F456 HydrophobicContact CG2-CE2 4.07Å; V419-F456 HydrophobicContact CG2-CG 4.47Å; V419-F456 HydrophobicContact CG2-CZ 4.36Å; F452-F456 AromaticContact CD2-CD2 3.69Å; F452-F456 HydrophobicContact CD2-CD2 3.69Å; F452-F456 HydrophobicContact CD2-CE2 4.11Å; F452-F456 AromaticContact CE2-CD2 3.96Å; F452-F456 HydrophobicContact CE2-CD2 3.96Å; F452-F456 HydrophobicContact CE2-CE2 4.49Å; F452-F456 HydrophobicContact CG-CD2 4.03Å; F452-F456 WeakPolarHBondContact O-CD2 3.36Å; F452-F456 PolarHBondContact O-N 2.92Å; F456-E458 VanDerWaalsContact C-N 3.26Å; F456-E458 PolarHBondContact O-N 3.05Å; F456-K459 PolarHBondContact O-N 3.32Å; F456-V460 HydrophobicContact CB-CG2 3.78Å; F456-V460 PolarHBondContact O-N 2.91Å
457	H	94.4	Very high	94	Very high	40 Å²	40	42 Å²	42	19%	0.185	22%	0.223	C	C	.	.	H	α-helix	trans	-45.1	-45.4	-176.4	59.4	81.2	0	0	0	114.2	Q453 K459 I461 F487 Y499	Q453-H457 VanDerWaalsContact O-CB 3.31Å; Q453-H457 WeakPolarHBondContact O-CB 3.27Å; Q453-H457 PolarHBondContact O-CD2 3.18Å; Q453-H457 VanDerWaalsContact O-CD2 3.26Å; Q453-H457 PolarHBondContact O-N 3.41Å; H457-K459 PolarHBondContact O-N 2.97Å; H457-I461 HydrophobicContact CB-CD1 4.28Å; H457-I461 VanDerWaalsContact O-CB 3.24Å; H457-I461 WeakPolarHBondContact O-CB 3.45Å; H457-I461 VanDerWaalsContact O-CG1 3.22Å; H457-I461 WeakPolarHBondContact O-CG1 3.39Å; H457-I461 PolarHBondContact O-N 3.32Å; H457-F487 HydrophobicContact CB-CE1 4.37Å; H457-F487 HydrophobicContact CB-CZ 3.84Å; H457-Y499 AromaticContact CE1-CE2 3.64Å; H457-Y499 AromaticContact CE1-CZ 3.65Å; H457-Y499 PolarHBondContact CE1-OH 3.31Å; H457-Y499 AromaticContact ND1-CE2 3.1Å; H457-Y499 WeakPolarHBondContact ND1-CE2 3.45Å; H457-Y499 AromaticContact ND1-CZ 3.17Å; H457-Y499 PolarHBondContact ND1-OH 3.32Å
458	E	92.4	Very high	93.6	Very high	136 Å²	136	41 Å²	41	64%	0.636	22%	0.217	S	C	*	.	H	α-helix	trans	-65.6	-41.2	-176.3	-168.2	177.2	-174.1	0	0	112.6	F456 A462	F456-E458 VanDerWaalsContact C-N 3.26Å; F456-E458 PolarHBondContact O-N 3.05Å; E458-A462 VanDerWaalsContact O-CB 3.25Å; E458-A462 WeakPolarHBondContact O-CB 3.3Å
459	K	95.1	Very high	92.8	Very high	100 Å²	100	45.1 Å²	45.1	44%	0.435	24%	0.236	S	C	.	.	H	α-helix	trans	-77.3	-45.5	-178.9	-68.8	-179.7	178.4	177.3	0	111.7	N420 L423 F456 H457 A463	N420-K459 PolarHBondContact OD1-NZ 3.05Å; L423-K459 HydrophobicContact CD1-CB 3.94Å; F456-K459 PolarHBondContact O-N 3.32Å; H457-K459 PolarHBondContact O-N 2.97Å; K459-A463 VanDerWaalsContact O-CB 3.26Å; K459-A463 WeakPolarHBondContact O-CB 3.37Å; K459-A463 PolarHBondContact O-N 3.11Å
460	V	96.2	Very high	91.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.9	-49.7	-174	172.4	0	0	0	0	110.6	V419 V441 F452 F456 A462 A463 L464 F487	V419-V460 HydrophobicContact CG1-CG2 4.27Å; V441-V460 HydrophobicContact CG1-CG1 3.69Å; F452-V460 HydrophobicContact CE1-CG1 4.24Å; F452-V460 HydrophobicContact CE1-CG2 3.84Å; F452-V460 HydrophobicContact CZ-CG2 3.87Å; F456-V460 HydrophobicContact CB-CG2 3.78Å; F456-V460 PolarHBondContact O-N 2.91Å; V460-A462 VanDerWaalsContact C-N 3.31Å; V460-A462 PolarHBondContact O-N 3.19Å; V460-A463 PolarHBondContact O-N 3.12Å; V460-L464 HydrophobicContact CG1-CD1 3.8Å; V460-L464 HydrophobicContact CG1-CG 4.25Å; V460-L464 WeakPolarHBondContact O-CB 3.46Å; V460-L464 WeakPolarHBondContact O-CG 3.26Å; V460-L464 PolarHBondContact O-N 3.16Å; V460-F487 HydrophobicContact CB-CD2 4.37Å; V460-F487 HydrophobicContact CB-CE2 4.09Å; V460-F487 HydrophobicContact CG1-CD2 3.69Å; V460-F487 HydrophobicContact CG1-CE2 3.92Å; V460-F487 HydrophobicContact CG1-CG 4.41Å
461	I	91.9	Very high	90.2	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-44.6	179	-64.9	172.3	0	0	0	110.3	H457 A463 L465 F487 Y499 L503	H457-I461 HydrophobicContact CB-CD1 4.28Å; H457-I461 VanDerWaalsContact O-CB 3.24Å; H457-I461 WeakPolarHBondContact O-CB 3.45Å; H457-I461 VanDerWaalsContact O-CG1 3.22Å; H457-I461 WeakPolarHBondContact O-CG1 3.39Å; H457-I461 PolarHBondContact O-N 3.32Å; I461-A463 PolarHBondContact O-N 3.22Å; I461-L465 HydrophobicContact CG2-CD1 3.79Å; I461-L465 HydrophobicContact CG2-CG 4.26Å; I461-L465 VanDerWaalsContact O-CB 3.29Å; I461-L465 WeakPolarHBondContact O-CB 3.43Å; I461-L465 VanDerWaalsContact O-CG 3.24Å; I461-L465 WeakPolarHBondContact O-CG 3.25Å; I461-L465 PolarHBondContact O-N 3.48Å; I461-F487 HydrophobicContact CD1-CD1 4.48Å; I461-F487 HydrophobicContact CD1-CE1 3.89Å; I461-F487 HydrophobicContact CG1-CD1 4.21Å; I461-F487 HydrophobicContact CG1-CE1 3.91Å; I461-F487 HydrophobicContact CG1-CZ 4.41Å; I461-Y499 HydrophobicContact CD1-CD2 4.4Å; I461-Y499 HydrophobicContact CD1-CG 4.17Å; I461-L503 HydrophobicContact CG2-CD1 4.45Å
462	A	91.3	Very high	89	Confident	58 Å²	58	52 Å²	52	48%	0.479	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-43.3	179.5	0	0	0	0	0	112.4	E458 V460 Q466	E458-A462 VanDerWaalsContact O-CB 3.25Å; E458-A462 WeakPolarHBondContact O-CB 3.3Å; V460-A462 VanDerWaalsContact C-N 3.31Å; V460-A462 PolarHBondContact O-N 3.19Å; A462-Q466 WeakPolarHBondContact O-CB 3.37Å; A462-Q466 PolarHBondContact O-N 3.13Å
463	A	94.4	Very high	88.4	Confident	16 Å²	16	52.3 Å²	52.3	13%	0.132	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-44.8	-179.8	0	0	0	0	0	112.2	L423 L426 K459 V460 I461 Q466 T467	L423-A463 HydrophobicContact CD2-CB 3.75Å; L426-A463 HydrophobicContact CD1-CB 3.8Å; K459-A463 VanDerWaalsContact O-CB 3.26Å; K459-A463 WeakPolarHBondContact O-CB 3.37Å; K459-A463 PolarHBondContact O-N 3.11Å; V460-A463 PolarHBondContact O-N 3.12Å; I461-A463 PolarHBondContact O-N 3.22Å; A463-Q466 PolarHBondContact O-N 3.41Å; A463-T467 PolarHBondContact O-N 3.29Å; A463-T467 PolarHBondContact O-OG1 2.88Å
464	L	93.5	Very high	87.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-44.5	177.6	-69.2	178.9	0	0	0	111.5	V441 V460 Q466 T467 M468 A480 A483 L484	V441-L464 HydrophobicContact CG1-CD1 4.01Å; V441-L464 HydrophobicContact CG1-CD2 4.04Å; V441-L464 HydrophobicContact CG1-CG 4.22Å; V460-L464 HydrophobicContact CG1-CD1 3.8Å; V460-L464 HydrophobicContact CG1-CG 4.25Å; V460-L464 WeakPolarHBondContact O-CB 3.46Å; V460-L464 WeakPolarHBondContact O-CG 3.26Å; V460-L464 PolarHBondContact O-N 3.16Å; L464-Q466 VanDerWaalsContact C-N 3.32Å; L464-Q466 PolarHBondContact O-N 3.1Å; L464-T467 PolarHBondContact O-N 2.88Å; L464-T467 VanDerWaalsContact O-N 3.14Å; L464-M468 VanDerWaalsContact O-CG 3.26Å; L464-M468 WeakPolarHBondContact O-CG 3.27Å; L464-M468 PolarHBondContact O-N 3.24Å; L464-A480 HydrophobicContact CD2-CB 4.34Å; L464-A483 HydrophobicContact CD1-CB 4.15Å; L464-A483 HydrophobicContact CD2-CB 3.98Å; L464-L484 HydrophobicContact CD1-CB 4.15Å; L464-L484 HydrophobicContact CD1-CD1 4.2Å
465	L	87.8	Confident	87.4	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-59.6	-42.3	175.3	-75.3	178.8	0	0	0	112	I461 T467 M468 E469 L484 L503 H506	I461-L465 HydrophobicContact CG2-CD1 3.79Å; I461-L465 HydrophobicContact CG2-CG 4.26Å; I461-L465 VanDerWaalsContact O-CB 3.29Å; I461-L465 WeakPolarHBondContact O-CB 3.43Å; I461-L465 VanDerWaalsContact O-CG 3.24Å; I461-L465 WeakPolarHBondContact O-CG 3.25Å; I461-L465 PolarHBondContact O-N 3.48Å; L465-T467 VanDerWaalsContact C-N 3.34Å; L465-T467 PolarHBondContact O-N 3.26Å; L465-M468 HydrophobicContact CD2-SD 4.29Å; L465-M468 PolarHBondContact O-N 3.4Å; L465-E469 WeakPolarHBondContact O-CG 3.47Å; L465-E469 PolarHBondContact O-N 3.35Å; L465-L484 HydrophobicContact CD2-CD2 4.29Å; L465-L503 HydrophobicContact CD1-CD1 4.24Å; L465-L503 HydrophobicContact CD2-CD1 3.98Å; L465-L503 HydrophobicContact CG-CD1 4.39Å; L465-H506 HydrophobicContact CD1-CB 4.37Å; L465-H506 HydrophobicContact CD2-CB 3.8Å
466	Q	90.3	Very high	87.2	Confident	114 Å²	114	43.6 Å²	43.6	53%	0.533	23%	0.234	S	C	.	.	H	α-helix	trans	-62.1	-42.1	175.1	-175.3	-177.8	26.7	0	0	111.8	A462 A463 L464 M468 E469 D470	A462-Q466 WeakPolarHBondContact O-CB 3.37Å; A462-Q466 PolarHBondContact O-N 3.13Å; A463-Q466 PolarHBondContact O-N 3.41Å; L464-Q466 VanDerWaalsContact C-N 3.32Å; L464-Q466 PolarHBondContact O-N 3.1Å; Q466-M468 VanDerWaalsContact C-N 3.34Å; Q466-E469 WeakPolarHBondContact O-CB 3.48Å; Q466-E469 PolarHBondContact O-N 2.64Å; Q466-E469 VanDerWaalsContact O-N 3.16Å; Q466-D470 PolarHBondContact O-N 3.03Å
467	T	91.1	Very high	86.8	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-35.6	178.1	-57.4	0	0	0	0	111.9	L426 A463 L464 L465 E469 D470 V476 A480	L426-T467 HydrophobicContact CD2-CG2 4.46Å; A463-T467 PolarHBondContact O-N 3.29Å; A463-T467 PolarHBondContact O-OG1 2.88Å; L464-T467 PolarHBondContact O-N 2.88Å; L464-T467 VanDerWaalsContact O-N 3.14Å; L465-T467 VanDerWaalsContact C-N 3.34Å; L465-T467 PolarHBondContact O-N 3.26Å; T467-E469 PolarHBondContact O-N 3.05Å; T467-D470 WeakPolarHBondContact O-CB 3.38Å; T467-D470 PolarHBondContact O-N 3.26Å; T467-D470 VanDerWaalsContact O-N 3.14Å; T467-V476 HydrophobicContact CG2-CG1 3.5Å; T467-A480 HydrophobicContact CG2-CB 3.74Å
468	M	85.3	Confident	86.6	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-21.9	173.5	-67.1	169.3	65.4	0	0	112.9	L464 L465 Q466 Q477 A480 A481 L484 L507 I510 V530	L464-M468 VanDerWaalsContact O-CG 3.26Å; L464-M468 WeakPolarHBondContact O-CG 3.27Å; L464-M468 PolarHBondContact O-N 3.24Å; L465-M468 HydrophobicContact CD2-SD 4.29Å; L465-M468 PolarHBondContact O-N 3.4Å; Q466-M468 VanDerWaalsContact C-N 3.34Å; M468-Q477 PolarHBondContact O-NE2 2.91Å; M468-A480 HydrophobicContact CG-CB 3.71Å; M468-A481 HydrophobicContact CE-CB 3.76Å; M468-A481 HydrophobicContact CG-CB 4.4Å; M468-A481 HydrophobicContact SD-CB 4.16Å; M468-L484 HydrophobicContact CE-CD2 4.42Å; M468-L484 HydrophobicContact SD-CD2 3.76Å; M468-L507 HydrophobicContact CE-CD2 3.64Å; M468-I510 HydrophobicContact CB-CD1 3.79Å; M468-I510 HydrophobicContact CE-CD1 3.93Å; M468-V530 HydrophobicContact CE-CG2 4.17Å
469	E	79	Confident	86.5	Confident	96 Å²	96	36.8 Å²	36.8	45%	0.449	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-11.2	174.6	-69.1	176.3	172.1	0	0	113.7	L465 Q466 T467 Q471 H506	L465-E469 WeakPolarHBondContact O-CG 3.47Å; L465-E469 PolarHBondContact O-N 3.35Å; Q466-E469 WeakPolarHBondContact O-CB 3.48Å; Q466-E469 PolarHBondContact O-N 2.64Å; Q466-E469 VanDerWaalsContact O-N 3.16Å; T467-E469 PolarHBondContact O-N 3.05Å; E469-Q471 WeakPolarHBondContact O-CG 3.47Å; E469-Q471 PolarHBondContact O-N 2.97Å; E469-H506 IonicContact OE1-CE1 3.35Å; E469-H506 PolarHBondContact OE1-CE1 2.78Å; E469-H506 IonicContact OE1-CG 3.91Å; E469-H506 IonicContact OE1-ND1 3.76Å; E469-H506 PolarHBondContact OE1-ND1 3.38Å
470	D	70.8	Confident	86.5	Confident	54 Å²	54	32 Å²	32	29%	0.289	18%	0.183	S	C	.	.			trans	-69.1	85.8	-179.2	-178.2	9.3	0	0	0	111.5	R434 Q466 T467 G472 N473 Q477	R434-D470 IonicContact NH1-OD2 3.51Å; R434-D470 PolarHBondContact NH1-OD2 3.38Å; Q466-D470 PolarHBondContact O-N 3.03Å; T467-D470 WeakPolarHBondContact O-CB 3.38Å; T467-D470 PolarHBondContact O-N 3.26Å; T467-D470 VanDerWaalsContact O-N 3.14Å; D470-G472 PolarHBondContact O-N 3.2Å; D470-G472 PolarHBondContact OD1-N 2.67Å; D470-N473 PolarHBondContact O-N 3.09Å; D470-Q477 PolarHBondContact O-NE2 2.98Å
471	Q	64.1	Low	86.2	Confident	144 Å²	144	32 Å²	32	67%	0.673	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-5.8	-175.5	-63.2	-159.9	-15.5	0	0	115.2	E469 Q477	E469-Q471 WeakPolarHBondContact O-CG 3.47Å; E469-Q471 PolarHBondContact O-N 2.97Å; Q471-Q477 VanDerWaalsContact CA-NE2 3.27Å
472	G	70.3	Confident	86.2	Confident	66 Å²	66	32.7 Å²	32.7	68%	0.68	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-15.6	-177.4	0	0	0	0	0	115.8	D470	D470-G472 PolarHBondContact O-N 3.2Å; D470-G472 PolarHBondContact OD1-N 2.67Å
473	N	84.4	Confident	86.4	Confident	8 Å²	8	30.1 Å²	30.1	4%	0.043	17%	0.168	C	C	.	.			trans	-149.2	115.2	-176.2	-169.4	-60.8	0	0	0	113.1	A340 P431 D470 R475 V476 Q477	A340-N473 VanDerWaalsContact CB-ND2 3.32Å; A340-N473 WeakPolarHBondContact CB-ND2 3.44Å; P431-N473 WeakPolarHBondContact CB-ND2 3.17Å; D470-N473 PolarHBondContact O-N 3.09Å; N473-R475 PolarHBondContact OD1-N 3.18Å; N473-R475 VanDerWaalsContact OD1-N 3.15Å; N473-V476 HydrophobicContact CB-CB 4.18Å; N473-V476 HydrophobicContact CB-CG2 4.21Å; N473-V476 WeakPolarHBondContact OD1-CG2 3.37Å; N473-V476 PolarHBondContact OD1-N 3.16Å; N473-Q477 WeakPolarHBondContact O-CG 3.45Å; N473-Q477 PolarHBondContact O-N 3.31Å
474	Q	84.2	Confident	86.4	Confident	48 Å²	48	29.4 Å²	29.4	22%	0.224	16%	0.162	C	C	.	.	H	α-helix	trans	-71	-41.1	-174.7	-65.9	-179.8	-3.8	0	0	112.9	V476 Q477 A478 V526	Q474-V476 PolarHBondContact O-N 3.36Å; Q474-Q477 PolarHBondContact O-N 2.9Å; Q474-A478 WeakPolarHBondContact O-CB 3.29Å; Q474-A478 PolarHBondContact O-N 3.13Å; Q474-V526 HydrophobicContact CB-CG2 4.1Å; Q474-V526 VanDerWaalsContact O-CG2 3.3Å; Q474-V526 WeakPolarHBondContact O-CG2 3.37Å
475	R	87.1	Confident	86.5	Confident	8 Å²	8	30 Å²	30	3%	0.03	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-41.2	179.4	-70	-166.2	72.5	162.8	1.5	112.2	W339 N473 A478 H479 L525	W339-R475 HydrophobicContact CH2-CB 3.69Å; W339-R475 HydrophobicContact CH2-CG 4.47Å; W339-R475 HydrophobicContact CZ2-CB 4.2Å; W339-R475 HydrophobicContact CZ3-CB 3.98Å; W339-R475 WeakPolarHBondContact O-CD 3.44Å; N473-R475 PolarHBondContact OD1-N 3.18Å; N473-R475 VanDerWaalsContact OD1-N 3.15Å; R475-A478 PolarHBondContact O-N 3.44Å; R475-H479 WeakPolarHBondContact O-CB 3.32Å; R475-H479 PolarHBondContact O-N 2.9Å; R475-L525 HydrophobicContact CG-CD2 3.96Å
476	V	90.6	Very high	86.8	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-41.7	176.9	174.4	0	0	0	0	111.2	P431 R434 T467 N473 Q474 H479 A480	P431-V476 HydrophobicContact CB-CG2 4.37Å; P431-V476 WeakPolarHBondContact O-CG2 3.36Å; R434-V476 HydrophobicContact CB-CG1 3.93Å; R434-V476 HydrophobicContact CB-CG2 3.95Å; T467-V476 HydrophobicContact CG2-CG1 3.5Å; N473-V476 HydrophobicContact CB-CB 4.18Å; N473-V476 HydrophobicContact CB-CG2 4.21Å; N473-V476 WeakPolarHBondContact OD1-CG2 3.37Å; N473-V476 PolarHBondContact OD1-N 3.16Å; Q474-V476 PolarHBondContact O-N 3.36Å; V476-H479 PolarHBondContact O-N 3.26Å; V476-A480 WeakPolarHBondContact O-CB 3.48Å; V476-A480 PolarHBondContact O-N 3.33Å
477	Q	89.5	Confident	87.1	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.019	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-46.7	174.8	-72	-174.4	-5.2	0	0	112.3	M468 D470 Q471 N473 Q474 H479 A480 A481 V526	M468-Q477 PolarHBondContact O-NE2 2.91Å; D470-Q477 PolarHBondContact O-NE2 2.98Å; Q471-Q477 VanDerWaalsContact CA-NE2 3.27Å; N473-Q477 WeakPolarHBondContact O-CG 3.45Å; N473-Q477 PolarHBondContact O-N 3.31Å; Q474-Q477 PolarHBondContact O-N 2.9Å; Q477-H479 VanDerWaalsContact C-N 3.33Å; Q477-H479 PolarHBondContact O-N 3.48Å; Q477-A480 PolarHBondContact O-N 3.17Å; Q477-A481 PolarHBondContact O-N 3Å; Q477-V526 HydrophobicContact CB-CG1 3.96Å; Q477-V526 HydrophobicContact CB-CG2 3.91Å
478	A	88.6	Confident	87.3	Confident	6 Å²	6	26.5 Å²	26.5	5%	0.05	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-43.3	179.5	0	0	0	0	0	111.2	Q474 R475 A481 A482 L525 V526 Q529	Q474-A478 WeakPolarHBondContact O-CB 3.29Å; Q474-A478 PolarHBondContact O-N 3.13Å; R475-A478 PolarHBondContact O-N 3.44Å; A478-A481 WeakPolarHBondContact O-CB 3.37Å; A478-A481 PolarHBondContact O-N 2.89Å; A478-A482 PolarHBondContact O-N 3.31Å; A478-L525 HydrophobicContact CB-CD1 4.48Å; A478-L525 HydrophobicContact CB-CD2 4.16Å; A478-L525 HydrophobicContact CB-CG 3.83Å; A478-V526 HydrophobicContact CB-CG2 4.26Å; A478-Q529 HydrophobicContact CB-CG 4.08Å
479	H	91.7	Very high	87.6	Confident	33 Å²	33	32.2 Å²	32.2	15%	0.153	18%	0.177	C	C	.	.	H	α-helix	trans	-72.8	-31.7	-179.9	-139.2	62.8	0	0	0	113.1	Y435 C438 N439 R475 V476 Q477 A481 A482 A483	Y435-H479 HydrophobicContact CD2-CB 3.58Å; Y435-H479 AromaticContact CD2-CD2 3.9Å; Y435-H479 AromaticContact CD2-CG 3.6Å; Y435-H479 AromaticContact CE1-CD2 3.89Å; Y435-H479 AromaticContact CE1-CE1 3.87Å; Y435-H479 AromaticContact CE1-NE2 3.64Å; Y435-H479 HydrophobicContact CE2-CB 3.61Å; Y435-H479 AromaticContact CE2-CD2 3.73Å; Y435-H479 AromaticContact CE2-CE1 3.75Å; Y435-H479 AromaticContact CE2-CG 3.27Å; Y435-H479 AromaticContact CE2-ND1 3.28Å; Y435-H479 VanDerWaalsContact CE2-ND1 3.28Å; Y435-H479 WeakPolarHBondContact CE2-ND1 3.28Å; Y435-H479 HydrophobicContact CG-CB 4.41Å; Y435-H479 AromaticContact CZ-CD2 3.73Å; Y435-H479 AromaticContact CZ-CE1 3.3Å; Y435-H479 AromaticContact CZ-CG 3.63Å; Y435-H479 AromaticContact CZ-ND1 3.35Å; Y435-H479 AromaticContact CZ-NE2 3.53Å; Y435-H479 PolarHBondContact O-CD2 3.37Å; Y435-H479 PolarHBondContact OH-CE1 3.31Å; Y435-H479 PolarHBondContact OH-ND1 2.85Å; C438-H479 HydrophobicContact CB-CB 4.05Å; N439-H479 WeakPolarHBondContact CB-NE2 3.4Å; R475-H479 WeakPolarHBondContact O-CB 3.32Å; R475-H479 PolarHBondContact O-N 2.9Å; V476-H479 PolarHBondContact O-N 3.26Å; Q477-H479 VanDerWaalsContact C-N 3.33Å; Q477-H479 PolarHBondContact O-N 3.48Å; H479-A481 VanDerWaalsContact C-N 3.31Å; H479-A482 WeakPolarHBondContact O-CB 3.28Å; H479-A482 PolarHBondContact O-N 2.82Å; H479-A483 PolarHBondContact O-N 2.92Å
480	A	93.6	Very high	88.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.9	-36.7	170.3	0	0	0	0	0	112	L464 T467 M468 V476 Q477 L484	L464-A480 HydrophobicContact CD2-CB 4.34Å; T467-A480 HydrophobicContact CG2-CB 3.74Å; M468-A480 HydrophobicContact CG-CB 3.71Å; V476-A480 WeakPolarHBondContact O-CB 3.48Å; V476-A480 PolarHBondContact O-N 3.33Å; Q477-A480 PolarHBondContact O-N 3.17Å; A480-L484 PolarHBondContact O-N 3.15Å; A480-L484 VanDerWaalsContact O-N 3.11Å
481	A	91.4	Very high	89.3	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-68.1	-38.1	172.7	0	0	0	0	0	112	M468 Q477 A478 H479 L484 I485 Q529	M468-A481 HydrophobicContact CE-CB 3.76Å; M468-A481 HydrophobicContact CG-CB 4.4Å; M468-A481 HydrophobicContact SD-CB 4.16Å; Q477-A481 PolarHBondContact O-N 3Å; A478-A481 WeakPolarHBondContact O-CB 3.37Å; A478-A481 PolarHBondContact O-N 2.89Å; H479-A481 VanDerWaalsContact C-N 3.31Å; A481-L484 WeakPolarHBondContact O-CB 3.33Å; A481-L484 PolarHBondContact O-N 3.04Å; A481-I485 WeakPolarHBondContact O-CG1 3.26Å; A481-I485 PolarHBondContact O-N 3.2Å; A481-I485 VanDerWaalsContact O-N 3.16Å; A481-Q529 HydrophobicContact CB-CB 3.73Å
482	A	91.4	Very high	90.7	Very high	20 Å²	20	23.6 Å²	23.6	17%	0.165	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-50.6	172.5	0	0	0	0	0	111.5	A478 H479 L484 I485 N486	A478-A482 PolarHBondContact O-N 3.31Å; H479-A482 WeakPolarHBondContact O-CB 3.28Å; H479-A482 PolarHBondContact O-N 2.82Å; A482-L484 PolarHBondContact O-N 2.95Å; A482-L484 VanDerWaalsContact O-N 3.15Å; A482-I485 VanDerWaalsContact O-CB 3.31Å; A482-I485 WeakPolarHBondContact O-CB 3.37Å; A482-I485 PolarHBondContact O-N 3.41Å; A482-N486 PolarHBondContact O-N 2.87Å; A482-N486 PolarHBondContact O-OD1 3.22Å
483	A	95.4	Very high	91.7	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.033	12%	0.119	C	C	.	.	H	α-helix	trans	-58.7	-30.3	175.8	0	0	0	0	0	113.4	C438 L464 H479 F487	C438-A483 VanDerWaalsContact O-CB 3.27Å; C438-A483 WeakPolarHBondContact O-CB 3.5Å; L464-A483 HydrophobicContact CD1-CB 4.15Å; L464-A483 HydrophobicContact CD2-CB 3.98Å; H479-A483 PolarHBondContact O-N 2.92Å; A483-F487 PolarHBondContact O-N 3.19Å; A483-F487 VanDerWaalsContact O-N 3.12Å
484	L	95.1	Very high	92	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-71.6	-32.5	175.8	-172.1	59.8	0	0	0	112.2	L464 L465 M468 A480 A481 A482 F487 T488 L503 L507	L464-L484 HydrophobicContact CD1-CB 4.15Å; L464-L484 HydrophobicContact CD1-CD1 4.2Å; L465-L484 HydrophobicContact CD2-CD2 4.29Å; M468-L484 HydrophobicContact CE-CD2 4.42Å; M468-L484 HydrophobicContact SD-CD2 3.76Å; A480-L484 PolarHBondContact O-N 3.15Å; A480-L484 VanDerWaalsContact O-N 3.11Å; A481-L484 WeakPolarHBondContact O-CB 3.33Å; A481-L484 PolarHBondContact O-N 3.04Å; A482-L484 PolarHBondContact O-N 2.95Å; A482-L484 VanDerWaalsContact O-N 3.15Å; L484-F487 PolarHBondContact O-N 3.07Å; L484-T488 HydrophobicContact CD1-CG2 4.36Å; L484-T488 WeakPolarHBondContact O-CG2 3.26Å; L484-T488 PolarHBondContact O-N 2.95Å; L484-T488 PolarHBondContact O-OG1 3.48Å; L484-L503 HydrophobicContact CD1-CD1 4.43Å; L484-L503 HydrophobicContact CD2-CD1 3.86Å; L484-L507 HydrophobicContact CD2-CD2 4.47Å
485	I	94.7	Very high	92.3	Very high	14 Å²	14	26.6 Å²	26.6	7%	0.072	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-55.7	173.7	-66.7	159.6	0	0	0	109.4	A481 A482 F487 T488 E489 T532	A481-I485 WeakPolarHBondContact O-CG1 3.26Å; A481-I485 PolarHBondContact O-N 3.2Å; A481-I485 VanDerWaalsContact O-N 3.16Å; A482-I485 VanDerWaalsContact O-CB 3.31Å; A482-I485 WeakPolarHBondContact O-CB 3.37Å; A482-I485 PolarHBondContact O-N 3.41Å; I485-F487 PolarHBondContact O-N 3.44Å; I485-T488 PolarHBondContact O-N 3.34Å; I485-T488 PolarHBondContact O-OG1 3.03Å; I485-E489 HydrophobicContact CG2-CG 4.11Å; I485-E489 WeakPolarHBondContact O-CG 3.28Å; I485-E489 PolarHBondContact O-N 3.49Å; I485-T532 HydrophobicContact CD1-CG2 3.65Å; I485-T532 HydrophobicContact CG1-CG2 4.45Å
486	N	95	Very high	92.6	Very high	47 Å²	47	26.3 Å²	26.3	25%	0.251	15%	0.146	S	C	.	.	H	α-helix	trans	-52.5	-41.2	175.7	-68.2	59.1	0	0	0	111.6	A445 T446 A482 T488	A445-N486 HydrophobicContact CB-CB 4.46Å; T446-N486 PolarHBondContact OG1-ND2 3.22Å; A482-N486 PolarHBondContact O-N 2.87Å; A482-N486 PolarHBondContact O-OD1 3.22Å; N486-T488 PolarHBondContact O-N 3.18Å
487	F	96.5	Very high	92.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-43.2	176.4	-170.8	-83.1	0	0	0	113	A445 F452 Q453 H457 V460 I461 A483 L484 I485 C491	A445-F487 HydrophobicContact CB-CB 4.14Å; A445-F487 HydrophobicContact CB-CD2 4.1Å; F452-F487 AromaticContact CD1-CD2 3.93Å; F452-F487 HydrophobicContact CD1-CD2 3.93Å; F452-F487 AromaticContact CD1-CE2 3.73Å; F452-F487 HydrophobicContact CD1-CE2 3.73Å; F452-F487 AromaticContact CE1-CD2 3.8Å; F452-F487 HydrophobicContact CE1-CD2 3.8Å; F452-F487 AromaticContact CE1-CE2 3.79Å; F452-F487 HydrophobicContact CE1-CE2 3.79Å; Q453-F487 HydrophobicContact CB-CE1 4.35Å; Q453-F487 HydrophobicContact CB-CE2 4.28Å; Q453-F487 HydrophobicContact CB-CZ 3.87Å; Q453-F487 HydrophobicContact CG-CD1 4.36Å; Q453-F487 HydrophobicContact CG-CD2 4.2Å; Q453-F487 HydrophobicContact CG-CE1 4.01Å; Q453-F487 HydrophobicContact CG-CE2 3.88Å; Q453-F487 HydrophobicContact CG-CG 4.43Å; Q453-F487 HydrophobicContact CG-CZ 3.75Å; Q453-F487 WeakPolarHBondContact CG-O 3.28Å; H457-F487 HydrophobicContact CB-CE1 4.37Å; H457-F487 HydrophobicContact CB-CZ 3.84Å; V460-F487 HydrophobicContact CB-CD2 4.37Å; V460-F487 HydrophobicContact CB-CE2 4.09Å; V460-F487 HydrophobicContact CG1-CD2 3.69Å; V460-F487 HydrophobicContact CG1-CE2 3.92Å; V460-F487 HydrophobicContact CG1-CG 4.41Å; I461-F487 HydrophobicContact CD1-CD1 4.48Å; I461-F487 HydrophobicContact CD1-CE1 3.89Å; I461-F487 HydrophobicContact CG1-CD1 4.21Å; I461-F487 HydrophobicContact CG1-CE1 3.91Å; I461-F487 HydrophobicContact CG1-CZ 4.41Å; A483-F487 PolarHBondContact O-N 3.19Å; A483-F487 VanDerWaalsContact O-N 3.12Å; L484-F487 PolarHBondContact O-N 3.07Å; I485-F487 PolarHBondContact O-N 3.44Å; F487-C491 VanDerWaalsContact O-CB 3.29Å; F487-C491 WeakPolarHBondContact O-CB 3.19Å; F487-C491 PolarHBondContact O-N 3.2Å
488	T	95	Very high	92.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-84.5	-27.4	-172.9	52.2	0	0	0	0	114.6	L484 I485 N486 C491 L496 L503 S536 V537 T540	L484-T488 HydrophobicContact CD1-CG2 4.36Å; L484-T488 WeakPolarHBondContact O-CG2 3.26Å; L484-T488 PolarHBondContact O-N 2.95Å; L484-T488 PolarHBondContact O-OG1 3.48Å; I485-T488 PolarHBondContact O-N 3.34Å; I485-T488 PolarHBondContact O-OG1 3.03Å; N486-T488 PolarHBondContact O-N 3.18Å; T488-C491 PolarHBondContact O-N 2.96Å; T488-L496 HydrophobicContact CG2-CD1 4.09Å; T488-L503 HydrophobicContact CG2-CD2 4.38Å; T488-S536 PolarHBondContact OG1-OG 2.74Å; T488-V537 HydrophobicContact CG2-CG2 3.89Å; T488-T540 PolarHBondContact O-OG1 3.04Å
489	E	91.6	Very high	92.7	Very high	124 Å²	124	36.4 Å²	36.4	58%	0.579	20%	0.2	S	C	*	.	H	α-helix	trans	-61.1	-48.2	174.2	-74.1	-169.7	150	0	0	111.1	I485 C491 S536	I485-E489 HydrophobicContact CG2-CG 4.11Å; I485-E489 WeakPolarHBondContact O-CG 3.28Å; I485-E489 PolarHBondContact O-N 3.49Å; E489-C491 VanDerWaalsContact C-N 3.32Å; E489-C491 PolarHBondContact O-N 3.19Å; E489-S536 VanDerWaalsContact CG-OG 3.3Å; E489-S536 WeakPolarHBondContact CG-OG 3.47Å; E489-S536 PolarHBondContact N-OG 3.22Å
490	D	91.7	Very high	92.7	Very high	69 Å²	69	35 Å²	35	37%	0.369	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	7.6	-179.8	-69.4	-50.5	0	0	0	113.9	A449 P492	A449-D490 HydrophobicContact CB-CB 3.63Å; D490-P492 WeakPolarHBondContact O-CD 3.4Å
491	C	94.3	Very high	92.6	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.047	21%	0.211	C	C	.	.	S	Bend	trans	-82.2	122	178.5	-171	0	0	0	0	111.1	Q453 F487 T488 E489 K493 T540	Q453-C491 HydrophobicContact CB-CB 4.43Å; Q453-C491 HydrophobicContact CG-CB 4Å; F487-C491 VanDerWaalsContact O-CB 3.29Å; F487-C491 WeakPolarHBondContact O-CB 3.19Å; F487-C491 PolarHBondContact O-N 3.2Å; T488-C491 PolarHBondContact O-N 2.96Å; E489-C491 VanDerWaalsContact C-N 3.32Å; E489-C491 PolarHBondContact O-N 3.19Å; C491-K493 PolarHBondContact O-N 3.36Å; C491-T540 WeakPolarHBondContact O-CG2 3.39Å
492	P	92.5	Very high	92.5	Very high	37 Å²	37	42.1 Å²	42.1	24%	0.24	23%	0.232	C	C	.	.			trans	-54.9	127.3	170	-24.6	32.8	0	0	0	110.9	P450 D490 S494 L495 L496	P450-P492 HydrophobicContact CB-CG 4.04Å; D490-P492 WeakPolarHBondContact O-CD 3.4Å; P492-S494 PolarHBondContact O-N 2.95Å; P492-L495 HydrophobicContact CB-CD1 4.15Å; P492-L495 HydrophobicContact CB-CG 4.39Å; P492-L495 HydrophobicContact CG-CD1 3.93Å; P492-L495 WeakPolarHBondContact O-CB 3.49Å; P492-L495 PolarHBondContact O-N 2.96Å; P492-L496 PolarHBondContact O-N 3.16Å
493	K	92.1	Very high	92.4	Very high	51 Å²	51	41.2 Å²	41.2	22%	0.222	22%	0.224	C	C	.	.	H	α-helix	trans	-44.6	-41.4	178.6	177.2	177.5	178.7	-170.5	0	113.7	C491 L495 L496 I497 T540 A541 E542 E543	C491-K493 PolarHBondContact O-N 3.36Å; K493-L495 PolarHBondContact O-N 3.05Å; K493-L496 PolarHBondContact O-N 3.12Å; K493-I497 HydrophobicContact CG-CD1 3.97Å; K493-I497 HydrophobicContact CG-CG1 4.37Å; K493-I497 WeakPolarHBondContact O-CD1 3.43Å; K493-I497 VanDerWaalsContact O-CG1 3.24Å; K493-I497 WeakPolarHBondContact O-CG1 3.2Å; K493-I497 PolarHBondContact O-N 3.29Å; K493-T540 WeakPolarHBondContact CB-O 3.39Å; K493-T540 VanDerWaalsContact CG-O 3.27Å; K493-T540 WeakPolarHBondContact CG-O 3.32Å; K493-A541 VanDerWaalsContact CE-O 3.32Å; K493-A541 WeakPolarHBondContact CE-O 3.07Å; K493-E542 HydrophobicContact CD-CG 4.49Å; K493-E542 WeakPolarHBondContact CD-OE2 3.49Å; K493-E542 WeakPolarHBondContact CE-OE2 3.47Å; K493-E542 IonicContact NZ-OE2 3.54Å; K493-E542 PolarHBondContact NZ-OE2 3.04Å; K493-E543 IonicContact NZ-OE1 2.79Å; K493-E543 PolarHBondContact NZ-OE1 2.99Å; K493-E543 IonicContact NZ-OE2 3.25Å; K493-E543 PolarHBondContact NZ-OE2 3.32Å
494	S	90.7	Very high	92.3	Very high	90 Å²	90	41.1 Å²	41.1	63%	0.629	22%	0.223	S	C	*	.	H	α-helix	trans	-59.2	-29.2	178.8	56.5	0	0	0	0	114.1	P492	P492-S494 PolarHBondContact O-N 2.95Å
495	L	90.9	Very high	92.1	Very high	45 Å²	45	46.2 Å²	46.2	24%	0.236	25%	0.245	C	C	.	.	H	α-helix	trans	-89.2	-27.4	178.4	-64.7	172.1	0	0	0	113.2	K454 P492 K493 P498	K454-L495 HydrophobicContact CB-CD1 4.25Å; K454-L495 HydrophobicContact CG-CD1 3.47Å; K454-L495 VanDerWaalsContact CG-CD1 3.47Å; P492-L495 HydrophobicContact CB-CD1 4.15Å; P492-L495 HydrophobicContact CB-CG 4.39Å; P492-L495 HydrophobicContact CG-CD1 3.93Å; P492-L495 WeakPolarHBondContact O-CB 3.49Å; P492-L495 PolarHBondContact O-N 2.96Å; K493-L495 PolarHBondContact O-N 3.05Å; L495-P498 WeakPolarHBondContact O-CD 3.41Å
496	L	91.4	Very high	91.8	Very high	2 Å²	2	48 Å²	48	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-74.4	-39.3	178.7	-174.1	63.2	0	0	0	112.2	T488 P492 K493 P498 Y499 L500 L503 T540	T488-L496 HydrophobicContact CG2-CD1 4.09Å; P492-L496 PolarHBondContact O-N 3.16Å; K493-L496 PolarHBondContact O-N 3.12Å; L496-P498 VanDerWaalsContact C-CD 3.45Å; L496-Y499 PolarHBondContact O-N 2.9Å; L496-L500 PolarHBondContact O-N 3.28Å; L496-L503 HydrophobicContact CD1-CD2 3.88Å; L496-T540 HydrophobicContact CD2-CG2 3.64Å
497	I	92.2	Very high	91.6	Very high	66 Å²	66	45.8 Å²	45.8	34%	0.338	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-49.2	-45.7	-174	-71.1	163.2	0	0	0	114.2	K493 Y499 L500 K544	K493-I497 HydrophobicContact CG-CD1 3.97Å; K493-I497 HydrophobicContact CG-CG1 4.37Å; K493-I497 WeakPolarHBondContact O-CD1 3.43Å; K493-I497 VanDerWaalsContact O-CG1 3.24Å; K493-I497 WeakPolarHBondContact O-CG1 3.2Å; K493-I497 PolarHBondContact O-N 3.29Å; I497-Y499 PolarHBondContact O-N 2.9Å; I497-L500 WeakPolarHBondContact O-CB 3.25Å; I497-L500 PolarHBondContact O-N 2.94Å; I497-K544 HydrophobicContact CD1-CG 3.81Å; I497-K544 HydrophobicContact CG1-CB 4.36Å; I497-K544 HydrophobicContact CG1-CG 3.94Å
498	P	91.4	Very high	91.5	Very high	97 Å²	97	47.7 Å²	47.7	63%	0.63	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-60.5	-26.3	179.8	-24.7	35.5	0	0	0	114.6	L495 L496	L495-P498 WeakPolarHBondContact O-CD 3.41Å; L496-P498 VanDerWaalsContact C-CD 3.45Å
499	Y	88.6	Confident	91.3	Very high	58 Å²	58	50.8 Å²	50.8	23%	0.227	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-97.2	-11.9	-178.2	-64.1	-81.2	0	0	0	113.1	H457 I461 L496 I497 D501 N502 L503	H457-Y499 AromaticContact CE1-CE2 3.64Å; H457-Y499 AromaticContact CE1-CZ 3.65Å; H457-Y499 PolarHBondContact CE1-OH 3.31Å; H457-Y499 AromaticContact ND1-CE2 3.1Å; H457-Y499 WeakPolarHBondContact ND1-CE2 3.45Å; H457-Y499 AromaticContact ND1-CZ 3.17Å; H457-Y499 PolarHBondContact ND1-OH 3.32Å; I461-Y499 HydrophobicContact CD1-CD2 4.4Å; I461-Y499 HydrophobicContact CD1-CG 4.17Å; L496-Y499 PolarHBondContact O-N 2.9Å; I497-Y499 PolarHBondContact O-N 2.9Å; Y499-D501 VanDerWaalsContact C-N 3.35Å; Y499-D501 PolarHBondContact O-N 3.28Å; Y499-N502 PolarHBondContact O-N 3.06Å; Y499-L503 WeakPolarHBondContact O-CB 3.29Å; Y499-L503 PolarHBondContact O-N 2.95Å
500	L	90.8	Very high	91.2	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-55.1	-45.6	-168	-173.2	60.5	0	0	0	112.9	L496 I497 N502 L503 V504 V537 A541 K544 F545 Y548	L496-L500 PolarHBondContact O-N 3.28Å; I497-L500 WeakPolarHBondContact O-CB 3.25Å; I497-L500 PolarHBondContact O-N 2.94Å; L500-N502 PolarHBondContact O-N 3.37Å; L500-L503 PolarHBondContact O-N 3.33Å; L500-V504 HydrophobicContact CD1-CG2 3.95Å; L500-V504 HydrophobicContact CG-CG2 4.33Å; L500-V504 WeakPolarHBondContact O-CB 3.35Å; L500-V504 VanDerWaalsContact O-CG2 3.23Å; L500-V504 WeakPolarHBondContact O-CG2 3.37Å; L500-V504 PolarHBondContact O-N 3.31Å; L500-V537 HydrophobicContact CD1-CG1 3.46Å; L500-V537 VanDerWaalsContact CD1-CG1 3.46Å; L500-A541 HydrophobicContact CD1-CB 4.01Å; L500-A541 HydrophobicContact CD2-CB 3.85Å; L500-K544 HydrophobicContact CD2-CB 3.99Å; L500-F545 HydrophobicContact CD1-CD2 4.4Å; L500-Y548 HydrophobicContact CD2-CD2 4.29Å; L500-Y548 HydrophobicContact CD2-CE2 3.6Å; L500-Y548 HydrophobicContact CG-CD2 4.31Å; L500-Y548 HydrophobicContact CG-CE2 3.63Å
501	D	92	Very high	91.2	Very high	70 Å²	70	42.2 Å²	42.2	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-42.1	179.5	178.1	71	0	0	0	112.5	Y499 K505 Y548	Y499-D501 VanDerWaalsContact C-N 3.35Å; Y499-D501 PolarHBondContact O-N 3.28Å; D501-K505 WeakPolarHBondContact O-CB 3.42Å; D501-K505 WeakPolarHBondContact O-CD 3.28Å; D501-K505 WeakPolarHBondContact O-CG 3.35Å; D501-K505 PolarHBondContact O-N 3.3Å; D501-K505 VanDerWaalsContact O-N 3.16Å; D501-K505 WeakPolarHBondContact OD1-CE 3.45Å; D501-K505 IonicContact OD1-NZ 2.88Å; D501-K505 PolarHBondContact OD1-NZ 3.21Å; D501-K505 VanDerWaalsContact OD1-NZ 3.09Å; D501-K505 WeakPolarHBondContact OD2-CE 3.28Å; D501-K505 IonicContact OD2-NZ 3.53Å; D501-K505 PolarHBondContact OD2-NZ 3.48Å; D501-Y548 WeakPolarHBondContact CA-OH 3.42Å; D501-Y548 HydrophobicContact CB-CE1 4.46Å; D501-Y548 WeakPolarHBondContact CB-OH 3.46Å; D501-Y548 PolarHBondContact N-OH 3.13Å
502	N	88.8	Confident	91.1	Very high	81 Å²	81	44.1 Å²	44.1	43%	0.433	24%	0.242	S	C	.	.	H	α-helix	trans	-68.8	-49.2	178.5	-168.8	65.7	0	0	0	110.7	Y499 L500 V504 K505 H506	Y499-N502 PolarHBondContact O-N 3.06Å; L500-N502 PolarHBondContact O-N 3.37Å; N502-V504 PolarHBondContact O-N 3.43Å; N502-K505 PolarHBondContact O-N 2.92Å; N502-H506 PolarHBondContact O-CD2 3.45Å; N502-H506 PolarHBondContact O-N 3.16Å; N502-H506 VanDerWaalsContact O-N 3.09Å
503	L	89.5	Confident	90.9	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-56.6	-50.1	-179.9	-177	58.2	0	0	0	111.6	I461 L465 L484 T488 L496 Y499 L500 K505 H506 L507 V537	I461-L503 HydrophobicContact CG2-CD1 4.45Å; L465-L503 HydrophobicContact CD1-CD1 4.24Å; L465-L503 HydrophobicContact CD2-CD1 3.98Å; L465-L503 HydrophobicContact CG-CD1 4.39Å; L484-L503 HydrophobicContact CD1-CD1 4.43Å; L484-L503 HydrophobicContact CD2-CD1 3.86Å; T488-L503 HydrophobicContact CG2-CD2 4.38Å; L496-L503 HydrophobicContact CD1-CD2 3.88Å; Y499-L503 WeakPolarHBondContact O-CB 3.29Å; Y499-L503 PolarHBondContact O-N 2.95Å; L500-L503 PolarHBondContact O-N 3.33Å; L503-K505 PolarHBondContact O-N 3.44Å; L503-H506 PolarHBondContact O-N 2.89Å; L503-L507 HydrophobicContact CD1-CD1 4.14Å; L503-L507 HydrophobicContact CD1-CG 4.41Å; L503-L507 HydrophobicContact CG-CD1 4.07Å; L503-L507 WeakPolarHBondContact O-CB 3.44Å; L503-L507 WeakPolarHBondContact O-CG 3.23Å; L503-L507 PolarHBondContact O-N 2.95Å; L503-V537 HydrophobicContact CD2-CB 4.45Å; L503-V537 HydrophobicContact CD2-CG1 4.01Å; L503-V537 HydrophobicContact CD2-CG2 3.49Å; L503-V537 VanDerWaalsContact CD2-CG2 3.49Å; L503-V537 HydrophobicContact CG-CG2 4.16Å
504	V	92.6	Very high	90.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-44.3	177.2	159.2	0	0	0	0	111.9	L500 N502 H506 L507 H508 V537 F545 Y548 L551 F552	L500-V504 HydrophobicContact CD1-CG2 3.95Å; L500-V504 HydrophobicContact CG-CG2 4.33Å; L500-V504 WeakPolarHBondContact O-CB 3.35Å; L500-V504 VanDerWaalsContact O-CG2 3.23Å; L500-V504 WeakPolarHBondContact O-CG2 3.37Å; L500-V504 PolarHBondContact O-N 3.31Å; N502-V504 PolarHBondContact O-N 3.43Å; V504-H506 PolarHBondContact O-N 3.44Å; V504-L507 PolarHBondContact O-N 3.23Å; V504-H508 VanDerWaalsContact O-CB 3.29Å; V504-H508 WeakPolarHBondContact O-CB 3.26Å; V504-H508 PolarHBondContact O-N 3.3Å; V504-V537 HydrophobicContact CG2-CG1 4.47Å; V504-F545 HydrophobicContact CG2-CE2 3.84Å; V504-Y548 HydrophobicContact CB-CD1 4.16Å; V504-Y548 HydrophobicContact CB-CE1 4.43Å; V504-Y548 HydrophobicContact CB-CG 4.35Å; V504-Y548 HydrophobicContact CG1-CD1 3.48Å; V504-Y548 VanDerWaalsContact CG1-CD1 3.48Å; V504-Y548 HydrophobicContact CG1-CE1 4.13Å; V504-Y548 HydrophobicContact CG1-CG 3.76Å; V504-Y548 HydrophobicContact CG2-CD1 4.39Å; V504-Y548 HydrophobicContact CG2-CD2 4.19Å; V504-Y548 HydrophobicContact CG2-CG 4.09Å; V504-L551 HydrophobicContact CG1-CD2 3.75Å; V504-F552 HydrophobicContact CB-CE2 4.33Å; V504-F552 HydrophobicContact CB-CZ 4.39Å; V504-F552 HydrophobicContact CG1-CE2 3.47Å; V504-F552 VanDerWaalsContact CG1-CE2 3.47Å; V504-F552 HydrophobicContact CG1-CZ 3.72Å; V504-F552 HydrophobicContact CG2-CE2 4.28Å
505	K	90.8	Very high	90.8	Very high	107 Å²	107	40.9 Å²	40.9	47%	0.465	22%	0.216	S	C	.	.	H	α-helix	trans	-62.2	-42.2	179.5	-78.4	169.9	-177.9	166.1	0	112.4	D501 N502 L503 S509	D501-K505 WeakPolarHBondContact O-CB 3.42Å; D501-K505 WeakPolarHBondContact O-CD 3.28Å; D501-K505 WeakPolarHBondContact O-CG 3.35Å; D501-K505 PolarHBondContact O-N 3.3Å; D501-K505 VanDerWaalsContact O-N 3.16Å; D501-K505 WeakPolarHBondContact OD1-CE 3.45Å; D501-K505 IonicContact OD1-NZ 2.88Å; D501-K505 PolarHBondContact OD1-NZ 3.21Å; D501-K505 VanDerWaalsContact OD1-NZ 3.09Å; D501-K505 WeakPolarHBondContact OD2-CE 3.28Å; D501-K505 IonicContact OD2-NZ 3.53Å; D501-K505 PolarHBondContact OD2-NZ 3.48Å; N502-K505 PolarHBondContact O-N 2.92Å; L503-K505 PolarHBondContact O-N 3.44Å; K505-S509 WeakPolarHBondContact O-CB 3.32Å; K505-S509 PolarHBondContact O-N 3.45Å; K505-S509 VanDerWaalsContact O-N 3.09Å; K505-S509 PolarHBondContact O-OG 3.07Å
506	H	89	Confident	90.6	Very high	51 Å²	51	43.4 Å²	43.4	24%	0.236	23%	0.227	C	C	.	.	H	α-helix	trans	-67	-49.8	176.8	-77.1	-78.9	0	0	0	111.3	L465 E469 N502 L503 V504 H508 S509 I510	L465-H506 HydrophobicContact CD1-CB 4.37Å; L465-H506 HydrophobicContact CD2-CB 3.8Å; E469-H506 IonicContact OE1-CE1 3.35Å; E469-H506 PolarHBondContact OE1-CE1 2.78Å; E469-H506 IonicContact OE1-CG 3.91Å; E469-H506 IonicContact OE1-ND1 3.76Å; E469-H506 PolarHBondContact OE1-ND1 3.38Å; N502-H506 PolarHBondContact O-CD2 3.45Å; N502-H506 PolarHBondContact O-N 3.16Å; N502-H506 VanDerWaalsContact O-N 3.09Å; L503-H506 PolarHBondContact O-N 2.89Å; V504-H506 PolarHBondContact O-N 3.44Å; H506-H508 VanDerWaalsContact C-N 3.32Å; H506-H508 PolarHBondContact O-N 3.45Å; H506-S509 WeakPolarHBondContact O-CB 3.49Å; H506-S509 PolarHBondContact O-N 3.25Å; H506-S509 VanDerWaalsContact O-N 3.09Å; H506-I510 WeakPolarHBondContact O-CG1 3.39Å; H506-I510 PolarHBondContact O-N 2.97Å
507	L	91.7	Very high	90.5	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-42.4	177.9	-72.3	174.1	0	0	0	112.4	M468 L484 L503 V504 S509 I510 M511 V530 I534 V537	M468-L507 HydrophobicContact CE-CD2 3.64Å; L484-L507 HydrophobicContact CD2-CD2 4.47Å; L503-L507 HydrophobicContact CD1-CD1 4.14Å; L503-L507 HydrophobicContact CD1-CG 4.41Å; L503-L507 HydrophobicContact CG-CD1 4.07Å; L503-L507 WeakPolarHBondContact O-CB 3.44Å; L503-L507 WeakPolarHBondContact O-CG 3.23Å; L503-L507 PolarHBondContact O-N 2.95Å; V504-L507 PolarHBondContact O-N 3.23Å; L507-S509 PolarHBondContact O-N 3.26Å; L507-I510 PolarHBondContact O-N 2.89Å; L507-M511 VanDerWaalsContact O-CB 3.28Å; L507-M511 WeakPolarHBondContact O-CB 3.4Å; L507-M511 PolarHBondContact O-N 3.39Å; L507-V530 HydrophobicContact CD2-CG1 4.4Å; L507-I534 HydrophobicContact CB-CD1 4.39Å; L507-I534 HydrophobicContact CB-CG1 3.85Å; L507-I534 HydrophobicContact CD1-CG1 4.04Å; L507-I534 HydrophobicContact CG-CG1 4.4Å; L507-V537 HydrophobicContact CD1-CG2 4.15Å
508	H	92.9	Very high	90.3	Very high	40 Å²	40	43.3 Å²	43.3	19%	0.185	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-45.1	175	179	73	0	0	0	112	V504 H506 I510 M511 V512 L551 F552	V504-H508 VanDerWaalsContact O-CB 3.29Å; V504-H508 WeakPolarHBondContact O-CB 3.26Å; V504-H508 PolarHBondContact O-N 3.3Å; H506-H508 VanDerWaalsContact C-N 3.32Å; H506-H508 PolarHBondContact O-N 3.45Å; H508-I510 VanDerWaalsContact C-N 3.34Å; H508-I510 PolarHBondContact O-N 2.66Å; H508-M511 PolarHBondContact O-N 3.49Å; H508-V512 WeakPolarHBondContact O-CG2 3.3Å; H508-V512 PolarHBondContact O-N 3.44Å; H508-L551 HydrophobicContact CB-CD2 3.82Å; H508-L551 HydrophobicContact CB-CG 4.17Å; H508-L551 PolarHBondContact CE1-O 3.1Å; H508-L551 WeakPolarHBondContact ND1-CG 3.21Å; H508-L551 PolarHBondContact ND1-O 2.96Å; H508-F552 HydrophobicContact CB-CD1 4.47Å; H508-F552 HydrophobicContact CB-CE1 3.63Å; H508-F552 HydrophobicContact CB-CZ 3.85Å
509	S	90.9	Very high	90	Very high	65 Å²	65	44.1 Å²	44.1	46%	0.455	22%	0.223	S	C	.	.	H	α-helix	trans	-61.5	-44.3	-179.8	-59	0	0	0	0	111.3	K505 H506 L507 L513	K505-S509 WeakPolarHBondContact O-CB 3.32Å; K505-S509 PolarHBondContact O-N 3.45Å; K505-S509 VanDerWaalsContact O-N 3.09Å; K505-S509 PolarHBondContact O-OG 3.07Å; H506-S509 WeakPolarHBondContact O-CB 3.49Å; H506-S509 PolarHBondContact O-N 3.25Å; H506-S509 VanDerWaalsContact O-N 3.09Å; L507-S509 PolarHBondContact O-N 3.26Å; S509-L513 WeakPolarHBondContact O-CG 3.47Å; S509-L513 PolarHBondContact O-N 2.93Å
510	I	89.6	Confident	89.8	Confident	13 Å²	13	48.3 Å²	48.3	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-46.2	177.7	-62.8	168.2	0	0	0	110.5	M468 H506 L507 H508 V512 L513 K514 V530	M468-I510 HydrophobicContact CB-CD1 3.79Å; M468-I510 HydrophobicContact CE-CD1 3.93Å; H506-I510 WeakPolarHBondContact O-CG1 3.39Å; H506-I510 PolarHBondContact O-N 2.97Å; L507-I510 PolarHBondContact O-N 2.89Å; H508-I510 VanDerWaalsContact C-N 3.34Å; H508-I510 PolarHBondContact O-N 2.66Å; I510-V512 VanDerWaalsContact C-N 3.33Å; I510-V512 PolarHBondContact O-N 2.75Å; I510-L513 PolarHBondContact O-N 2.88Å; I510-K514 HydrophobicContact CG2-CG 4.02Å; I510-K514 WeakPolarHBondContact O-CB 3.19Å; I510-K514 WeakPolarHBondContact O-CG 3.32Å; I510-K514 PolarHBondContact O-N 3.43Å; I510-V530 HydrophobicContact CG2-CG1 4.47Å; I510-V530 HydrophobicContact CG2-CG2 3.67Å
511	M	92.6	Very high	89.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-56.3	-46.2	178.5	-176.3	-169.2	66.9	0	0	111.6	L507 H508 L513 K514 L515 L527 V530 I534 F552 L556	L507-M511 VanDerWaalsContact O-CB 3.28Å; L507-M511 WeakPolarHBondContact O-CB 3.4Å; L507-M511 PolarHBondContact O-N 3.39Å; H508-M511 PolarHBondContact O-N 3.49Å; M511-L513 PolarHBondContact O-N 2.87Å; M511-K514 PolarHBondContact O-N 3.34Å; M511-L515 VanDerWaalsContact O-CB 3.23Å; M511-L515 WeakPolarHBondContact O-CB 3.39Å; M511-L515 PolarHBondContact O-N 3.09Å; M511-L527 HydrophobicContact CG-CD1 3.98Å; M511-V530 HydrophobicContact CB-CG1 3.92Å; M511-I534 HydrophobicContact CB-CD1 4.24Å; M511-I534 HydrophobicContact CG-CD1 4.36Å; M511-I534 HydrophobicContact SD-CD1 3.78Å; M511-F552 HydrophobicContact CE-CD1 3.68Å; M511-F552 HydrophobicContact CE-CE1 4.32Å; M511-F552 HydrophobicContact SD-CD1 3.95Å; M511-L556 HydrophobicContact SD-CD2 4.15Å
512	V	91.3	Very high	89	Confident	48 Å²	48	54.4 Å²	54.4	29%	0.291	28%	0.279	S	S	.	.	H	α-helix	trans	-64	-41.4	179.4	171.5	0	0	0	0	111.6	H508 I510 Q516	H508-V512 WeakPolarHBondContact O-CG2 3.3Å; H508-V512 PolarHBondContact O-N 3.44Å; I510-V512 VanDerWaalsContact C-N 3.33Å; I510-V512 PolarHBondContact O-N 2.75Å; V512-Q516 WeakPolarHBondContact O-CG 3.2Å; V512-Q516 PolarHBondContact O-N 3.18Å
513	L	89.4	Confident	88.9	Confident	75 Å²	75	51.6 Å²	51.6	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-65.3	-48.1	176.9	-71.4	171.2	0	0	0	111.5	S509 I510 M511 L515 Q516 E517	S509-L513 WeakPolarHBondContact O-CG 3.47Å; S509-L513 PolarHBondContact O-N 2.93Å; I510-L513 PolarHBondContact O-N 2.88Å; M511-L513 PolarHBondContact O-N 2.87Å; L513-L515 VanDerWaalsContact C-N 3.32Å; L513-L515 PolarHBondContact O-N 3.22Å; L513-Q516 WeakPolarHBondContact O-CB 3.16Å; L513-Q516 PolarHBondContact O-N 3.34Å; L513-Q516 VanDerWaalsContact O-N 3.08Å; L513-E517 PolarHBondContact O-N 2.87Å
514	K	89.7	Confident	88.8	Confident	14 Å²	14	52.5 Å²	52.5	6%	0.061	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-31	-179.6	-64.7	-50.2	-175.9	-172.4	0	113.1	I510 M511 Q516 E517 L518 V526 L527	I510-K514 HydrophobicContact CG2-CG 4.02Å; I510-K514 WeakPolarHBondContact O-CB 3.19Å; I510-K514 WeakPolarHBondContact O-CG 3.32Å; I510-K514 PolarHBondContact O-N 3.43Å; M511-K514 PolarHBondContact O-N 3.34Å; K514-Q516 VanDerWaalsContact C-N 3.33Å; K514-Q516 PolarHBondContact O-N 3.11Å; K514-E517 WeakPolarHBondContact CD-OE2 3.4Å; K514-E517 IonicContact NZ-OE1 3.62Å; K514-E517 PolarHBondContact NZ-OE1 3.09Å; K514-E517 IonicContact NZ-OE2 2.77Å; K514-E517 PolarHBondContact NZ-OE2 3.46Å; K514-E517 PolarHBondContact O-N 3.36Å; K514-L518 WeakPolarHBondContact O-CB 3.5Å; K514-L518 PolarHBondContact O-N 3.48Å; K514-V526 HydrophobicContact CD-CB 4.28Å; K514-V526 HydrophobicContact CD-CG1 4.36Å; K514-V526 HydrophobicContact CG-CB 4.26Å; K514-V526 HydrophobicContact CG-CG1 4.07Å; K514-L527 HydrophobicContact CB-CB 4.03Å; K514-L527 HydrophobicContact CB-CD1 4.04Å
515	L	89.8	Confident	88.6	Confident	20 Å²	20	52.8 Å²	52.8	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-38.2	169.7	-178.5	55.9	0	0	0	112.3	M511 L513 L518 I519 I559	M511-L515 VanDerWaalsContact O-CB 3.23Å; M511-L515 WeakPolarHBondContact O-CB 3.39Å; M511-L515 PolarHBondContact O-N 3.09Å; L513-L515 VanDerWaalsContact C-N 3.32Å; L513-L515 PolarHBondContact O-N 3.22Å; L515-L518 HydrophobicContact CD1-CD2 4.3Å; L515-I519 HydrophobicContact CD1-CD1 4.45Å; L515-I519 HydrophobicContact CG-CD1 4.39Å; L515-I519 WeakPolarHBondContact O-CG1 3.33Å; L515-I519 PolarHBondContact O-N 3.19Å; L515-I519 VanDerWaalsContact O-N 3.15Å; L515-I559 HydrophobicContact CD1-CD1 4.36Å; L515-I559 HydrophobicContact CD1-CG1 3.66Å; L515-I559 HydrophobicContact CD2-CG1 4.25Å
516	Q	88.2	Confident	88.4	Confident	98 Å²	98	48.1 Å²	48.1	46%	0.458	25%	0.251	S	S	.	.	H	α-helix	trans	-67.4	-39.3	174.2	-67.5	172.6	13	0	0	111.9	V512 L513 K514 I519 Q520	V512-Q516 WeakPolarHBondContact O-CG 3.2Å; V512-Q516 PolarHBondContact O-N 3.18Å; L513-Q516 WeakPolarHBondContact O-CB 3.16Å; L513-Q516 PolarHBondContact O-N 3.34Å; L513-Q516 VanDerWaalsContact O-N 3.08Å; K514-Q516 VanDerWaalsContact C-N 3.33Å; K514-Q516 PolarHBondContact O-N 3.11Å; Q516-I519 PolarHBondContact O-N 3.46Å; Q516-Q520 WeakPolarHBondContact O-CB 3.29Å; Q516-Q520 VanDerWaalsContact O-CG 3.26Å; Q516-Q520 WeakPolarHBondContact O-CG 3.45Å; Q516-Q520 PolarHBondContact O-N 3.42Å
517	E	87.8	Confident	88.6	Confident	44 Å²	44	45.7 Å²	45.7	21%	0.206	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-44	175.3	-67.6	176.1	-154.9	0	0	111.4	L513 K514 I519 Q520 K521 T523	L513-E517 PolarHBondContact O-N 2.87Å; K514-E517 WeakPolarHBondContact CD-OE2 3.4Å; K514-E517 IonicContact NZ-OE1 3.62Å; K514-E517 PolarHBondContact NZ-OE1 3.09Å; K514-E517 IonicContact NZ-OE2 2.77Å; K514-E517 PolarHBondContact NZ-OE2 3.46Å; K514-E517 PolarHBondContact O-N 3.36Å; E517-I519 VanDerWaalsContact C-N 3.34Å; E517-I519 PolarHBondContact O-N 3.4Å; E517-Q520 PolarHBondContact O-N 3Å; E517-Q520 VanDerWaalsContact O-N 3.16Å; E517-K521 PolarHBondContact O-N 3.44Å; E517-T523 WeakPolarHBondContact CB-OG1 3.5Å
518	L	88	Confident	88.6	Confident	22 Å²	22	46.2 Å²	46.2	12%	0.115	24%	0.242	C	C	.	.	H	α-helix	trans	-54.8	-48.1	173.8	180	70.3	0	0	0	111.5	K514 L515 Q520 G522 K524 L527 L568 L571	K514-L518 WeakPolarHBondContact O-CB 3.5Å; K514-L518 PolarHBondContact O-N 3.48Å; L515-L518 HydrophobicContact CD1-CD2 4.3Å; L518-Q520 VanDerWaalsContact C-N 3.32Å; L518-Q520 PolarHBondContact O-N 3.36Å; L518-G522 VanDerWaalsContact O-CA 3.23Å; L518-G522 WeakPolarHBondContact O-CA 3.47Å; L518-G522 PolarHBondContact O-N 3.39Å; L518-K524 HydrophobicContact CD1-CB 4.15Å; L518-L527 HydrophobicContact CB-CD2 4.37Å; L518-L527 HydrophobicContact CD2-CD2 3.86Å; L518-L568 HydrophobicContact CD1-CD1 4.5Å; L518-L568 HydrophobicContact CD1-CD2 3.8Å; L518-L571 HydrophobicContact CD1-CD2 4.42Å; L518-L571 HydrophobicContact CD2-CD2 3.7Å
519	I	85.2	Confident	88.5	Confident	115 Å²	115	45.8 Å²	45.8	59%	0.59	24%	0.24	S	C	*	.	H	α-helix	trans	-64.9	-35.6	179.8	-67.4	166	0	0	0	111.9	L515 Q516 E517	L515-I519 HydrophobicContact CD1-CD1 4.45Å; L515-I519 HydrophobicContact CG-CD1 4.39Å; L515-I519 WeakPolarHBondContact O-CG1 3.33Å; L515-I519 PolarHBondContact O-N 3.19Å; L515-I519 VanDerWaalsContact O-N 3.15Å; Q516-I519 PolarHBondContact O-N 3.46Å; E517-I519 VanDerWaalsContact C-N 3.34Å; E517-I519 PolarHBondContact O-N 3.4Å
520	Q	85.4	Confident	88.6	Confident	145 Å²	145	42.7 Å²	42.7	68%	0.678	22%	0.218	S	C	*	.	H	α-helix	trans	-85	-37	-175.3	-70.9	174.7	24.3	0	0	113.8	Q516 E517 L518	Q516-Q520 WeakPolarHBondContact O-CB 3.29Å; Q516-Q520 VanDerWaalsContact O-CG 3.26Å; Q516-Q520 WeakPolarHBondContact O-CG 3.45Å; Q516-Q520 PolarHBondContact O-N 3.42Å; E517-Q520 PolarHBondContact O-N 3Å; E517-Q520 VanDerWaalsContact O-N 3.16Å; L518-Q520 VanDerWaalsContact C-N 3.32Å; L518-Q520 PolarHBondContact O-N 3.36Å
521	K	83.7	Confident	88.9	Confident	162 Å²	162	42 Å²	42	70%	0.704	22%	0.215	S	C	*	.	H	α-helix	trans	-129.8	-14.3	-167.1	-63.6	-178	-179.1	177.2	0	114.2	E517 T523	E517-K521 PolarHBondContact O-N 3.44Å; K521-T523 HydrophobicContact CB-CG2 4.22Å
522	G	82.7	Confident	89	Confident	39 Å²	39	43.1 Å²	43.1	40%	0.402	22%	0.221	S	C	.	.			trans	82.5	6.8	-176.5	0	0	0	0	0	115.2	L518	L518-G522 VanDerWaalsContact O-CA 3.23Å; L518-G522 WeakPolarHBondContact O-CA 3.47Å; L518-G522 PolarHBondContact O-N 3.39Å
523	T	85.1	Confident	89.2	Confident	23 Å²	23	40.8 Å²	40.8	14%	0.141	21%	0.208	C	C	.	.			trans	-72.4	127	-178.5	52.6	0	0	0	0	112	D343 E517 K521	D343-T523 WeakPolarHBondContact OD2-CA 3.44Å; E517-T523 WeakPolarHBondContact CB-OG1 3.5Å; K521-T523 HydrophobicContact CB-CG2 4.22Å
524	K	88.1	Confident	89.5	Confident	20 Å²	20	37.3 Å²	37.3	9%	0.087	19%	0.189	C	C	.	.			trans	-122.8	-27.2	-170.3	56.5	175	163.3	61.6	0	115	D343 E344 L518 V526 L527 E528 E567 L568	D343-K524 PolarHBondContact O-NZ 3.25Å; D343-K524 VanDerWaalsContact O-NZ 3.13Å; D343-K524 PolarHBondContact OD1-N 3.15Å; D343-K524 PolarHBondContact OD2-N 3.48Å; E344-K524 IonicContact OE1-NZ 3.86Å; E344-K524 PolarHBondContact OE1-NZ 3.34Å; L518-K524 HydrophobicContact CD1-CB 4.15Å; K524-V526 PolarHBondContact O-N 3.08Å; K524-L527 WeakPolarHBondContact O-CA 3.41Å; K524-L527 WeakPolarHBondContact O-CB 3.48Å; K524-L527 PolarHBondContact O-N 2.94Å; K524-E528 PolarHBondContact O-N 3.12Å; K524-E567 WeakPolarHBondContact CD-O 3.46Å; K524-E567 VanDerWaalsContact CE-O 3.23Å; K524-E567 WeakPolarHBondContact CE-O 3.39Å; K524-L568 HydrophobicContact CB-CD2 4.24Å; K524-L568 HydrophobicContact CD-CD2 4.03Å
525	L	87.8	Confident	89.8	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-51.4	-50.8	-165.7	179.8	66.6	0	0	0	114	D343 L345 R475 A478	D343-L525 WeakPolarHBondContact OD1-CB 3.36Å; D343-L525 PolarHBondContact OD1-N 3.07Å; L345-L525 HydrophobicContact CD2-CD1 4.38Å; L345-L525 HydrophobicContact CG-CD1 4.13Å; R475-L525 HydrophobicContact CG-CD2 3.96Å; A478-L525 HydrophobicContact CB-CD1 4.48Å; A478-L525 HydrophobicContact CB-CD2 4.16Å; A478-L525 HydrophobicContact CB-CG 3.83Å
526	V	88.5	Confident	90	Very high	8 Å²	8	36.2 Å²	36.2	5%	0.048	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-36.3	-179.5	-175.4	0	0	0	0	111.4	Q474 Q477 A478 K514 K524 E528 Q529 V530	Q474-V526 HydrophobicContact CB-CG2 4.1Å; Q474-V526 VanDerWaalsContact O-CG2 3.3Å; Q474-V526 WeakPolarHBondContact O-CG2 3.37Å; Q477-V526 HydrophobicContact CB-CG1 3.96Å; Q477-V526 HydrophobicContact CB-CG2 3.91Å; A478-V526 HydrophobicContact CB-CG2 4.26Å; K514-V526 HydrophobicContact CD-CB 4.28Å; K514-V526 HydrophobicContact CD-CG1 4.36Å; K514-V526 HydrophobicContact CG-CB 4.26Å; K514-V526 HydrophobicContact CG-CG1 4.07Å; K524-V526 PolarHBondContact O-N 3.08Å; V526-E528 VanDerWaalsContact C-N 3.34Å; V526-E528 PolarHBondContact O-N 3.48Å; V526-Q529 PolarHBondContact O-N 3.31Å; V526-V530 HydrophobicContact CG1-CG2 4.06Å; V526-V530 WeakPolarHBondContact O-CB 3.36Å; V526-V530 WeakPolarHBondContact O-CG2 3.46Å; V526-V530 PolarHBondContact O-N 3.41Å
527	L	91.6	Very high	90.4	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-65.6	-39.4	-178.5	-175.6	60.9	0	0	0	111.2	M511 K514 L518 K524 Q529 V530 V531 I559 L571	M511-L527 HydrophobicContact CG-CD1 3.98Å; K514-L527 HydrophobicContact CB-CB 4.03Å; K514-L527 HydrophobicContact CB-CD1 4.04Å; L518-L527 HydrophobicContact CB-CD2 4.37Å; L518-L527 HydrophobicContact CD2-CD2 3.86Å; K524-L527 WeakPolarHBondContact O-CA 3.41Å; K524-L527 WeakPolarHBondContact O-CB 3.48Å; K524-L527 PolarHBondContact O-N 2.94Å; L527-Q529 VanDerWaalsContact C-N 3.34Å; L527-Q529 PolarHBondContact O-N 3.44Å; L527-V530 PolarHBondContact O-N 3.35Å; L527-V531 HydrophobicContact CD1-CG2 4.21Å; L527-V531 HydrophobicContact CG-CG2 4.38Å; L527-V531 WeakPolarHBondContact O-CB 3.46Å; L527-V531 VanDerWaalsContact O-CG2 3.28Å; L527-V531 WeakPolarHBondContact O-CG2 3.49Å; L527-V531 PolarHBondContact O-N 2.61Å; L527-I559 HydrophobicContact CD1-CD1 4.49Å; L527-I559 HydrophobicContact CD2-CD1 4.47Å; L527-L571 HydrophobicContact CB-CD1 4.43Å; L527-L571 HydrophobicContact CD2-CD1 4.14Å; L527-L571 HydrophobicContact CD2-CD2 4Å; L527-L571 HydrophobicContact CG-CD1 3.95Å
528	E	91.9	Very high	90.8	Very high	11 Å²	11	29.4 Å²	29.4	5%	0.051	15%	0.153	C	C	.	.	H	α-helix	trans	-57.5	-45.9	175.9	-69.9	-176.5	167.8	0	0	112	K524 V526 T532 L571 K574	K524-E528 PolarHBondContact O-N 3.12Å; V526-E528 VanDerWaalsContact C-N 3.34Å; V526-E528 PolarHBondContact O-N 3.48Å; E528-T532 PolarHBondContact O-N 3.27Å; E528-T532 PolarHBondContact O-OG1 3.41Å; E528-L571 HydrophobicContact CB-CD1 4.49Å; E528-L571 HydrophobicContact CG-CB 3.78Å; E528-L571 HydrophobicContact CG-CD1 3.76Å; E528-L571 HydrophobicContact CG-CG 4.33Å; E528-L571 PolarHBondContact OE1-N 3.44Å; E528-K574 HydrophobicContact CB-CD 4.09Å
529	Q	91.4	Very high	91.1	Very high	31 Å²	31	31.8 Å²	31.8	15%	0.145	17%	0.166	C	C	.	.	H	α-helix	trans	-71.8	-37.7	179.2	-60.3	-58.7	-19.4	0	0	112.2	A478 A481 V526 L527 V531 T532 S533	A478-Q529 HydrophobicContact CB-CG 4.08Å; A481-Q529 HydrophobicContact CB-CB 3.73Å; V526-Q529 PolarHBondContact O-N 3.31Å; L527-Q529 VanDerWaalsContact C-N 3.34Å; L527-Q529 PolarHBondContact O-N 3.44Å; Q529-V531 PolarHBondContact O-N 3.11Å; Q529-T532 PolarHBondContact O-N 3.48Å; Q529-S533 WeakPolarHBondContact O-CB 3.41Å; Q529-S533 PolarHBondContact O-N 2.92Å
530	V	93.4	Very high	91.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.4	-41.8	176.6	169.5	0	0	0	0	111.7	M468 L507 I510 M511 V526 L527 T532 S533 I534	M468-V530 HydrophobicContact CE-CG2 4.17Å; L507-V530 HydrophobicContact CD2-CG1 4.4Å; I510-V530 HydrophobicContact CG2-CG1 4.47Å; I510-V530 HydrophobicContact CG2-CG2 3.67Å; M511-V530 HydrophobicContact CB-CG1 3.92Å; V526-V530 HydrophobicContact CG1-CG2 4.06Å; V526-V530 WeakPolarHBondContact O-CB 3.36Å; V526-V530 WeakPolarHBondContact O-CG2 3.46Å; V526-V530 PolarHBondContact O-N 3.41Å; L527-V530 PolarHBondContact O-N 3.35Å; V530-T532 VanDerWaalsContact C-N 3.31Å; V530-T532 PolarHBondContact O-N 3.33Å; V530-S533 PolarHBondContact O-N 3.21Å; V530-I534 HydrophobicContact CG1-CD1 3.98Å; V530-I534 WeakPolarHBondContact O-CD1 3.12Å; V530-I534 VanDerWaalsContact O-CG1 3.28Å; V530-I534 WeakPolarHBondContact O-CG1 3.41Å; V530-I534 PolarHBondContact O-N 3.25Å
531	V	95.4	Very high	92	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.2	-42.8	176.1	166.7	0	0	0	0	110.9	L527 Q529 I534 A535 L556 I559 K574 C578	L527-V531 HydrophobicContact CD1-CG2 4.21Å; L527-V531 HydrophobicContact CG-CG2 4.38Å; L527-V531 WeakPolarHBondContact O-CB 3.46Å; L527-V531 VanDerWaalsContact O-CG2 3.28Å; L527-V531 WeakPolarHBondContact O-CG2 3.49Å; L527-V531 PolarHBondContact O-N 2.61Å; Q529-V531 PolarHBondContact O-N 3.11Å; V531-I534 PolarHBondContact O-N 3.13Å; V531-A535 PolarHBondContact O-N 3.37Å; V531-L556 HydrophobicContact CG1-CD2 4.32Å; V531-L556 HydrophobicContact CG2-CD2 4.27Å; V531-I559 HydrophobicContact CG2-CD1 4.43Å; V531-K574 HydrophobicContact CG1-CB 4.5Å; V531-C578 HydrophobicContact CG1-CB 3.62Å; V531-C578 PolarHBondContact O-SG 3.05Å
532	T	94.8	Very high	92.6	Very high	22 Å²	22	17.5 Å²	17.5	14%	0.135	10%	0.101	C	C	.	.	H	α-helix	trans	-67.6	-40	177.7	-46.4	0	0	0	0	111.4	I485 E528 Q529 V530 I534 A535 S536 K574	I485-T532 HydrophobicContact CD1-CG2 3.65Å; I485-T532 HydrophobicContact CG1-CG2 4.45Å; E528-T532 PolarHBondContact O-N 3.27Å; E528-T532 PolarHBondContact O-OG1 3.41Å; Q529-T532 PolarHBondContact O-N 3.48Å; V530-T532 VanDerWaalsContact C-N 3.31Å; V530-T532 PolarHBondContact O-N 3.33Å; T532-I534 PolarHBondContact O-N 3.42Å; T532-A535 WeakPolarHBondContact O-CA 3.35Å; T532-A535 VanDerWaalsContact O-CB 3.28Å; T532-A535 WeakPolarHBondContact O-CB 3.38Å; T532-A535 PolarHBondContact O-N 3.24Å; T532-A535 VanDerWaalsContact O-N 3.07Å; T532-S536 PolarHBondContact O-N 3.43Å; T532-K574 WeakPolarHBondContact OG1-CD 3.48Å
533	S	94.6	Very high	93.2	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.6	-40.5	173.8	-175.7	0	0	0	0	112.7	Q529 V530 A535 S536 V537	Q529-S533 WeakPolarHBondContact O-CB 3.41Å; Q529-S533 PolarHBondContact O-N 2.92Å; V530-S533 PolarHBondContact O-N 3.21Å; S533-A535 VanDerWaalsContact C-N 3.29Å; S533-A535 PolarHBondContact O-N 2.89Å; S533-S536 PolarHBondContact O-N 3.05Å; S533-V537 WeakPolarHBondContact O-CB 3.43Å; S533-V537 VanDerWaalsContact O-CG2 3.28Å; S533-V537 WeakPolarHBondContact O-CG2 3.33Å; S533-V537 PolarHBondContact O-N 2.95Å
534	I	96.1	Very high	93.7	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-62.2	-40.3	172.7	-66.5	159.1	0	0	0	110.7	L507 M511 V530 V531 T532 A538 F545 F552 I582	L507-I534 HydrophobicContact CB-CD1 4.39Å; L507-I534 HydrophobicContact CB-CG1 3.85Å; L507-I534 HydrophobicContact CD1-CG1 4.04Å; L507-I534 HydrophobicContact CG-CG1 4.4Å; M511-I534 HydrophobicContact CB-CD1 4.24Å; M511-I534 HydrophobicContact CG-CD1 4.36Å; M511-I534 HydrophobicContact SD-CD1 3.78Å; V530-I534 HydrophobicContact CG1-CD1 3.98Å; V530-I534 WeakPolarHBondContact O-CD1 3.12Å; V530-I534 VanDerWaalsContact O-CG1 3.28Å; V530-I534 WeakPolarHBondContact O-CG1 3.41Å; V530-I534 PolarHBondContact O-N 3.25Å; V531-I534 PolarHBondContact O-N 3.13Å; T532-I534 PolarHBondContact O-N 3.42Å; I534-A538 WeakPolarHBondContact O-CB 3.42Å; I534-A538 PolarHBondContact O-N 3.5Å; I534-F545 HydrophobicContact CG2-CZ 4.3Å; I534-F552 HydrophobicContact CD1-CD1 3.76Å; I534-F552 HydrophobicContact CD1-CE1 3.51Å; I534-F552 HydrophobicContact CD1-CZ 4.42Å; I534-F552 HydrophobicContact CG1-CD1 4.35Å; I534-F552 HydrophobicContact CG1-CE1 3.86Å; I534-F552 HydrophobicContact CG1-CZ 4.29Å; I534-F552 HydrophobicContact CG2-CD1 4.07Å; I534-F552 HydrophobicContact CG2-CD2 4.37Å; I534-F552 HydrophobicContact CG2-CE1 4.15Å; I534-F552 HydrophobicContact CG2-CE2 4.42Å; I534-F552 HydrophobicContact CG2-CG 4.18Å; I534-F552 HydrophobicContact CG2-CZ 4.32Å; I534-I582 HydrophobicContact CG2-CD1 4.17Å
535	A	95.6	Very high	94.2	Very high	2 Å²	2	22.4 Å²	22.4	2%	0.017	11%	0.111	C	C	.	.	H	α-helix	trans	-62.5	-50	179.3	0	0	0	0	0	111.6	V531 T532 S533 V537 A538 D539 C578 L581	V531-A535 PolarHBondContact O-N 3.37Å; T532-A535 WeakPolarHBondContact O-CA 3.35Å; T532-A535 VanDerWaalsContact O-CB 3.28Å; T532-A535 WeakPolarHBondContact O-CB 3.38Å; T532-A535 PolarHBondContact O-N 3.24Å; T532-A535 VanDerWaalsContact O-N 3.07Å; S533-A535 VanDerWaalsContact C-N 3.29Å; S533-A535 PolarHBondContact O-N 2.89Å; A535-V537 PolarHBondContact O-N 3.47Å; A535-A538 PolarHBondContact O-N 2.93Å; A535-D539 PolarHBondContact O-N 3.2Å; A535-C578 HydrophobicContact CB-CB 3.83Å; A535-L581 HydrophobicContact CB-CD1 3.89Å
536	S	95.9	Very high	94.6	Very high	9 Å²	9	24.5 Å²	24.5	6%	0.063	12%	0.124	C	C	.	.	H	α-helix	trans	-59	-46.6	176.8	174.9	0	0	0	0	111.7	T488 E489 T532 S533 A538 D539 T540	T488-S536 PolarHBondContact OG1-OG 2.74Å; E489-S536 VanDerWaalsContact CG-OG 3.3Å; E489-S536 WeakPolarHBondContact CG-OG 3.47Å; E489-S536 PolarHBondContact N-OG 3.22Å; T532-S536 PolarHBondContact O-N 3.43Å; S533-S536 PolarHBondContact O-N 3.05Å; S536-A538 VanDerWaalsContact C-N 3.3Å; S536-A538 PolarHBondContact O-N 2.85Å; S536-D539 PolarHBondContact O-N 3.47Å; S536-T540 PolarHBondContact O-N 3.28Å; S536-T540 PolarHBondContact O-OG1 3.01Å
537	V	95.6	Very high	95	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.6	-39.6	176.2	170.9	0	0	0	0	112.2	T488 L500 L503 V504 L507 S533 A535 A541 F545	T488-V537 HydrophobicContact CG2-CG2 3.89Å; L500-V537 HydrophobicContact CD1-CG1 3.46Å; L500-V537 VanDerWaalsContact CD1-CG1 3.46Å; L503-V537 HydrophobicContact CD2-CB 4.45Å; L503-V537 HydrophobicContact CD2-CG1 4.01Å; L503-V537 HydrophobicContact CD2-CG2 3.49Å; L503-V537 VanDerWaalsContact CD2-CG2 3.49Å; L503-V537 HydrophobicContact CG-CG2 4.16Å; V504-V537 HydrophobicContact CG2-CG1 4.47Å; L507-V537 HydrophobicContact CD1-CG2 4.15Å; S533-V537 WeakPolarHBondContact O-CB 3.43Å; S533-V537 VanDerWaalsContact O-CG2 3.28Å; S533-V537 WeakPolarHBondContact O-CG2 3.33Å; S533-V537 PolarHBondContact O-N 2.95Å; A535-V537 PolarHBondContact O-N 3.47Å; V537-A541 WeakPolarHBondContact O-CB 3.34Å; V537-A541 PolarHBondContact O-N 3.49Å; V537-F545 HydrophobicContact CG1-CE2 4.31Å
538	A	96.1	Very high	95.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.8	-45.7	178.9	0	0	0	0	0	111.8	I534 A535 S536 A541 E542 F545 I582 A585	I534-A538 WeakPolarHBondContact O-CB 3.42Å; I534-A538 PolarHBondContact O-N 3.5Å; A535-A538 PolarHBondContact O-N 2.93Å; S536-A538 VanDerWaalsContact C-N 3.3Å; S536-A538 PolarHBondContact O-N 2.85Å; A538-A541 PolarHBondContact O-N 3.49Å; A538-E542 PolarHBondContact O-N 2.65Å; A538-F545 HydrophobicContact CB-CD1 3.8Å; A538-F545 HydrophobicContact CB-CD2 3.9Å; A538-F545 HydrophobicContact CB-CE1 3.83Å; A538-F545 HydrophobicContact CB-CE2 3.91Å; A538-F545 HydrophobicContact CB-CG 3.83Å; A538-F545 HydrophobicContact CB-CZ 3.88Å; A538-I582 HydrophobicContact CB-CB 4.49Å; A538-I582 HydrophobicContact CB-CG1 3.59Å; A538-A585 WeakPolarHBondContact O-CB 3.49Å
539	D	94.9	Very high	95.4	Very high	72 Å²	72	30.2 Å²	30.2	39%	0.385	16%	0.157	S	C	.	.	H	α-helix	trans	-60	-49.8	179.4	-163.8	53.9	0	0	0	111	A535 S536 A541 E542 L581	A535-D539 PolarHBondContact O-N 3.2Å; S536-D539 PolarHBondContact O-N 3.47Å; D539-A541 VanDerWaalsContact C-N 3.32Å; D539-A541 PolarHBondContact O-N 3.13Å; D539-E542 VanDerWaalsContact O-CG 3.29Å; D539-E542 WeakPolarHBondContact O-CG 3.29Å; D539-E542 PolarHBondContact O-N 2.93Å; D539-L581 HydrophobicContact CB-CD2 4.33Å
540	T	94.3	Very high	95.7	Very high	22 Å²	22	33.5 Å²	33.5	14%	0.135	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-32.6	177	-53.2	0	0	0	0	113.1	T488 C491 K493 L496 S536	T488-T540 PolarHBondContact O-OG1 3.04Å; C491-T540 WeakPolarHBondContact O-CG2 3.39Å; K493-T540 WeakPolarHBondContact CB-O 3.39Å; K493-T540 VanDerWaalsContact CG-O 3.27Å; K493-T540 WeakPolarHBondContact CG-O 3.32Å; L496-T540 HydrophobicContact CD2-CG2 3.64Å; S536-T540 PolarHBondContact O-N 3.28Å; S536-T540 PolarHBondContact O-OG1 3.01Å
541	A	95.1	Very high	95.8	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-78.7	-22.5	-178.6	0	0	0	0	0	113.8	K493 L500 V537 A538 D539 E543 K544 F545	K493-A541 VanDerWaalsContact CE-O 3.32Å; K493-A541 WeakPolarHBondContact CE-O 3.07Å; L500-A541 HydrophobicContact CD1-CB 4.01Å; L500-A541 HydrophobicContact CD2-CB 3.85Å; V537-A541 WeakPolarHBondContact O-CB 3.34Å; V537-A541 PolarHBondContact O-N 3.49Å; A538-A541 PolarHBondContact O-N 3.49Å; D539-A541 VanDerWaalsContact C-N 3.32Å; D539-A541 PolarHBondContact O-N 3.13Å; A541-E543 PolarHBondContact O-N 2.91Å; A541-K544 HydrophobicContact CB-CB 4.47Å; A541-K544 VanDerWaalsContact O-CB 3.26Å; A541-K544 WeakPolarHBondContact O-CB 3.3Å; A541-K544 PolarHBondContact O-N 2.98Å; A541-F545 HydrophobicContact CB-CB 4.11Å; A541-F545 HydrophobicContact CB-CD2 4.3Å
542	E	95.6	Very high	95.8	Very high	99 Å²	99	36.5 Å²	36.5	46%	0.463	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	46.9	-125.2	-178.8	-57.4	178.6	134.8	0	0	111.9	K493 A538 D539 K544 F545 A585	K493-E542 HydrophobicContact CD-CG 4.49Å; K493-E542 WeakPolarHBondContact CD-OE2 3.49Å; K493-E542 WeakPolarHBondContact CE-OE2 3.47Å; K493-E542 IonicContact NZ-OE2 3.54Å; K493-E542 PolarHBondContact NZ-OE2 3.04Å; A538-E542 PolarHBondContact O-N 2.65Å; D539-E542 VanDerWaalsContact O-CG 3.29Å; D539-E542 WeakPolarHBondContact O-CG 3.29Å; D539-E542 PolarHBondContact O-N 2.93Å; E542-K544 PolarHBondContact O-N 3.42Å; E542-F545 WeakPolarHBondContact O-CB 3.5Å; E542-F545 PolarHBondContact O-N 3.18Å; E542-A585 CarbonylContact C-O 3.16Å
543	E	95	Very high	95.8	Very high	90 Å²	90	35.5 Å²	35.5	42%	0.421	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-62.9	-16.5	-176.9	79.2	-69.5	161.9	0	0	113.6	K493 A541 F545 V546 A585	K493-E543 IonicContact NZ-OE1 2.79Å; K493-E543 PolarHBondContact NZ-OE1 2.99Å; K493-E543 IonicContact NZ-OE2 3.25Å; K493-E543 PolarHBondContact NZ-OE2 3.32Å; A541-E543 PolarHBondContact O-N 2.91Å; E543-F545 PolarHBondContact O-N 3.38Å; E543-V546 VanDerWaalsContact O-CG2 3.23Å; E543-V546 WeakPolarHBondContact O-CG2 3.44Å; E543-V546 PolarHBondContact O-N 2.83Å; E543-A585 PolarHBondContact N-O 3.21Å
544	K	96.5	Very high	95.8	Very high	93 Å²	93	39.1 Å²	39.1	40%	0.404	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-75	-12.3	175.7	-53.6	-57.5	-176.7	-160.3	0	112.5	I497 L500 A541 E542 P547	I497-K544 HydrophobicContact CD1-CG 3.81Å; I497-K544 HydrophobicContact CG1-CB 4.36Å; I497-K544 HydrophobicContact CG1-CG 3.94Å; L500-K544 HydrophobicContact CD2-CB 3.99Å; A541-K544 HydrophobicContact CB-CB 4.47Å; A541-K544 VanDerWaalsContact O-CB 3.26Å; A541-K544 WeakPolarHBondContact O-CB 3.3Å; A541-K544 PolarHBondContact O-N 2.98Å; E542-K544 PolarHBondContact O-N 3.42Å; K544-P547 VanDerWaalsContact O-CD 3.28Å; K544-P547 WeakPolarHBondContact O-CD 3.46Å
545	F	97.4	Very high	95.7	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-81.8	-15.9	176.4	-157	-100.3	0	0	0	113.7	L500 V504 I534 V537 A538 A541 E542 E543 P547 Y548 Y549 F552 I582 V586	L500-F545 HydrophobicContact CD1-CD2 4.4Å; V504-F545 HydrophobicContact CG2-CE2 3.84Å; I534-F545 HydrophobicContact CG2-CZ 4.3Å; V537-F545 HydrophobicContact CG1-CE2 4.31Å; A538-F545 HydrophobicContact CB-CD1 3.8Å; A538-F545 HydrophobicContact CB-CD2 3.9Å; A538-F545 HydrophobicContact CB-CE1 3.83Å; A538-F545 HydrophobicContact CB-CE2 3.91Å; A538-F545 HydrophobicContact CB-CG 3.83Å; A538-F545 HydrophobicContact CB-CZ 3.88Å; A541-F545 HydrophobicContact CB-CB 4.11Å; A541-F545 HydrophobicContact CB-CD2 4.3Å; E542-F545 WeakPolarHBondContact O-CB 3.5Å; E542-F545 PolarHBondContact O-N 3.18Å; E543-F545 PolarHBondContact O-N 3.38Å; F545-P547 VanDerWaalsContact C-N 3.33Å; F545-P547 VanDerWaalsContact O-N 3.15Å; F545-Y548 HydrophobicContact CD2-CD2 4.22Å; F545-Y548 PolarHBondContact O-N 3.09Å; F545-Y549 PolarHBondContact O-N 2.71Å; F545-F552 HydrophobicContact CE1-CD2 4.2Å; F545-F552 HydrophobicContact CE2-CE2 4.41Å; F545-F552 AromaticContact CZ-CD2 3.73Å; F545-F552 HydrophobicContact CZ-CD2 3.73Å; F545-F552 AromaticContact CZ-CE2 3.75Å; F545-F552 HydrophobicContact CZ-CE2 3.75Å; F545-I582 HydrophobicContact CD1-CG1 4.38Å; F545-I582 HydrophobicContact CD1-CG2 4.17Å; F545-I582 HydrophobicContact CE1-CD1 4.08Å; F545-I582 HydrophobicContact CE1-CG1 3.83Å; F545-I582 HydrophobicContact CE1-CG2 4.07Å; F545-V586 HydrophobicContact CB-CG1 4.5Å; F545-V586 HydrophobicContact CD1-CG1 4.41Å
546	V	96.8	Very high	95.6	Very high	51 Å²	51	40.3 Å²	40.3	31%	0.309	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-47.3	-43.8	-178.8	175.3	0	0	0	0	114.1	E543 Y548 Y549 V586 K590	E543-V546 VanDerWaalsContact O-CG2 3.23Å; E543-V546 WeakPolarHBondContact O-CG2 3.44Å; E543-V546 PolarHBondContact O-N 2.83Å; V546-Y548 PolarHBondContact O-N 2.94Å; V546-Y549 WeakPolarHBondContact O-CB 3.48Å; V546-Y549 PolarHBondContact O-N 2.87Å; V546-V586 HydrophobicContact CB-CG1 4.48Å; V546-V586 HydrophobicContact CG2-CB 3.82Å; V546-V586 HydrophobicContact CG2-CG1 3.97Å; V546-K590 HydrophobicContact CG1-CG 4.33Å
547	P	97	Very high	95.4	Very high	98 Å²	98	41.4 Å²	41.4	64%	0.636	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-64.7	-19.8	179.9	-21.4	35.1	0	0	0	114.6	K544 F545	K544-P547 VanDerWaalsContact O-CD 3.28Å; K544-P547 WeakPolarHBondContact O-CD 3.46Å; F545-P547 VanDerWaalsContact C-N 3.33Å; F545-P547 VanDerWaalsContact O-N 3.15Å
548	Y	97.1	Very high	95.2	Very high	42 Å²	42	45.2 Å²	45.2	17%	0.165	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-102.2	-7.5	-175.8	-49.5	-70.1	0	0	0	113.1	L500 D501 V504 F545 V546 D550 L551	L500-Y548 HydrophobicContact CD2-CD2 4.29Å; L500-Y548 HydrophobicContact CD2-CE2 3.6Å; L500-Y548 HydrophobicContact CG-CD2 4.31Å; L500-Y548 HydrophobicContact CG-CE2 3.63Å; D501-Y548 WeakPolarHBondContact CA-OH 3.42Å; D501-Y548 HydrophobicContact CB-CE1 4.46Å; D501-Y548 WeakPolarHBondContact CB-OH 3.46Å; D501-Y548 PolarHBondContact N-OH 3.13Å; V504-Y548 HydrophobicContact CB-CD1 4.16Å; V504-Y548 HydrophobicContact CB-CE1 4.43Å; V504-Y548 HydrophobicContact CB-CG 4.35Å; V504-Y548 HydrophobicContact CG1-CD1 3.48Å; V504-Y548 VanDerWaalsContact CG1-CD1 3.48Å; V504-Y548 HydrophobicContact CG1-CE1 4.13Å; V504-Y548 HydrophobicContact CG1-CG 3.76Å; V504-Y548 HydrophobicContact CG2-CD1 4.39Å; V504-Y548 HydrophobicContact CG2-CD2 4.19Å; V504-Y548 HydrophobicContact CG2-CG 4.09Å; F545-Y548 HydrophobicContact CD2-CD2 4.22Å; F545-Y548 PolarHBondContact O-N 3.09Å; V546-Y548 PolarHBondContact O-N 2.94Å; Y548-D550 VanDerWaalsContact C-N 3.31Å; Y548-D550 PolarHBondContact O-N 3.46Å; Y548-L551 WeakPolarHBondContact O-CB 3.31Å; Y548-L551 PolarHBondContact O-N 2.88Å
549	Y	96.3	Very high	94.9	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-50.4	-49.5	-179.1	179.9	-83.2	0	0	0	112.7	F545 V546 L551 F552 M553 I582 V586 K590 F591 D594	F545-Y549 PolarHBondContact O-N 2.71Å; V546-Y549 WeakPolarHBondContact O-CB 3.48Å; V546-Y549 PolarHBondContact O-N 2.87Å; Y549-L551 PolarHBondContact O-N 2.56Å; Y549-L551 VanDerWaalsContact O-N 3.15Å; Y549-F552 PolarHBondContact O-N 2.62Å; Y549-M553 HydrophobicContact CD1-CB 4.18Å; Y549-M553 HydrophobicContact CD2-CE 4.26Å; Y549-M553 HydrophobicContact CE1-CB 3.84Å; Y549-M553 HydrophobicContact CE1-CG 3.89Å; Y549-M553 HydrophobicContact CE2-CE 3.57Å; Y549-M553 HydrophobicContact CE2-CG 4.43Å; Y549-M553 WeakPolarHBondContact O-CB 3.4Å; Y549-M553 PolarHBondContact O-N 2.88Å; Y549-I582 HydrophobicContact CD2-CG2 3.58Å; Y549-I582 HydrophobicContact CE2-CG2 3.95Å; Y549-V586 HydrophobicContact CD2-CB 4.36Å; Y549-V586 HydrophobicContact CD2-CG1 3.91Å; Y549-V586 HydrophobicContact CD2-CG2 3.78Å; Y549-V586 HydrophobicContact CE2-CG2 3.93Å; Y549-K590 HydrophobicContact CD1-CD 4.45Å; Y549-K590 HydrophobicContact CD1-CG 4.46Å; Y549-K590 HydrophobicContact CD2-CG 4.25Å; Y549-K590 HydrophobicContact CG-CG 4.16Å; Y549-F591 HydrophobicContact CE2-CD2 4.13Å; Y549-D594 WeakPolarHBondContact CE1-OD2 3.39Å; Y549-D594 WeakPolarHBondContact OH-CB 3.49Å; Y549-D594 PolarHBondContact OH-OD2 2.91Å
550	D	95.8	Very high	94.6	Very high	100 Å²	100	42 Å²	42	54%	0.535	22%	0.221	S	C	.	.	H	α-helix	trans	-69.3	-13.9	-175.9	-60	-34.5	0	0	0	112.7	Y548 K590	Y548-D550 VanDerWaalsContact C-N 3.31Å; Y548-D550 PolarHBondContact O-N 3.46Å; D550-K590 IonicContact OD1-NZ 2.95Å; D550-K590 PolarHBondContact OD1-NZ 3.36Å; D550-K590 IonicContact OD2-NZ 2.64Å; D550-K590 PolarHBondContact OD2-NZ 3.12Å
551	L	95.6	Very high	94.2	Very high	62 Å²	62	46.2 Å²	46.2	33%	0.325	24%	0.239	S	C	.	.	H	α-helix	trans	-79.5	-33.6	178.4	-170.8	65.1	0	0	0	112.1	V504 H508 Y548 Y549	V504-L551 HydrophobicContact CG1-CD2 3.75Å; H508-L551 HydrophobicContact CB-CD2 3.82Å; H508-L551 HydrophobicContact CB-CG 4.17Å; H508-L551 PolarHBondContact CE1-O 3.1Å; H508-L551 WeakPolarHBondContact ND1-CG 3.21Å; H508-L551 PolarHBondContact ND1-O 2.96Å; Y548-L551 WeakPolarHBondContact O-CB 3.31Å; Y548-L551 PolarHBondContact O-N 2.88Å; Y549-L551 PolarHBondContact O-N 2.56Å; Y549-L551 VanDerWaalsContact O-N 3.15Å
552	F	95.9	Very high	93.7	Very high	1 Å²	1	50.3 Å²	50.3	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-106.8	-42.2	-174.1	-65.1	-77	0	0	0	113.6	V504 H508 M511 I534 F545 Y549 S555 L556 I582	V504-F552 HydrophobicContact CB-CE2 4.33Å; V504-F552 HydrophobicContact CB-CZ 4.39Å; V504-F552 HydrophobicContact CG1-CE2 3.47Å; V504-F552 VanDerWaalsContact CG1-CE2 3.47Å; V504-F552 HydrophobicContact CG1-CZ 3.72Å; V504-F552 HydrophobicContact CG2-CE2 4.28Å; H508-F552 HydrophobicContact CB-CD1 4.47Å; H508-F552 HydrophobicContact CB-CE1 3.63Å; H508-F552 HydrophobicContact CB-CZ 3.85Å; M511-F552 HydrophobicContact CE-CD1 3.68Å; M511-F552 HydrophobicContact CE-CE1 4.32Å; M511-F552 HydrophobicContact SD-CD1 3.95Å; I534-F552 HydrophobicContact CD1-CD1 3.76Å; I534-F552 HydrophobicContact CD1-CE1 3.51Å; I534-F552 HydrophobicContact CD1-CZ 4.42Å; I534-F552 HydrophobicContact CG1-CD1 4.35Å; I534-F552 HydrophobicContact CG1-CE1 3.86Å; I534-F552 HydrophobicContact CG1-CZ 4.29Å; I534-F552 HydrophobicContact CG2-CD1 4.07Å; I534-F552 HydrophobicContact CG2-CD2 4.37Å; I534-F552 HydrophobicContact CG2-CE1 4.15Å; I534-F552 HydrophobicContact CG2-CE2 4.42Å; I534-F552 HydrophobicContact CG2-CG 4.18Å; I534-F552 HydrophobicContact CG2-CZ 4.32Å; F545-F552 HydrophobicContact CE1-CD2 4.2Å; F545-F552 HydrophobicContact CE2-CE2 4.41Å; F545-F552 AromaticContact CZ-CD2 3.73Å; F545-F552 HydrophobicContact CZ-CD2 3.73Å; F545-F552 AromaticContact CZ-CE2 3.75Å; F545-F552 HydrophobicContact CZ-CE2 3.75Å; Y549-F552 PolarHBondContact O-N 2.62Å; F552-S555 WeakPolarHBondContact O-CB 3.47Å; F552-S555 PolarHBondContact O-N 3.45Å; F552-L556 HydrophobicContact CB-CD1 4Å; F552-L556 HydrophobicContact CB-CG 4.48Å; F552-L556 WeakPolarHBondContact O-CG 3.23Å; F552-L556 PolarHBondContact O-N 3.26Å; F552-I582 HydrophobicContact CB-CD1 4.45Å
553	M	95.1	Very high	93.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-54.1	-43.8	-168.6	-171.9	59.3	58.7	0	0	113.9	Y549 S555 L556 K557 I579 I582 F591 D594	Y549-M553 HydrophobicContact CD1-CB 4.18Å; Y549-M553 HydrophobicContact CD2-CE 4.26Å; Y549-M553 HydrophobicContact CE1-CB 3.84Å; Y549-M553 HydrophobicContact CE1-CG 3.89Å; Y549-M553 HydrophobicContact CE2-CE 3.57Å; Y549-M553 HydrophobicContact CE2-CG 4.43Å; Y549-M553 WeakPolarHBondContact O-CB 3.4Å; Y549-M553 PolarHBondContact O-N 2.88Å; M553-S555 VanDerWaalsContact C-N 3.35Å; M553-S555 PolarHBondContact O-N 3.33Å; M553-L556 PolarHBondContact O-N 3.06Å; M553-K557 WeakPolarHBondContact O-CG 3.39Å; M553-K557 PolarHBondContact O-N 3.48Å; M553-K557 HydrophobicContact SD-CG 4.34Å; M553-I579 HydrophobicContact CE-CG2 4.11Å; M553-I579 HydrophobicContact SD-CB 4.47Å; M553-I579 HydrophobicContact SD-CG1 4.13Å; M553-I579 HydrophobicContact SD-CG2 3.85Å; M553-I582 HydrophobicContact CE-CB 4.17Å; M553-I582 HydrophobicContact CE-CG2 3.72Å; M553-F591 HydrophobicContact CE-CE2 4.47Å; M553-D594 HydrophobicContact CG-CB 4.4Å
554	P	93.6	Very high	92.6	Very high	77 Å²	77	46.2 Å²	46.2	50%	0.5	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-40.1	177.5	-23	34.9	0	0	0	113.4	H558	P554-H558 PolarHBondContact O-N 2.77Å; P554-H558 VanDerWaalsContact O-N 3.11Å
555	S	93.9	Very high	92	Very high	27 Å²	27	47.2 Å²	47.2	19%	0.189	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-40.8	179.4	-57.4	0	0	0	0	111.5	F552 M553 H558 I559	F552-S555 WeakPolarHBondContact O-CB 3.47Å; F552-S555 PolarHBondContact O-N 3.45Å; M553-S555 VanDerWaalsContact C-N 3.35Å; M553-S555 PolarHBondContact O-N 3.33Å; S555-H558 WeakPolarHBondContact O-CB 3.41Å; S555-H558 PolarHBondContact O-N 3.33Å; S555-I559 WeakPolarHBondContact O-CG1 3.49Å; S555-I559 PolarHBondContact O-N 2.91Å
556	L	94.9	Very high	91.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.3	-44	177.4	-65.1	169.4	0	0	0	111.5	M511 V531 F552 M553 H558 I559 V560 T575 I579 I582	M511-L556 HydrophobicContact SD-CD2 4.15Å; V531-L556 HydrophobicContact CG1-CD2 4.32Å; V531-L556 HydrophobicContact CG2-CD2 4.27Å; F552-L556 HydrophobicContact CB-CD1 4Å; F552-L556 HydrophobicContact CB-CG 4.48Å; F552-L556 WeakPolarHBondContact O-CG 3.23Å; F552-L556 PolarHBondContact O-N 3.26Å; M553-L556 PolarHBondContact O-N 3.06Å; L556-H558 VanDerWaalsContact C-N 3.27Å; L556-H558 PolarHBondContact O-N 3.34Å; L556-I559 HydrophobicContact CD2-CD1 4.49Å; L556-I559 WeakPolarHBondContact O-CB 3.47Å; L556-I559 PolarHBondContact O-N 3.44Å; L556-I559 VanDerWaalsContact O-N 3.12Å; L556-V560 PolarHBondContact O-N 3.27Å; L556-V560 VanDerWaalsContact O-N 3.13Å; L556-T575 HydrophobicContact CB-CG2 4.03Å; L556-T575 HydrophobicContact CD2-CG2 3.86Å; L556-T575 WeakPolarHBondContact O-CG2 3.46Å; L556-I579 HydrophobicContact CB-CD1 3.93Å; L556-I579 HydrophobicContact CB-CG1 3.64Å; L556-I579 HydrophobicContact CD1-CG1 4.15Å; L556-I579 HydrophobicContact CG-CG1 4.49Å; L556-I582 HydrophobicContact CD1-CD1 3.53Å
557	K	91.7	Very high	90.7	Very high	32 Å²	32	56.8 Å²	56.8	14%	0.139	29%	0.294	C	S	.	.	H	α-helix	trans	-57.2	-42.8	172.6	-70.3	-164.7	-57.3	-176.1	0	111.3	M553 I559 V560 E561 D594 D597 V598 L601	M553-K557 WeakPolarHBondContact O-CG 3.39Å; M553-K557 PolarHBondContact O-N 3.48Å; M553-K557 HydrophobicContact SD-CG 4.34Å; K557-I559 VanDerWaalsContact C-N 3.33Å; K557-I559 PolarHBondContact O-N 3.24Å; K557-V560 PolarHBondContact O-N 3.44Å; K557-E561 WeakPolarHBondContact O-CG 3.39Å; K557-E561 PolarHBondContact O-N 3.38Å; K557-E561 VanDerWaalsContact O-N 3.1Å; K557-D594 IonicContact NZ-OD1 3.53Å; K557-D594 PolarHBondContact NZ-OD1 3.19Å; K557-D597 HydrophobicContact CD-CB 4.45Å; K557-D597 IonicContact NZ-OD2 3.94Å; K557-D597 PolarHBondContact NZ-OD2 3.23Å; K557-V598 HydrophobicContact CD-CG2 4.08Å; K557-V598 HydrophobicContact CG-CG2 4.34Å; K557-L601 HydrophobicContact CB-CD1 4.22Å; K557-L601 HydrophobicContact CD-CD1 4.43Å; K557-L601 HydrophobicContact CG-CD1 4.22Å
558	H	90.1	Very high	90.3	Very high	80 Å²	80	52.8 Å²	52.8	37%	0.37	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-38.9	176.7	-167.9	66	0	0	0	112.6	P554 S555 L556 E561 N562	P554-H558 PolarHBondContact O-N 2.77Å; P554-H558 VanDerWaalsContact O-N 3.11Å; S555-H558 WeakPolarHBondContact O-CB 3.41Å; S555-H558 PolarHBondContact O-N 3.33Å; L556-H558 VanDerWaalsContact C-N 3.27Å; L556-H558 PolarHBondContact O-N 3.34Å; H558-E561 PolarHBondContact O-N 3.48Å; H558-N562 PolarHBondContact CE1-ND2 3.44Å; H558-N562 PolarHBondContact ND1-ND2 3.21Å; H558-N562 PolarHBondContact NE2-ND2 2.77Å; H558-N562 PolarHBondContact O-N 3.01Å; H558-N562 PolarHBondContact O-ND2 3Å
559	I	90.8	Very high	89.7	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-49.1	175.6	-68.5	164.5	0	0	0	110.5	L515 L527 V531 S555 L556 K557 E561 N562 A563 L571 T575	L515-I559 HydrophobicContact CD1-CD1 4.36Å; L515-I559 HydrophobicContact CD1-CG1 3.66Å; L515-I559 HydrophobicContact CD2-CG1 4.25Å; L527-I559 HydrophobicContact CD1-CD1 4.49Å; L527-I559 HydrophobicContact CD2-CD1 4.47Å; V531-I559 HydrophobicContact CG2-CD1 4.43Å; S555-I559 WeakPolarHBondContact O-CG1 3.49Å; S555-I559 PolarHBondContact O-N 2.91Å; L556-I559 HydrophobicContact CD2-CD1 4.49Å; L556-I559 WeakPolarHBondContact O-CB 3.47Å; L556-I559 PolarHBondContact O-N 3.44Å; L556-I559 VanDerWaalsContact O-N 3.12Å; K557-I559 VanDerWaalsContact C-N 3.33Å; K557-I559 PolarHBondContact O-N 3.24Å; I559-E561 VanDerWaalsContact C-N 3.27Å; I559-E561 PolarHBondContact O-N 2.93Å; I559-N562 PolarHBondContact O-N 3.4Å; I559-N562 VanDerWaalsContact O-N 3.12Å; I559-A563 WeakPolarHBondContact O-CB 3.34Å; I559-A563 PolarHBondContact O-N 3.2Å; I559-L571 HydrophobicContact CG2-CD1 4.47Å; I559-L571 HydrophobicContact CG2-CD2 4.27Å; I559-L571 HydrophobicContact CG2-CG 4.15Å; I559-T575 HydrophobicContact CB-CG2 3.95Å; I559-T575 HydrophobicContact CG2-CG2 3.9Å; I559-T575 WeakPolarHBondContact CG2-OG1 3.19Å
560	V	88.4	Confident	89.3	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-33.7	-179.4	178.2	0	0	0	0	112.8	L556 K557 R572 T575 I576 I579 L601 T605	L556-V560 PolarHBondContact O-N 3.27Å; L556-V560 VanDerWaalsContact O-N 3.13Å; K557-V560 PolarHBondContact O-N 3.44Å; V560-R572 HydrophobicContact CG1-CG 4.24Å; V560-R572 PolarHBondContact O-NE 3.09Å; V560-R572 VanDerWaalsContact O-NE 3.07Å; V560-R572 PolarHBondContact O-NH2 2.72Å; V560-T575 HydrophobicContact CG2-CG2 3.6Å; V560-I576 HydrophobicContact CG1-CD1 4.4Å; V560-I576 HydrophobicContact CG1-CG1 4.21Å; V560-I576 HydrophobicContact CG2-CG1 4.02Å; V560-I579 HydrophobicContact CG2-CD1 3.84Å; V560-L601 HydrophobicContact CG1-CB 4.36Å; V560-T605 HydrophobicContact CG1-CG2 4.45Å
561	E	86.6	Confident	89.1	Confident	111 Å²	111	51.4 Å²	51.4	52%	0.519	26%	0.258	S	S	.	.	H	α-helix	trans	-69.8	-32.8	176.5	-74.7	176.7	167.2	0	0	113.3	K557 H558 I559 L601	K557-E561 WeakPolarHBondContact O-CG 3.39Å; K557-E561 PolarHBondContact O-N 3.38Å; K557-E561 VanDerWaalsContact O-N 3.1Å; H558-E561 PolarHBondContact O-N 3.48Å; I559-E561 VanDerWaalsContact C-N 3.27Å; I559-E561 PolarHBondContact O-N 2.93Å; E561-L601 HydrophobicContact CG-CD1 4.47Å; E561-L601 HydrophobicContact CG-CD2 3.49Å; E561-L601 VanDerWaalsContact CG-CD2 3.49Å
562	N	83.8	Confident	88.8	Confident	88 Å²	88	49.3 Å²	49.3	47%	0.471	25%	0.246	S	C	.	.	H	α-helix	trans	-99	-25.9	-174.8	-71	-85.4	0	0	0	113.6	H558 I559 V564	H558-N562 PolarHBondContact CE1-ND2 3.44Å; H558-N562 PolarHBondContact ND1-ND2 3.21Å; H558-N562 PolarHBondContact NE2-ND2 2.77Å; H558-N562 PolarHBondContact O-N 3.01Å; H558-N562 PolarHBondContact O-ND2 3Å; I559-N562 PolarHBondContact O-N 3.4Å; I559-N562 VanDerWaalsContact O-N 3.12Å; N562-V564 PolarHBondContact O-N 3.03Å
563	A	85.3	Confident	88.5	Confident	2 Å²	2	49.3 Å²	49.3	2%	0.017	25%	0.247	C	C	.	.			trans	-78	60.5	178	0	0	0	0	0	112	I559 L568 R572	I559-A563 WeakPolarHBondContact O-CB 3.34Å; I559-A563 PolarHBondContact O-N 3.2Å; A563-L568 HydrophobicContact CB-CB 3.89Å; A563-L568 HydrophobicContact CB-CD1 4.28Å; A563-R572 HydrophobicContact CB-CB 4Å; A563-R572 HydrophobicContact CB-CG 4.28Å; A563-R572 VanDerWaalsContact O-CD 3.23Å; A563-R572 WeakPolarHBondContact O-CD 3.48Å; A563-R572 PolarHBondContact O-NE 3.06Å
564	V	82.8	Confident	88.4	Confident	100 Å²	100	50.4 Å²	50.4	61%	0.606	25%	0.251	S	S	*	.			trans	-97.4	-10.8	-179.2	-63	0	0	0	0	113.7	N562	N562-V564 PolarHBondContact O-N 3.03Å
565	Q	84	Confident	88.4	Confident	115 Å²	115	46.8 Å²	46.8	54%	0.537	23%	0.228	S	C	.	.	S	Bend	trans	-76.3	153.2	-179.2	-61.5	172.3	-9.5	0	0	110.3	E567 L568	Q565-E567 VanDerWaalsContact C-N 3.25Å; Q565-E567 WeakPolarHBondContact CB-OE2 3.23Å; Q565-E567 PolarHBondContact O-N 2.84Å; Q565-L568 HydrophobicContact CB-CD1 4.33Å; Q565-L568 HydrophobicContact CB-CG 4.32Å; Q565-L568 PolarHBondContact O-N 2.8Å; Q565-L568 VanDerWaalsContact O-N 3.11Å
566	K	82.5	Confident	88.3	Confident	130 Å²	130	45.8 Å²	45.8	57%	0.565	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-61.4	-38.7	-176.3	-73.7	-163.9	172	-164	0	111.5	L568 R569	K566-L568 PolarHBondContact O-N 3.5Å; K566-R569 WeakPolarHBondContact O-CB 3.39Å; K566-R569 WeakPolarHBondContact O-CD 3.33Å; K566-R569 VanDerWaalsContact O-CG 3.25Å; K566-R569 WeakPolarHBondContact O-CG 3.48Å; K566-R569 PolarHBondContact O-N 3.05Å
567	E	83.8	Confident	88.3	Confident	123 Å²	123	47.3 Å²	47.3	58%	0.575	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-67	-15.7	-179.3	-52.8	78.2	-171.8	0	0	112.7	K524 Q565	K524-E567 WeakPolarHBondContact CD-O 3.46Å; K524-E567 VanDerWaalsContact CE-O 3.23Å; K524-E567 WeakPolarHBondContact CE-O 3.39Å; Q565-E567 VanDerWaalsContact C-N 3.25Å; Q565-E567 WeakPolarHBondContact CB-OE2 3.23Å; Q565-E567 PolarHBondContact O-N 2.84Å
568	L	87.8	Confident	88.5	Confident	13 Å²	13	45.8 Å²	45.8	7%	0.068	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-107.2	7.8	-179	-57.5	-179.2	0	0	0	113.1	L518 K524 A563 Q565 K566 L570 L571 R572	L518-L568 HydrophobicContact CD1-CD1 4.5Å; L518-L568 HydrophobicContact CD1-CD2 3.8Å; K524-L568 HydrophobicContact CB-CD2 4.24Å; K524-L568 HydrophobicContact CD-CD2 4.03Å; A563-L568 HydrophobicContact CB-CB 3.89Å; A563-L568 HydrophobicContact CB-CD1 4.28Å; Q565-L568 HydrophobicContact CB-CD1 4.33Å; Q565-L568 HydrophobicContact CB-CG 4.32Å; Q565-L568 PolarHBondContact O-N 2.8Å; Q565-L568 VanDerWaalsContact O-N 3.11Å; K566-L568 PolarHBondContact O-N 3.5Å; L568-L570 PolarHBondContact O-N 3.48Å; L568-L571 HydrophobicContact CD2-CD2 4.37Å; L568-L571 PolarHBondContact O-N 3.36Å; L568-R572 WeakPolarHBondContact O-CB 3.02Å; L568-R572 PolarHBondContact O-N 2.93Å
569	R	86.1	Confident	88.7	Confident	54 Å²	54	42.1 Å²	42.1	20%	0.204	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-43.2	-177.8	-77.3	171	173.7	-176	-13.4	112.5	K566 R572 G573 D616	K566-R569 WeakPolarHBondContact O-CB 3.39Å; K566-R569 WeakPolarHBondContact O-CD 3.33Å; K566-R569 VanDerWaalsContact O-CG 3.25Å; K566-R569 WeakPolarHBondContact O-CG 3.48Å; K566-R569 PolarHBondContact O-N 3.05Å; R569-R572 WeakPolarHBondContact O-CB 3.48Å; R569-R572 PolarHBondContact O-N 2.97Å; R569-G573 PolarHBondContact O-N 3.18Å; R569-D616 IonicContact CZ-OD2 3.43Å; R569-D616 IonicContact NE-OD2 2.87Å; R569-D616 PolarHBondContact NE-OD2 2.88Å; R569-D616 IonicContact NH1-OD2 2.87Å; R569-D616 PolarHBondContact NH1-OD2 2.71Å; R569-D616 IonicContact NH2-OD2 3.67Å
570	L	87.5	Confident	88.9	Confident	60 Å²	60	42 Å²	42	31%	0.314	20%	0.203	S	C	.	.	H	α-helix	trans	-62.9	-50.6	177	-177.8	60.3	0	0	0	111.6	L568 R572 G573 K574 Y621	L568-L570 PolarHBondContact O-N 3.48Å; L570-R572 VanDerWaalsContact C-N 3.26Å; L570-R572 PolarHBondContact O-N 3.33Å; L570-G573 PolarHBondContact O-N 3.2Å; L570-G573 VanDerWaalsContact O-N 3.12Å; L570-K574 HydrophobicContact CD1-CD 4.41Å; L570-K574 HydrophobicContact CD1-CG 4.4Å; L570-K574 HydrophobicContact CG-CD 4.32Å; L570-K574 PolarHBondContact O-N 2.96Å; L570-Y621 HydrophobicContact CD1-CE2 3.66Å
571	L	90.9	Very high	89.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-52.5	-44.7	172.6	175.7	62.8	0	0	0	112	L518 L527 E528 I559 L568 T575	L518-L571 HydrophobicContact CD1-CD2 4.42Å; L518-L571 HydrophobicContact CD2-CD2 3.7Å; L527-L571 HydrophobicContact CB-CD1 4.43Å; L527-L571 HydrophobicContact CD2-CD1 4.14Å; L527-L571 HydrophobicContact CD2-CD2 4Å; L527-L571 HydrophobicContact CG-CD1 3.95Å; E528-L571 HydrophobicContact CB-CD1 4.49Å; E528-L571 HydrophobicContact CG-CB 3.78Å; E528-L571 HydrophobicContact CG-CD1 3.76Å; E528-L571 HydrophobicContact CG-CG 4.33Å; E528-L571 PolarHBondContact OE1-N 3.44Å; I559-L571 HydrophobicContact CG2-CD1 4.47Å; I559-L571 HydrophobicContact CG2-CD2 4.27Å; I559-L571 HydrophobicContact CG2-CG 4.15Å; L568-L571 HydrophobicContact CD2-CD2 4.37Å; L568-L571 PolarHBondContact O-N 3.36Å; L571-T575 WeakPolarHBondContact O-CB 3.47Å; L571-T575 PolarHBondContact O-N 3.24Å; L571-T575 PolarHBondContact O-OG1 2.87Å
572	R	90	Very high	89.7	Confident	19 Å²	19	37.6 Å²	37.6	7%	0.072	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-46.4	177.9	-164.2	-171.4	-149.8	-177.9	3.9	111.6	V560 A563 L568 R569 L570 T575 I576 T605	V560-R572 HydrophobicContact CG1-CG 4.24Å; V560-R572 PolarHBondContact O-NE 3.09Å; V560-R572 VanDerWaalsContact O-NE 3.07Å; V560-R572 PolarHBondContact O-NH2 2.72Å; A563-R572 HydrophobicContact CB-CB 4Å; A563-R572 HydrophobicContact CB-CG 4.28Å; A563-R572 VanDerWaalsContact O-CD 3.23Å; A563-R572 WeakPolarHBondContact O-CD 3.48Å; A563-R572 PolarHBondContact O-NE 3.06Å; L568-R572 WeakPolarHBondContact O-CB 3.02Å; L568-R572 PolarHBondContact O-N 2.93Å; R569-R572 WeakPolarHBondContact O-CB 3.48Å; R569-R572 PolarHBondContact O-N 2.97Å; L570-R572 VanDerWaalsContact C-N 3.26Å; L570-R572 PolarHBondContact O-N 3.33Å; R572-T575 PolarHBondContact O-N 2.93Å; R572-I576 HydrophobicContact CG-CD1 4.22Å; R572-I576 WeakPolarHBondContact O-CG1 3.48Å; R572-I576 PolarHBondContact O-N 3.4Å; R572-T605 VanDerWaalsContact NH2-CG2 3.29Å
573	G	89.6	Confident	90.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-57.8	-52.7	176.2	0	0	0	0	0	112.3	R569 L570 T575 I576 E577	R569-G573 PolarHBondContact O-N 3.18Å; L570-G573 PolarHBondContact O-N 3.2Å; L570-G573 VanDerWaalsContact O-N 3.12Å; G573-T575 VanDerWaalsContact C-N 3.26Å; G573-T575 PolarHBondContact O-N 2.87Å; G573-I576 WeakPolarHBondContact O-CB 3.23Å; G573-I576 PolarHBondContact O-N 2.8Å; G573-I576 VanDerWaalsContact O-N 3.1Å; G573-E577 PolarHBondContact O-N 2.88Å
574	K	92.6	Very high	90.6	Very high	23 Å²	23	35.6 Å²	35.6	10%	0.1	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-36.4	175.6	-71.4	-177.3	166.6	-161.7	0	112.9	E528 V531 T532 L570 E577 C578 Y621	E528-K574 HydrophobicContact CB-CD 4.09Å; V531-K574 HydrophobicContact CG1-CB 4.5Å; T532-K574 WeakPolarHBondContact OG1-CD 3.48Å; L570-K574 HydrophobicContact CD1-CD 4.41Å; L570-K574 HydrophobicContact CD1-CG 4.4Å; L570-K574 HydrophobicContact CG-CD 4.32Å; L570-K574 PolarHBondContact O-N 2.96Å; K574-E577 PolarHBondContact O-N 3.27Å; K574-C578 WeakPolarHBondContact O-CB 3.49Å; K574-C578 PolarHBondContact O-N 3.34Å; K574-Y621 WeakPolarHBondContact CE-OH 3.29Å; K574-Y621 HydrophobicContact CG-CE1 4.05Å; K574-Y621 HydrophobicContact CG-CE2 4.37Å
575	T	94	Very high	91.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.6	-41	176.1	-53	0	0	0	0	112	L556 I559 V560 L571 R572 G573 E577 C578 I579	L556-T575 HydrophobicContact CB-CG2 4.03Å; L556-T575 HydrophobicContact CD2-CG2 3.86Å; L556-T575 WeakPolarHBondContact O-CG2 3.46Å; I559-T575 HydrophobicContact CB-CG2 3.95Å; I559-T575 HydrophobicContact CG2-CG2 3.9Å; I559-T575 WeakPolarHBondContact CG2-OG1 3.19Å; V560-T575 HydrophobicContact CG2-CG2 3.6Å; L571-T575 WeakPolarHBondContact O-CB 3.47Å; L571-T575 PolarHBondContact O-N 3.24Å; L571-T575 PolarHBondContact O-OG1 2.87Å; R572-T575 PolarHBondContact O-N 2.93Å; G573-T575 VanDerWaalsContact C-N 3.26Å; G573-T575 PolarHBondContact O-N 2.87Å; T575-E577 VanDerWaalsContact C-N 3.32Å; T575-C578 PolarHBondContact O-N 3.05Å; T575-I579 HydrophobicContact CG2-CD1 4.29Å; T575-I579 VanDerWaalsContact O-CG1 3.31Å; T575-I579 WeakPolarHBondContact O-CG1 3.47Å; T575-I579 PolarHBondContact O-N 3.19Å
576	I	92	Very high	91.7	Very high	6 Å²	6	26.6 Å²	26.6	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-45.1	173.9	-78.7	166.3	0	0	0	110.4	V560 R572 G573 I579 S580 L602 T605 M622 A625	V560-I576 HydrophobicContact CG1-CD1 4.4Å; V560-I576 HydrophobicContact CG1-CG1 4.21Å; V560-I576 HydrophobicContact CG2-CG1 4.02Å; R572-I576 HydrophobicContact CG-CD1 4.22Å; R572-I576 WeakPolarHBondContact O-CG1 3.48Å; R572-I576 PolarHBondContact O-N 3.4Å; G573-I576 WeakPolarHBondContact O-CB 3.23Å; G573-I576 PolarHBondContact O-N 2.8Å; G573-I576 VanDerWaalsContact O-N 3.1Å; I576-I579 PolarHBondContact O-N 3.16Å; I576-S580 WeakPolarHBondContact O-CB 3.47Å; I576-S580 PolarHBondContact O-N 3.3Å; I576-S580 PolarHBondContact O-OG 3.47Å; I576-L602 HydrophobicContact CB-CD2 4.17Å; I576-L602 HydrophobicContact CD1-CD2 3.79Å; I576-L602 HydrophobicContact CG1-CD2 3.73Å; I576-L602 HydrophobicContact CG2-CD2 3.43Å; I576-L602 VanDerWaalsContact CG2-CD2 3.43Å; I576-T605 HydrophobicContact CD1-CG2 4.49Å; I576-M622 HydrophobicContact CD1-CG 4.3Å; I576-A625 HydrophobicContact CG2-CB 3.36Å
577	E	93.2	Very high	92.2	Very high	32 Å²	32	21.7 Å²	21.7	15%	0.15	11%	0.113	C	C	.	.	H	α-helix	trans	-58	-51.6	174	167.2	159.2	-98.8	0	0	111.5	G573 K574 T575 I579 S580 L581 Y621 R628	G573-E577 PolarHBondContact O-N 2.88Å; K574-E577 PolarHBondContact O-N 3.27Å; T575-E577 VanDerWaalsContact C-N 3.32Å; E577-I579 VanDerWaalsContact C-N 3.33Å; E577-I579 PolarHBondContact O-N 3.06Å; E577-S580 WeakPolarHBondContact CA-OG 2.99Å; E577-S580 PolarHBondContact O-N 2.84Å; E577-S580 PolarHBondContact O-OG 2.68Å; E577-L581 HydrophobicContact CG-CD1 3.65Å; E577-L581 HydrophobicContact CG-CG 4.34Å; E577-L581 PolarHBondContact O-N 3.01Å; E577-Y621 HydrophobicContact CB-CD1 3.92Å; E577-Y621 VanDerWaalsContact OE2-CE1 3.32Å; E577-Y621 WeakPolarHBondContact OE2-CE1 3.4Å; E577-R628 IonicContact OE1-CZ 2.67Å; E577-R628 IonicContact OE1-NH1 3.62Å; E577-R628 PolarHBondContact OE1-NH1 2.93Å; E577-R628 VanDerWaalsContact OE1-NH1 3.11Å; E577-R628 IonicContact OE1-NH2 3.87Å; E577-R628 PolarHBondContact OE1-NH2 3.26Å
578	C	96	Very high	92.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-54.6	-46.6	177.7	-174.2	0	0	0	0	112.4	V531 A535 K574 T575 S580 L581 I582	V531-C578 HydrophobicContact CG1-CB 3.62Å; V531-C578 PolarHBondContact O-SG 3.05Å; A535-C578 HydrophobicContact CB-CB 3.83Å; K574-C578 WeakPolarHBondContact O-CB 3.49Å; K574-C578 PolarHBondContact O-N 3.34Å; T575-C578 PolarHBondContact O-N 3.05Å; C578-S580 VanDerWaalsContact C-N 3.33Å; C578-S580 PolarHBondContact O-N 3.36Å; C578-L581 PolarHBondContact O-N 3.28Å; C578-I582 WeakPolarHBondContact O-CB 2.79Å; C578-I582 VanDerWaalsContact O-CG1 3.26Å; C578-I582 WeakPolarHBondContact O-CG1 3.3Å; C578-I582 PolarHBondContact O-N 3.44Å
579	I	95.8	Very high	92.8	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-58.9	-45.9	176.2	-70.4	167.9	0	0	0	110.9	M553 L556 V560 T575 I576 E577 G583 F591 V598	M553-I579 HydrophobicContact CE-CG2 4.11Å; M553-I579 HydrophobicContact SD-CB 4.47Å; M553-I579 HydrophobicContact SD-CG1 4.13Å; M553-I579 HydrophobicContact SD-CG2 3.85Å; L556-I579 HydrophobicContact CB-CD1 3.93Å; L556-I579 HydrophobicContact CB-CG1 3.64Å; L556-I579 HydrophobicContact CD1-CG1 4.15Å; L556-I579 HydrophobicContact CG-CG1 4.49Å; V560-I579 HydrophobicContact CG2-CD1 3.84Å; T575-I579 HydrophobicContact CG2-CD1 4.29Å; T575-I579 VanDerWaalsContact O-CG1 3.31Å; T575-I579 WeakPolarHBondContact O-CG1 3.47Å; T575-I579 PolarHBondContact O-N 3.19Å; I576-I579 PolarHBondContact O-N 3.16Å; E577-I579 VanDerWaalsContact C-N 3.33Å; E577-I579 PolarHBondContact O-N 3.06Å; I579-G583 PolarHBondContact O-N 3.41Å; I579-F591 HydrophobicContact CG2-CE2 4.39Å; I579-V598 HydrophobicContact CG2-CB 4.34Å; I579-V598 HydrophobicContact CG2-CG1 3.56Å; I579-V598 HydrophobicContact CG2-CG2 3.78Å
580	S	93.6	Very high	93.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.3	-38.3	-177.7	70.3	0	0	0	0	113.1	I576 E577 C578 G583 L584 R628	I576-S580 WeakPolarHBondContact O-CB 3.47Å; I576-S580 PolarHBondContact O-N 3.3Å; I576-S580 PolarHBondContact O-OG 3.47Å; E577-S580 WeakPolarHBondContact CA-OG 2.99Å; E577-S580 PolarHBondContact O-N 2.84Å; E577-S580 PolarHBondContact O-OG 2.68Å; C578-S580 VanDerWaalsContact C-N 3.33Å; C578-S580 PolarHBondContact O-N 3.36Å; S580-G583 PolarHBondContact O-N 2.85Å; S580-L584 PolarHBondContact O-N 3.45Å; S580-R628 VanDerWaalsContact OG-CD 3.27Å; S580-R628 WeakPolarHBondContact OG-CD 3.48Å; S580-R628 PolarHBondContact OG-NH1 3.3Å
581	L	95.1	Very high	93.5	Very high	19 Å²	19	23.9 Å²	23.9	10%	0.099	12%	0.121	C	C	.	.	H	α-helix	trans	-69.9	-42.8	175.8	-75.7	169.7	0	0	0	111.8	A535 D539 E577 C578 G583 L584 A585	A535-L581 HydrophobicContact CB-CD1 3.89Å; D539-L581 HydrophobicContact CB-CD2 4.33Å; E577-L581 HydrophobicContact CG-CD1 3.65Å; E577-L581 HydrophobicContact CG-CG 4.34Å; E577-L581 PolarHBondContact O-N 3.01Å; C578-L581 PolarHBondContact O-N 3.28Å; L581-G583 VanDerWaalsContact C-N 3.28Å; L581-G583 PolarHBondContact O-N 3.06Å; L581-L584 WeakPolarHBondContact O-CB 3.43Å; L581-L584 PolarHBondContact O-N 3.08Å; L581-L584 VanDerWaalsContact O-N 3.14Å; L581-A585 WeakPolarHBondContact O-CB 3.42Å; L581-A585 PolarHBondContact O-N 2.8Å
582	I	96.9	Very high	93.4	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-57.3	-45.4	171.2	-71.1	169	0	0	0	110.2	I534 A538 F545 Y549 F552 M553 L556 C578 L584 A585 V586	I534-I582 HydrophobicContact CG2-CD1 4.17Å; A538-I582 HydrophobicContact CB-CB 4.49Å; A538-I582 HydrophobicContact CB-CG1 3.59Å; F545-I582 HydrophobicContact CD1-CG1 4.38Å; F545-I582 HydrophobicContact CD1-CG2 4.17Å; F545-I582 HydrophobicContact CE1-CD1 4.08Å; F545-I582 HydrophobicContact CE1-CG1 3.83Å; F545-I582 HydrophobicContact CE1-CG2 4.07Å; Y549-I582 HydrophobicContact CD2-CG2 3.58Å; Y549-I582 HydrophobicContact CE2-CG2 3.95Å; F552-I582 HydrophobicContact CB-CD1 4.45Å; M553-I582 HydrophobicContact CE-CB 4.17Å; M553-I582 HydrophobicContact CE-CG2 3.72Å; L556-I582 HydrophobicContact CD1-CD1 3.53Å; C578-I582 WeakPolarHBondContact O-CB 2.79Å; C578-I582 VanDerWaalsContact O-CG1 3.26Å; C578-I582 WeakPolarHBondContact O-CG1 3.3Å; C578-I582 PolarHBondContact O-N 3.44Å; I582-L584 VanDerWaalsContact C-N 3.29Å; I582-L584 PolarHBondContact O-N 3.13Å; I582-A585 PolarHBondContact O-N 3.48Å; I582-V586 HydrophobicContact CG2-CG1 4.45Å; I582-V586 WeakPolarHBondContact O-CG1 3.21Å; I582-V586 VanDerWaalsContact O-CG2 3.31Å; I582-V586 WeakPolarHBondContact O-CG2 3.47Å; I582-V586 PolarHBondContact O-N 3.45Å
583	G	95.1	Very high	93.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.2	-38.1	177.4	0	0	0	0	0	113.1	I579 S580 L581 G587 I632	I579-G583 PolarHBondContact O-N 3.41Å; S580-G583 PolarHBondContact O-N 2.85Å; L581-G583 VanDerWaalsContact C-N 3.28Å; L581-G583 PolarHBondContact O-N 3.06Å; G583-G587 PolarHBondContact O-N 3.12Å; G583-I632 VanDerWaalsContact C-CD1 3.45Å
584	L	93.7	Very high	93.5	Very high	47 Å²	47	34.1 Å²	34.1	25%	0.246	17%	0.171	C	C	.	.	H	α-helix	trans	-68	-47.9	176.8	-172.5	64.2	0	0	0	111.3	S580 L581 I582 V586 G587 R628 K631 I632	S580-L584 PolarHBondContact O-N 3.45Å; L581-L584 WeakPolarHBondContact O-CB 3.43Å; L581-L584 PolarHBondContact O-N 3.08Å; L581-L584 VanDerWaalsContact O-N 3.14Å; I582-L584 VanDerWaalsContact C-N 3.29Å; I582-L584 PolarHBondContact O-N 3.13Å; L584-V586 PolarHBondContact O-N 3.22Å; L584-G587 PolarHBondContact O-N 3.37Å; L584-R628 HydrophobicContact CD2-CG 4.45Å; L584-K631 HydrophobicContact CD1-CB 4.3Å; L584-K631 HydrophobicContact CD1-CD 3.98Å; L584-K631 HydrophobicContact CD1-CG 4.11Å; L584-I632 HydrophobicContact CB-CD1 4.11Å; L584-I632 HydrophobicContact CB-CG1 4.18Å; L584-I632 HydrophobicContact CD1-CG1 3.79Å
585	A	94	Very high	93.1	Very high	12 Å²	12	33.2 Å²	33.2	10%	0.099	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-45.5	-179.8	0	0	0	0	0	113.2	A538 E542 E543 L581 I582 G587	A538-A585 WeakPolarHBondContact O-CB 3.49Å; E542-A585 CarbonylContact C-O 3.16Å; E543-A585 PolarHBondContact N-O 3.21Å; L581-A585 WeakPolarHBondContact O-CB 3.42Å; L581-A585 PolarHBondContact O-N 2.8Å; I582-A585 PolarHBondContact O-N 3.48Å; A585-G587 VanDerWaalsContact C-N 3.26Å; A585-G587 PolarHBondContact O-N 3.42Å
586	V	95.6	Very high	92.6	Very high	15 Å²	15	36.1 Å²	36.1	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-78.8	-12.1	-179.1	-56.9	0	0	0	0	113.6	F545 V546 Y549 I582 L584 K590 F591	F545-V586 HydrophobicContact CB-CG1 4.5Å; F545-V586 HydrophobicContact CD1-CG1 4.41Å; V546-V586 HydrophobicContact CB-CG1 4.48Å; V546-V586 HydrophobicContact CG2-CB 3.82Å; V546-V586 HydrophobicContact CG2-CG1 3.97Å; Y549-V586 HydrophobicContact CD2-CB 4.36Å; Y549-V586 HydrophobicContact CD2-CG1 3.91Å; Y549-V586 HydrophobicContact CD2-CG2 3.78Å; Y549-V586 HydrophobicContact CE2-CG2 3.93Å; I582-V586 HydrophobicContact CG2-CG1 4.45Å; I582-V586 WeakPolarHBondContact O-CG1 3.21Å; I582-V586 VanDerWaalsContact O-CG2 3.31Å; I582-V586 WeakPolarHBondContact O-CG2 3.47Å; I582-V586 PolarHBondContact O-N 3.45Å; L584-V586 PolarHBondContact O-N 3.22Å; V586-K590 HydrophobicContact CB-CB 4.04Å; V586-K590 HydrophobicContact CB-CG 4.06Å; V586-K590 HydrophobicContact CG2-CB 3.87Å; V586-K590 HydrophobicContact CG2-CG 3.93Å; V586-F591 HydrophobicContact CG2-CB 4.19Å
587	G	93.3	Very high	92.4	Very high	27 Å²	27	39.5 Å²	39.5	28%	0.278	21%	0.207	S	C	.	.	H	α-helix	trans	74.4	169.9	-179	0	0	0	0	0	114.9	G583 L584 A585 E589 K590 F591	G583-G587 PolarHBondContact O-N 3.12Å; L584-G587 PolarHBondContact O-N 3.37Å; A585-G587 VanDerWaalsContact C-N 3.26Å; A585-G587 PolarHBondContact O-N 3.42Å; G587-E589 VanDerWaalsContact C-N 3.34Å; G587-E589 PolarHBondContact O-N 3.15Å; G587-K590 PolarHBondContact O-N 3.5Å; G587-F591 WeakPolarHBondContact O-CB 3.34Å; G587-F591 PolarHBondContact O-N 2.96Å; G587-F591 VanDerWaalsContact O-N 3.16Å
588	K	92.3	Very high	92.1	Very high	75 Å²	75	38.1 Å²	38.1	33%	0.326	20%	0.201	S	C	.	.	H	α-helix	trans	-53	-44.4	-173.1	-175.5	177	176.8	170	0	113.9	K590 F591 M592 I632 L633 E636	K588-K590 PolarHBondContact O-N 2.89Å; K588-F591 PolarHBondContact O-N 2.92Å; K588-M592 HydrophobicContact CD-CE 4.08Å; K588-M592 HydrophobicContact CG-CE 3.55Å; K588-M592 WeakPolarHBondContact O-CB 3.34Å; K588-M592 PolarHBondContact O-N 3.3Å; K588-I632 HydrophobicContact CB-CG2 4.25Å; K588-I632 WeakPolarHBondContact CB-O 3.37Å; K588-I632 WeakPolarHBondContact CD-O 3.44Å; K588-I632 WeakPolarHBondContact CG-O 3.46Å; K588-L633 PolarHBondContact NZ-O 3.32Å; K588-E636 IonicContact NZ-OE1 2.75Å; K588-E636 PolarHBondContact NZ-OE1 3Å; K588-E636 IonicContact NZ-OE2 2.67Å; K588-E636 PolarHBondContact NZ-OE2 2.67Å
589	E	92.4	Very high	91.4	Very high	185 Å²	185	38.2 Å²	38.2	86%	0.864	20%	0.201	S	C	*	.	H	α-helix	trans	-63.4	-44.8	-172.3	-172.5	179.1	179.8	0	0	112.3	G587	G587-E589 VanDerWaalsContact C-N 3.34Å; G587-E589 PolarHBondContact O-N 3.15Å
590	K	93.8	Very high	90.9	Very high	34 Å²	34	43.8 Å²	43.8	15%	0.148	23%	0.227	C	C	.	.	H	α-helix	trans	-74.9	-42.4	178.6	179.4	59	-179.6	163.7	0	111.4	V546 Y549 D550 V586 G587 K588 M592	V546-K590 HydrophobicContact CG1-CG 4.33Å; Y549-K590 HydrophobicContact CD1-CD 4.45Å; Y549-K590 HydrophobicContact CD1-CG 4.46Å; Y549-K590 HydrophobicContact CD2-CG 4.25Å; Y549-K590 HydrophobicContact CG-CG 4.16Å; D550-K590 IonicContact OD1-NZ 2.95Å; D550-K590 PolarHBondContact OD1-NZ 3.36Å; D550-K590 IonicContact OD2-NZ 2.64Å; D550-K590 PolarHBondContact OD2-NZ 3.12Å; V586-K590 HydrophobicContact CB-CB 4.04Å; V586-K590 HydrophobicContact CB-CG 4.06Å; V586-K590 HydrophobicContact CG2-CB 3.87Å; V586-K590 HydrophobicContact CG2-CG 3.93Å; G587-K590 PolarHBondContact O-N 3.5Å; K588-K590 PolarHBondContact O-N 2.89Å; K590-M592 VanDerWaalsContact C-N 3.3Å; K590-M592 PolarHBondContact O-N 2.81Å
591	F	94.8	Very high	90.4	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-26	-176.8	-174	-111.3	0	0	0	113.8	Y549 M553 I579 V586 G587 K588 Q593 D594 A595 V598 M629 I632	Y549-F591 HydrophobicContact CE2-CD2 4.13Å; M553-F591 HydrophobicContact CE-CE2 4.47Å; I579-F591 HydrophobicContact CG2-CE2 4.39Å; V586-F591 HydrophobicContact CG2-CB 4.19Å; G587-F591 WeakPolarHBondContact O-CB 3.34Å; G587-F591 PolarHBondContact O-N 2.96Å; G587-F591 VanDerWaalsContact O-N 3.16Å; K588-F591 PolarHBondContact O-N 2.92Å; F591-Q593 PolarHBondContact O-N 2.89Å; F591-D594 PolarHBondContact O-N 2.99Å; F591-A595 HydrophobicContact CD1-CB 3.79Å; F591-A595 HydrophobicContact CE1-CB 3.66Å; F591-A595 HydrophobicContact CZ-CB 4.44Å; F591-A595 PolarHBondContact O-N 3.42Å; F591-V598 HydrophobicContact CE2-CG2 4.42Å; F591-V598 HydrophobicContact CZ-CB 4.22Å; F591-V598 HydrophobicContact CZ-CG1 4.23Å; F591-V598 HydrophobicContact CZ-CG2 4.32Å; F591-M629 HydrophobicContact CE1-CE 4.1Å; F591-M629 HydrophobicContact CE1-SD 3.43Å; F591-M629 WeakPolarHBondContact CE1-SD 3.14Å; F591-M629 HydrophobicContact CZ-CE 3.61Å; F591-M629 HydrophobicContact CZ-SD 3.61Å; F591-I632 HydrophobicContact CB-CG2 4.4Å; F591-I632 HydrophobicContact CD1-CD1 4.38Å; F591-I632 HydrophobicContact CD1-CG2 3.85Å; F591-I632 HydrophobicContact CG-CG2 4.47Å
592	M	87.9	Confident	89.6	Confident	78 Å²	78	44.1 Å²	44.1	38%	0.384	23%	0.229	S	C	.	.	H	α-helix	trans	-55.9	-24.1	-177.9	-161.4	61.1	64.2	0	0	114.2	K588 K590 D594 A595 L633	K588-M592 HydrophobicContact CD-CE 4.08Å; K588-M592 HydrophobicContact CG-CE 3.55Å; K588-M592 WeakPolarHBondContact O-CB 3.34Å; K588-M592 PolarHBondContact O-N 3.3Å; K590-M592 VanDerWaalsContact C-N 3.3Å; K590-M592 PolarHBondContact O-N 2.81Å; M592-D594 VanDerWaalsContact C-N 3.29Å; M592-D594 PolarHBondContact O-N 2.93Å; M592-A595 HydrophobicContact SD-CB 4.34Å; M592-L633 HydrophobicContact CE-CD2 3.9Å; M592-L633 HydrophobicContact SD-CD2 4.23Å
593	Q	89.8	Confident	88.7	Confident	131 Å²	131	46 Å²	46	61%	0.612	24%	0.239	S	C	*	.	H	α-helix	trans	-63.2	-34.4	178.5	-62.8	179.2	-6.7	0	0	112.6	F591	F591-Q593 PolarHBondContact O-N 2.89Å
594	D	90.9	Very high	87.9	Confident	26 Å²	26	52.9 Å²	52.9	14%	0.139	27%	0.268	C	S	.	.	H	α-helix	trans	-115.3	-7.9	-179.5	-63.5	-70.6	0	0	0	113.3	Y549 M553 K557 F591 M592 S596 D597 V598	Y549-D594 WeakPolarHBondContact CE1-OD2 3.39Å; Y549-D594 WeakPolarHBondContact OH-CB 3.49Å; Y549-D594 PolarHBondContact OH-OD2 2.91Å; M553-D594 HydrophobicContact CG-CB 4.4Å; K557-D594 IonicContact NZ-OD1 3.53Å; K557-D594 PolarHBondContact NZ-OD1 3.19Å; F591-D594 PolarHBondContact O-N 2.99Å; M592-D594 VanDerWaalsContact C-N 3.29Å; M592-D594 PolarHBondContact O-N 2.93Å; D594-S596 VanDerWaalsContact C-N 3.28Å; D594-S596 PolarHBondContact O-N 3.2Å; D594-D597 PolarHBondContact O-N 3.14Å; D594-V598 HydrophobicContact CB-CG2 4.28Å; D594-V598 WeakPolarHBondContact O-CG2 3.39Å; D594-V598 PolarHBondContact O-N 3.4Å
595	A	85.2	Confident	86.9	Confident	4 Å²	4	50.6 Å²	50.6	3%	0.033	26%	0.257	C	S	.	.	H	α-helix	trans	-51.9	-45.1	-175.3	0	0	0	0	0	112.5	F591 M592 D597 V598 M599	F591-A595 HydrophobicContact CD1-CB 3.79Å; F591-A595 HydrophobicContact CE1-CB 3.66Å; F591-A595 HydrophobicContact CZ-CB 4.44Å; F591-A595 PolarHBondContact O-N 3.42Å; M592-A595 HydrophobicContact SD-CB 4.34Å; A595-D597 PolarHBondContact O-N 3Å; A595-V598 PolarHBondContact O-N 2.91Å; A595-M599 VanDerWaalsContact O-CB 3.26Å; A595-M599 WeakPolarHBondContact O-CB 3.47Å; A595-M599 WeakPolarHBondContact O-CG 3.33Å; A595-M599 PolarHBondContact O-N 3.22Å
596	S	83.9	Confident	85.6	Confident	61 Å²	61	50.6 Å²	50.6	43%	0.427	26%	0.255	S	S	.	.	H	α-helix	trans	-62.9	-42	178.3	-179.8	0	0	0	0	112.7	D594 Q600	D594-S596 VanDerWaalsContact C-N 3.28Å; D594-S596 PolarHBondContact O-N 3.2Å; S596-Q600 VanDerWaalsContact O-CG 3.3Å; S596-Q600 WeakPolarHBondContact O-CG 3.24Å; S596-Q600 PolarHBondContact O-N 3.14Å
597	D	87.2	Confident	84.2	Confident	77 Å²	77	54.7 Å²	54.7	41%	0.412	28%	0.279	S	S	.	.	H	α-helix	trans	-67.9	-46	-179.5	-67.6	-5.9	0	0	0	110.4	K557 D594 A595 Q600 L601	K557-D597 HydrophobicContact CD-CB 4.45Å; K557-D597 IonicContact NZ-OD2 3.94Å; K557-D597 PolarHBondContact NZ-OD2 3.23Å; D594-D597 PolarHBondContact O-N 3.14Å; A595-D597 PolarHBondContact O-N 3Å; D597-Q600 PolarHBondContact O-N 3.07Å; D597-L601 WeakPolarHBondContact O-CG 3.41Å; D597-L601 PolarHBondContact O-N 2.93Å
598	V	86.4	Confident	82.7	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.024	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-44.9	178.1	174.7	0	0	0	0	110.7	K557 I579 F591 D594 A595 Q600 L601 L602 M629	K557-V598 HydrophobicContact CD-CG2 4.08Å; K557-V598 HydrophobicContact CG-CG2 4.34Å; I579-V598 HydrophobicContact CG2-CB 4.34Å; I579-V598 HydrophobicContact CG2-CG1 3.56Å; I579-V598 HydrophobicContact CG2-CG2 3.78Å; F591-V598 HydrophobicContact CE2-CG2 4.42Å; F591-V598 HydrophobicContact CZ-CB 4.22Å; F591-V598 HydrophobicContact CZ-CG1 4.23Å; F591-V598 HydrophobicContact CZ-CG2 4.32Å; D594-V598 HydrophobicContact CB-CG2 4.28Å; D594-V598 WeakPolarHBondContact O-CG2 3.39Å; D594-V598 PolarHBondContact O-N 3.4Å; A595-V598 PolarHBondContact O-N 2.91Å; V598-Q600 VanDerWaalsContact C-N 3.31Å; V598-Q600 PolarHBondContact O-N 2.83Å; V598-L601 WeakPolarHBondContact O-CB 3.41Å; V598-L601 PolarHBondContact O-N 3.03Å; V598-L601 VanDerWaalsContact O-N 3.14Å; V598-L602 HydrophobicContact CG1-CD1 4.24Å; V598-L602 HydrophobicContact CG1-CG 4.47Å; V598-L602 WeakPolarHBondContact O-CG 3.43Å; V598-L602 PolarHBondContact O-N 2.88Å; V598-M629 HydrophobicContact CG1-CE 3.55Å
599	M	82.6	Confident	80.9	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-40.6	176	-70	-66.9	-70.4	0	0	111.2	A595 L602 L603 W626 M629 L633 F637 Y640	A595-M599 VanDerWaalsContact O-CB 3.26Å; A595-M599 WeakPolarHBondContact O-CB 3.47Å; A595-M599 WeakPolarHBondContact O-CG 3.33Å; A595-M599 PolarHBondContact O-N 3.22Å; M599-L602 PolarHBondContact O-N 2.87Å; M599-L602 HydrophobicContact SD-CD1 4.47Å; M599-L603 WeakPolarHBondContact O-CB 3.27Å; M599-L603 WeakPolarHBondContact O-CG 3.31Å; M599-L603 PolarHBondContact O-N 3.11Å; M599-W626 HydrophobicContact CE-CE3 3.95Å; M599-W626 HydrophobicContact CE-CH2 4.37Å; M599-W626 HydrophobicContact CE-CZ3 3.35Å; M599-W626 HydrophobicContact SD-CE3 4.08Å; M599-W626 HydrophobicContact SD-CZ3 3.54Å; M599-W626 VanDerWaalsContact SD-CZ3 3.54Å; M599-M629 HydrophobicContact SD-CB 3.92Å; M599-M629 HydrophobicContact SD-CG 3.73Å; M599-M629 HydrophobicContact SD-SD 4.2Å; M599-L633 HydrophobicContact SD-CD1 4.37Å; M599-F637 HydrophobicContact CE-CD2 4.26Å; M599-F637 HydrophobicContact CE-CE2 3.9Å; M599-Y640 HydrophobicContact CB-CE1 4.3Å; M599-Y640 HydrophobicContact CE-CD1 3.54Å; M599-Y640 HydrophobicContact CE-CD2 3.3Å; M599-Y640 HydrophobicContact CE-CE1 3.81Å; M599-Y640 HydrophobicContact CE-CE2 3.59Å; M599-Y640 HydrophobicContact CE-CG 3.26Å
600	Q	84.3	Confident	79	Confident	122 Å²	122	52.5 Å²	52.5	57%	0.57	27%	0.271	S	S	*	.	H	α-helix	trans	-65.2	-37.9	174.7	-75.2	178.1	17	0	0	112.7	S596 D597 V598 L603 K604	S596-Q600 VanDerWaalsContact O-CG 3.3Å; S596-Q600 WeakPolarHBondContact O-CG 3.24Å; S596-Q600 PolarHBondContact O-N 3.14Å; D597-Q600 PolarHBondContact O-N 3.07Å; V598-Q600 VanDerWaalsContact C-N 3.31Å; V598-Q600 PolarHBondContact O-N 2.83Å; Q600-L603 PolarHBondContact O-N 3.39Å; Q600-K604 WeakPolarHBondContact O-CB 3.34Å; Q600-K604 PolarHBondContact O-N 2.83Å
601	L	82.8	Confident	77.3	Confident	23 Å²	23	57.9 Å²	57.9	12%	0.12	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-48.6	174.2	-71.4	170.4	0	0	0	110.7	K557 V560 E561 D597 V598 L603 K604 T605	K557-L601 HydrophobicContact CB-CD1 4.22Å; K557-L601 HydrophobicContact CD-CD1 4.43Å; K557-L601 HydrophobicContact CG-CD1 4.22Å; V560-L601 HydrophobicContact CG1-CB 4.36Å; E561-L601 HydrophobicContact CG-CD1 4.47Å; E561-L601 HydrophobicContact CG-CD2 3.49Å; E561-L601 VanDerWaalsContact CG-CD2 3.49Å; D597-L601 WeakPolarHBondContact O-CG 3.41Å; D597-L601 PolarHBondContact O-N 2.93Å; V598-L601 WeakPolarHBondContact O-CB 3.41Å; V598-L601 PolarHBondContact O-N 3.03Å; V598-L601 VanDerWaalsContact O-N 3.14Å; L601-L603 PolarHBondContact O-N 2.86Å; L601-K604 WeakPolarHBondContact O-CB 3.1Å; L601-K604 PolarHBondContact O-N 3.31Å; L601-T605 VanDerWaalsContact O-CG2 3.24Å; L601-T605 WeakPolarHBondContact O-CG2 3.43Å; L601-T605 PolarHBondContact O-N 3.27Å
602	L	79.1	Confident	75.9	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-62	-40.4	176.7	-65.7	174.2	0	0	0	112.5	I576 V598 M599 K604 T605 Q606 W626 M629	I576-L602 HydrophobicContact CB-CD2 4.17Å; I576-L602 HydrophobicContact CD1-CD2 3.79Å; I576-L602 HydrophobicContact CG1-CD2 3.73Å; I576-L602 HydrophobicContact CG2-CD2 3.43Å; I576-L602 VanDerWaalsContact CG2-CD2 3.43Å; V598-L602 HydrophobicContact CG1-CD1 4.24Å; V598-L602 HydrophobicContact CG1-CG 4.47Å; V598-L602 WeakPolarHBondContact O-CG 3.43Å; V598-L602 PolarHBondContact O-N 2.88Å; M599-L602 PolarHBondContact O-N 2.87Å; M599-L602 HydrophobicContact SD-CD1 4.47Å; L602-K604 VanDerWaalsContact C-N 3.32Å; L602-K604 PolarHBondContact O-N 3.24Å; L602-T605 PolarHBondContact O-N 3.27Å; L602-T605 PolarHBondContact O-OG1 3.27Å; L602-Q606 VanDerWaalsContact O-CB 3.26Å; L602-Q606 WeakPolarHBondContact O-CB 3.4Å; L602-Q606 PolarHBondContact O-N 3.07Å; L602-W626 HydrophobicContact CB-CH2 3.25Å; L602-W626 HydrophobicContact CB-CZ2 3.54Å; L602-W626 HydrophobicContact CB-CZ3 3.82Å; L602-W626 HydrophobicContact CD1-CE3 4.06Å; L602-W626 HydrophobicContact CD1-CH2 4.15Å; L602-W626 HydrophobicContact CD1-CZ3 3.82Å; L602-W626 HydrophobicContact CG-CH2 4.33Å; L602-W626 HydrophobicContact CG-CZ3 4.49Å; L602-M629 HydrophobicContact CD1-CE 4.08Å; L602-M629 HydrophobicContact CD1-CG 4.26Å
603	L	77.1	Confident	74.9	Confident	40 Å²	40	60.7 Å²	60.7	21%	0.209	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-36.6	175.8	-70.9	174.5	0	0	0	111.8	M599 Q600 L601 Q606 T607 W626 Y640 V643	M599-L603 WeakPolarHBondContact O-CB 3.27Å; M599-L603 WeakPolarHBondContact O-CG 3.31Å; M599-L603 PolarHBondContact O-N 3.11Å; Q600-L603 PolarHBondContact O-N 3.39Å; L601-L603 PolarHBondContact O-N 2.86Å; L603-Q606 CarbonylContact O-C 3.57Å; L603-Q606 WeakPolarHBondContact O-CB 3.22Å; L603-Q606 PolarHBondContact O-N 2.95Å; L603-T607 PolarHBondContact O-N 3.14Å; L603-T607 PolarHBondContact O-OG1 2.92Å; L603-W626 HydrophobicContact CD2-CH2 3.74Å; L603-W626 HydrophobicContact CD2-CZ2 4.15Å; L603-W626 HydrophobicContact CG-CH2 3.88Å; L603-Y640 HydrophobicContact CD1-CD1 4.44Å; L603-V643 HydrophobicContact CD2-CB 3.77Å; L603-V643 HydrophobicContact CD2-CG1 3.34Å; L603-V643 HydrophobicContact CD2-CG2 4.23Å
604	K	78.9	Confident	73.5	Confident	144 Å²	144	58.8 Å²	58.8	63%	0.626	31%	0.307	S	S	*	.	H	α-helix	trans	-69.3	-37.7	177	-172.3	-178.4	178.1	-171.2	0	111.7	Q600 L601 L602 Q606 T607	Q600-K604 WeakPolarHBondContact O-CB 3.34Å; Q600-K604 PolarHBondContact O-N 2.83Å; L601-K604 WeakPolarHBondContact O-CB 3.1Å; L601-K604 PolarHBondContact O-N 3.31Å; L602-K604 VanDerWaalsContact C-N 3.32Å; L602-K604 PolarHBondContact O-N 3.24Å; K604-Q606 VanDerWaalsContact C-N 3.27Å; K604-T607 PolarHBondContact O-OG1 3.16Å
605	T	72.8	Confident	72.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.9	-34	171.6	66.1	0	0	0	0	111.1	V560 R572 I576 L601 L602 D608 M622	V560-T605 HydrophobicContact CG1-CG2 4.45Å; R572-T605 VanDerWaalsContact NH2-CG2 3.29Å; I576-T605 HydrophobicContact CD1-CG2 4.49Å; L601-T605 VanDerWaalsContact O-CG2 3.24Å; L601-T605 WeakPolarHBondContact O-CG2 3.43Å; L601-T605 PolarHBondContact O-N 3.27Å; L602-T605 PolarHBondContact O-N 3.27Å; L602-T605 PolarHBondContact O-OG1 3.27Å; T605-D608 PolarHBondContact O-N 3.04Å; T605-M622 VanDerWaalsContact OG1-CE 3.27Å; T605-M622 WeakPolarHBondContact OG1-CE 3.48Å
606	Q	67.3	Low	71.7	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.056	33%	0.325	C	S	.	.	H	α-helix	trans	-71.4	-29.4	177.4	-165.8	76.1	59.4	0	0	113.9	L602 L603 K604 D608 F609 M622 P647	L602-Q606 VanDerWaalsContact O-CB 3.26Å; L602-Q606 WeakPolarHBondContact O-CB 3.4Å; L602-Q606 PolarHBondContact O-N 3.07Å; L603-Q606 CarbonylContact O-C 3.57Å; L603-Q606 WeakPolarHBondContact O-CB 3.22Å; L603-Q606 PolarHBondContact O-N 2.95Å; K604-Q606 VanDerWaalsContact C-N 3.27Å; Q606-D608 PolarHBondContact O-N 3.26Å; Q606-F609 HydrophobicContact CG-CB 4.46Å; Q606-F609 WeakPolarHBondContact O-CB 3.24Å; Q606-F609 PolarHBondContact O-N 2.79Å; Q606-M622 HydrophobicContact CB-CE 3.87Å; Q606-M622 HydrophobicContact CG-CE 4.39Å; Q606-P647 HydrophobicContact CG-CG 4.15Å
607	T	65.8	Low	71.1	Confident	100 Å²	100	62.3 Å²	62.3	61%	0.613	32%	0.324	S	S	*	.	H	α-helix	trans	-66.8	-23	177.5	41.1	0	0	0	0	113.1	L603 K604 F609	L603-T607 PolarHBondContact O-N 3.14Å; L603-T607 PolarHBondContact O-OG1 2.92Å; K604-T607 PolarHBondContact O-OG1 3.16Å; T607-F609 VanDerWaalsContact C-N 3.3Å
608	D	61.6	Low	70.7	Confident	89 Å²	89	58.8 Å²	58.8	48%	0.476	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.1	173.3	-61.8	-24.3	0	0	0	112.3	T605 Q606 N610 D611 M612	T605-D608 PolarHBondContact O-N 3.04Å; Q606-D608 PolarHBondContact O-N 3.26Å; D608-N610 PolarHBondContact O-N 3.17Å; D608-D611 PolarHBondContact O-N 3.38Å; D608-D611 VanDerWaalsContact O-N 3.13Å; D608-M612 HydrophobicContact CB-CE 4.04Å
609	F	54.8	Low	70.3	Confident	11 Å²	11	59 Å²	59	5%	0.048	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-74.2	-19.7	-171.1	-147.7	-89.3	0	0	0	114.3	Q606 T607 D611 M612 I619 M622 P647	Q606-F609 HydrophobicContact CG-CB 4.46Å; Q606-F609 WeakPolarHBondContact O-CB 3.24Å; Q606-F609 PolarHBondContact O-N 2.79Å; T607-F609 VanDerWaalsContact C-N 3.3Å; F609-D611 PolarHBondContact O-N 3.45Å; F609-M612 HydrophobicContact CB-SD 4.17Å; F609-M612 HydrophobicContact CD2-CE 4.35Å; F609-M612 HydrophobicContact CD2-SD 3.58Å; F609-M612 VanDerWaalsContact CD2-SD 3.58Å; F609-M612 HydrophobicContact CE2-SD 4.29Å; F609-M612 HydrophobicContact CG-SD 3.92Å; F609-M612 PolarHBondContact O-N 3.12Å; F609-I619 HydrophobicContact CE1-CG1 4.11Å; F609-I619 HydrophobicContact CE1-CG2 4.49Å; F609-I619 HydrophobicContact CE2-CG1 4.14Å; F609-I619 HydrophobicContact CZ-CB 4.07Å; F609-I619 HydrophobicContact CZ-CG1 3.66Å; F609-I619 HydrophobicContact CZ-CG2 3.98Å; F609-M622 HydrophobicContact CD2-CE 3.72Å; F609-M622 HydrophobicContact CD2-SD 3.88Å; F609-M622 HydrophobicContact CE2-CB 4.25Å; F609-M622 HydrophobicContact CE2-CE 3.65Å; F609-M622 HydrophobicContact CE2-SD 3.62Å; F609-P647 HydrophobicContact CD1-CB 4.16Å; F609-P647 HydrophobicContact CE1-CB 3.97Å
610	N	52.5	Low	70.3	Confident	142 Å²	142	60.4 Å²	60.4	76%	0.759	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-72.9	-16.2	171.2	-71.4	-30.8	0	0	0	112.4	D608	D608-N610 PolarHBondContact O-N 3.17Å
611	D	58.8	Low	70.4	Confident	146 Å²	146	57 Å²	57	78%	0.781	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-104	5.5	177.1	-64.6	-30.1	0	0	0	112.2	D608 F609	D608-D611 PolarHBondContact O-N 3.38Å; D608-D611 VanDerWaalsContact O-N 3.13Å; F609-D611 PolarHBondContact O-N 3.45Å
612	M	64.4	Low	70.4	Confident	19 Å²	19	55.9 Å²	55.9	9%	0.094	29%	0.293	C	S	.	.	S	Bend	trans	-87.4	143.6	176.8	-68.2	175.5	-172.4	0	0	110.9	D608 F609 D616 Q618	D608-M612 HydrophobicContact CB-CE 4.04Å; F609-M612 HydrophobicContact CB-SD 4.17Å; F609-M612 HydrophobicContact CD2-CE 4.35Å; F609-M612 HydrophobicContact CD2-SD 3.58Å; F609-M612 VanDerWaalsContact CD2-SD 3.58Å; F609-M612 HydrophobicContact CE2-SD 4.29Å; F609-M612 HydrophobicContact CG-SD 3.92Å; F609-M612 PolarHBondContact O-N 3.12Å; M612-D616 HydrophobicContact CB-CB 4.31Å; M612-Q618 VanDerWaalsContact CE-CD 3.44Å; M612-Q618 HydrophobicContact CE-CG 4.39Å; M612-Q618 HydrophobicContact SD-CG 3.88Å; M612-Q618 PolarHBondContact SD-NE2 3.32Å
613	E	66.4	Low	70.6	Confident	119 Å²	119	56.1 Å²	56.1	56%	0.556	29%	0.294	S	S	*	.			trans	-68.4	150.9	173	-69.4	157.5	177.6	0	0	109.3	D615 D616 I619	E613-D615 VanDerWaalsContact CB-OD1 3.26Å; E613-D615 WeakPolarHBondContact CB-OD1 3.25Å; E613-D615 PolarHBondContact O-N 3.26Å; E613-D616 WeakPolarHBondContact O-CB 3.2Å; E613-D616 PolarHBondContact O-N 2.92Å; E613-D616 VanDerWaalsContact O-N 3.16Å; E613-I619 WeakPolarHBondContact O-CD1 3.48Å
614	D	61.2	Low	71.1	Confident	91 Å²	91	55.1 Å²	55.1	49%	0.487	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.5	-172.4	-70.6	-29.9	0	0	0	112.9	K650	D614-K650 WeakPolarHBondContact OD1-CE 3.5Å; D614-K650 IonicContact OD1-NZ 3.56Å; D614-K650 PolarHBondContact OD1-NZ 2.93Å
615	D	63.5	Low	71.5	Confident	98 Å²	98	48.2 Å²	48.2	52%	0.524	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	12.7	176.7	62.5	-13.7	0	0	0	113.5	E613 P617	E613-D615 VanDerWaalsContact CB-OD1 3.26Å; E613-D615 WeakPolarHBondContact CB-OD1 3.25Å; E613-D615 PolarHBondContact O-N 3.26Å; D615-P617 WeakPolarHBondContact O-CD 3.34Å
616	D	74.2	Confident	72.2	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.016	26%	0.261	C	S	.	.			trans	-65.5	121	-179.9	-167.2	-37	0	0	0	110.6	R569 M612 E613 Q618 I619	R569-D616 IonicContact CZ-OD2 3.43Å; R569-D616 IonicContact NE-OD2 2.87Å; R569-D616 PolarHBondContact NE-OD2 2.88Å; R569-D616 IonicContact NH1-OD2 2.87Å; R569-D616 PolarHBondContact NH1-OD2 2.71Å; R569-D616 IonicContact NH2-OD2 3.67Å; M612-D616 HydrophobicContact CB-CB 4.31Å; E613-D616 WeakPolarHBondContact O-CB 3.2Å; E613-D616 PolarHBondContact O-N 2.92Å; E613-D616 VanDerWaalsContact O-N 3.16Å; D616-Q618 PolarHBondContact O-N 3.33Å; D616-Q618 VanDerWaalsContact OD1-CG 3.26Å; D616-Q618 WeakPolarHBondContact OD1-CG 3.45Å; D616-Q618 PolarHBondContact OD1-N 2.89Å; D616-Q618 PolarHBondContact OD1-NE2 2.95Å; D616-Q618 PolarHBondContact OD2-NE2 3.02Å; D616-I619 HydrophobicContact CB-CD1 4.1Å; D616-I619 HydrophobicContact CB-CG1 4.26Å; D616-I619 WeakPolarHBondContact O-CB 3.43Å; D616-I619 VanDerWaalsContact O-CG1 3.29Å; D616-I619 WeakPolarHBondContact O-CG1 3.24Å; D616-I619 PolarHBondContact O-N 3.43Å
617	P	72.5	Confident	73.1	Confident	64 Å²	64	48.5 Å²	48.5	42%	0.416	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.9	-171.5	22.8	-35.2	0	0	0	113.7	D615 I619 Y621	D615-P617 WeakPolarHBondContact O-CD 3.34Å; P617-I619 PolarHBondContact O-N 3.08Å; P617-Y621 VanDerWaalsContact O-CD2 3.28Å; P617-Y621 WeakPolarHBondContact O-CD2 3.48Å
618	Q	77.9	Confident	74.2	Confident	4 Å²	4	46 Å²	46	2%	0.019	24%	0.243	C	C	.	.	H	α-helix	trans	-71.1	-17.4	178	76.4	-166.8	-54.8	0	0	113.8	M612 D616 M622	M612-Q618 VanDerWaalsContact CE-CD 3.44Å; M612-Q618 HydrophobicContact CE-CG 4.39Å; M612-Q618 HydrophobicContact SD-CG 3.88Å; M612-Q618 PolarHBondContact SD-NE2 3.32Å; D616-Q618 PolarHBondContact O-N 3.33Å; D616-Q618 VanDerWaalsContact OD1-CG 3.26Å; D616-Q618 WeakPolarHBondContact OD1-CG 3.45Å; D616-Q618 PolarHBondContact OD1-N 2.89Å; D616-Q618 PolarHBondContact OD1-NE2 2.95Å; D616-Q618 PolarHBondContact OD2-NE2 3.02Å; Q618-M622 HydrophobicContact CG-SD 4.48Å; Q618-M622 WeakPolarHBondContact O-CB 3.4Å; Q618-M622 VanDerWaalsContact O-CG 3.3Å; Q618-M622 WeakPolarHBondContact O-CG 3.48Å; Q618-M622 PolarHBondContact O-N 3.21Å
619	I	78.4	Confident	75.6	Confident	8 Å²	8	41.9 Å²	41.9	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-52.4	-177.5	-68.4	172.7	0	0	0	110.6	F609 E613 D616 P617 Y621 M622 I623 T651 E695	F609-I619 HydrophobicContact CE1-CG1 4.11Å; F609-I619 HydrophobicContact CE1-CG2 4.49Å; F609-I619 HydrophobicContact CE2-CG1 4.14Å; F609-I619 HydrophobicContact CZ-CB 4.07Å; F609-I619 HydrophobicContact CZ-CG1 3.66Å; F609-I619 HydrophobicContact CZ-CG2 3.98Å; E613-I619 WeakPolarHBondContact O-CD1 3.48Å; D616-I619 HydrophobicContact CB-CD1 4.1Å; D616-I619 HydrophobicContact CB-CG1 4.26Å; D616-I619 WeakPolarHBondContact O-CB 3.43Å; D616-I619 VanDerWaalsContact O-CG1 3.29Å; D616-I619 WeakPolarHBondContact O-CG1 3.24Å; D616-I619 PolarHBondContact O-N 3.43Å; P617-I619 PolarHBondContact O-N 3.08Å; I619-Y621 PolarHBondContact O-N 3.02Å; I619-M622 PolarHBondContact O-N 3.39Å; I619-I623 HydrophobicContact CG2-CD1 3.7Å; I619-I623 WeakPolarHBondContact O-CG1 3.26Å; I619-I623 PolarHBondContact O-N 2.96Å; I619-T651 HydrophobicContact CG2-CG2 4.12Å; I619-E695 HydrophobicContact CG2-CG 4.41Å
620	S	81.5	Confident	77.3	Confident	31 Å²	31	41.4 Å²	41.4	22%	0.217	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-48.2	-178.9	-179.1	0	0	0	0	111.7	M622 I623 S624	S620-M622 VanDerWaalsContact C-N 3.31Å; S620-M622 PolarHBondContact O-N 3.15Å; S620-I623 PolarHBondContact O-N 3.15Å; S620-S624 PolarHBondContact O-N 3.11Å; S620-S624 PolarHBondContact O-OG 3.06Å
621	Y	86.2	Confident	79	Confident	49 Å²	49	40.9 Å²	40.9	19%	0.192	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-39.9	177.5	-69.8	-67.7	0	0	0	113.2	L570 K574 E577 P617 I619 A625	L570-Y621 HydrophobicContact CD1-CE2 3.66Å; K574-Y621 WeakPolarHBondContact CE-OH 3.29Å; K574-Y621 HydrophobicContact CG-CE1 4.05Å; K574-Y621 HydrophobicContact CG-CE2 4.37Å; E577-Y621 HydrophobicContact CB-CD1 3.92Å; E577-Y621 VanDerWaalsContact OE2-CE1 3.32Å; E577-Y621 WeakPolarHBondContact OE2-CE1 3.4Å; P617-Y621 VanDerWaalsContact O-CD2 3.28Å; P617-Y621 WeakPolarHBondContact O-CD2 3.48Å; I619-Y621 PolarHBondContact O-N 3.02Å; Y621-A625 VanDerWaalsContact O-CB 3.22Å; Y621-A625 WeakPolarHBondContact O-CB 3.42Å; Y621-A625 PolarHBondContact O-N 3.46Å
622	M	84.1	Confident	80.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.4	-44.3	178.6	-76	-174.8	54.2	0	0	111.8	I576 T605 Q606 F609 Q618 I619 S620 A625 W626	I576-M622 HydrophobicContact CD1-CG 4.3Å; T605-M622 VanDerWaalsContact OG1-CE 3.27Å; T605-M622 WeakPolarHBondContact OG1-CE 3.48Å; Q606-M622 HydrophobicContact CB-CE 3.87Å; Q606-M622 HydrophobicContact CG-CE 4.39Å; F609-M622 HydrophobicContact CD2-CE 3.72Å; F609-M622 HydrophobicContact CD2-SD 3.88Å; F609-M622 HydrophobicContact CE2-CB 4.25Å; F609-M622 HydrophobicContact CE2-CE 3.65Å; F609-M622 HydrophobicContact CE2-SD 3.62Å; Q618-M622 HydrophobicContact CG-SD 4.48Å; Q618-M622 WeakPolarHBondContact O-CB 3.4Å; Q618-M622 VanDerWaalsContact O-CG 3.3Å; Q618-M622 WeakPolarHBondContact O-CG 3.48Å; Q618-M622 PolarHBondContact O-N 3.21Å; I619-M622 PolarHBondContact O-N 3.39Å; S620-M622 VanDerWaalsContact C-N 3.31Å; S620-M622 PolarHBondContact O-N 3.15Å; M622-A625 PolarHBondContact O-N 3.3Å; M622-W626 PolarHBondContact O-N 2.97Å
623	I	83.3	Confident	81.6	Confident	8 Å²	8	34 Å²	34	4%	0.041	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-49.9	177.8	-72.3	171.5	0	0	0	110.6	I619 S620 A625 W626 A627 L648 T651 T698 A699 M702	I619-I623 HydrophobicContact CG2-CD1 3.7Å; I619-I623 WeakPolarHBondContact O-CG1 3.26Å; I619-I623 PolarHBondContact O-N 2.96Å; S620-I623 PolarHBondContact O-N 3.15Å; I623-A625 PolarHBondContact O-N 3.16Å; I623-W626 PolarHBondContact O-N 3.25Å; I623-A627 PolarHBondContact O-N 3.07Å; I623-L648 HydrophobicContact CD1-CD1 4.33Å; I623-L648 HydrophobicContact CG1-CD1 4.26Å; I623-L648 HydrophobicContact CG2-CD1 3.74Å; I623-T651 HydrophobicContact CD1-CG2 3.78Å; I623-T698 HydrophobicContact CG2-CG2 4.05Å; I623-A699 HydrophobicContact CD1-CB 4.22Å; I623-M702 HydrophobicContact CG2-CB 4.07Å; I623-M702 HydrophobicContact CG2-CG 3.35Å
624	S	86.6	Confident	82.6	Confident	19 Å²	19	29.5 Å²	29.5	13%	0.133	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-39.7	178.2	-64.5	0	0	0	0	112.3	S620 W626 A627 R628	S620-S624 PolarHBondContact O-N 3.11Å; S620-S624 PolarHBondContact O-OG 3.06Å; S624-W626 PolarHBondContact O-N 2.91Å; S624-A627 PolarHBondContact O-N 2.96Å; S624-R628 WeakPolarHBondContact O-CG 3.4Å; S624-R628 PolarHBondContact O-N 2.94Å; S624-R628 VanDerWaalsContact O-N 3.09Å
625	A	88.9	Confident	83.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-42.4	175	0	0	0	0	0	112.2	I576 Y621 M622 I623 A627 R628 M629	I576-A625 HydrophobicContact CG2-CB 3.36Å; Y621-A625 VanDerWaalsContact O-CB 3.22Å; Y621-A625 WeakPolarHBondContact O-CB 3.42Å; Y621-A625 PolarHBondContact O-N 3.46Å; M622-A625 PolarHBondContact O-N 3.3Å; I623-A625 PolarHBondContact O-N 3.16Å; A625-A627 VanDerWaalsContact C-N 3.28Å; A625-A627 PolarHBondContact O-N 3.13Å; A625-R628 PolarHBondContact O-N 2.77Å; A625-M629 VanDerWaalsContact O-CG 3.27Å; A625-M629 WeakPolarHBondContact O-CG 3.41Å; A625-M629 PolarHBondContact O-N 3.05Å
626	W	86.8	Confident	85	Confident	6 Å²	6	32.2 Å²	32.2	2%	0.023	16%	0.163	C	C	.	.	H	α-helix	trans	-61.2	-37.3	177	-70.5	127	0	0	0	112.7	M599 L602 L603 M622 I623 S624 M629 C630 F637 V644 Y706	M599-W626 HydrophobicContact CE-CE3 3.95Å; M599-W626 HydrophobicContact CE-CH2 4.37Å; M599-W626 HydrophobicContact CE-CZ3 3.35Å; M599-W626 HydrophobicContact SD-CE3 4.08Å; M599-W626 HydrophobicContact SD-CZ3 3.54Å; M599-W626 VanDerWaalsContact SD-CZ3 3.54Å; L602-W626 HydrophobicContact CB-CH2 3.25Å; L602-W626 HydrophobicContact CB-CZ2 3.54Å; L602-W626 HydrophobicContact CB-CZ3 3.82Å; L602-W626 HydrophobicContact CD1-CE3 4.06Å; L602-W626 HydrophobicContact CD1-CH2 4.15Å; L602-W626 HydrophobicContact CD1-CZ3 3.82Å; L602-W626 HydrophobicContact CG-CH2 4.33Å; L602-W626 HydrophobicContact CG-CZ3 4.49Å; L603-W626 HydrophobicContact CD2-CH2 3.74Å; L603-W626 HydrophobicContact CD2-CZ2 4.15Å; L603-W626 HydrophobicContact CG-CH2 3.88Å; M622-W626 PolarHBondContact O-N 2.97Å; I623-W626 PolarHBondContact O-N 3.25Å; S624-W626 PolarHBondContact O-N 2.91Å; W626-M629 WeakPolarHBondContact O-CB 3.42Å; W626-M629 PolarHBondContact O-N 3.04Å; W626-C630 PolarHBondContact O-N 3.04Å; W626-F637 HydrophobicContact CB-CZ 4.46Å; W626-F637 HydrophobicContact CE3-CE2 4.28Å; W626-F637 HydrophobicContact CE3-CZ 4.42Å; W626-F637 WeakPolarHBondContact O-CZ 3.46Å; W626-V644 HydrophobicContact CB-CG1 4.46Å; W626-V644 HydrophobicContact CD2-CB 4.47Å; W626-V644 HydrophobicContact CD2-CG1 3.47Å; W626-V644 VanDerWaalsContact CD2-CG1 3.47Å; W626-V644 HydrophobicContact CE3-CG1 3.71Å; W626-V644 HydrophobicContact CG-CB 4.39Å; W626-V644 HydrophobicContact CG-CG1 3.86Å; W626-V644 HydrophobicContact CH2-CG1 4.3Å; W626-V644 HydrophobicContact CZ2-CG1 4.09Å; W626-V644 HydrophobicContact CZ3-CG1 4.14Å; W626-Y706 WeakPolarHBondContact CB-OH 3.39Å
627	A	85.3	Confident	85.8	Confident	12 Å²	12	32.1 Å²	32.1	10%	0.099	16%	0.162	C	C	.	.	H	α-helix	trans	-68.5	-41.7	176.4	0	0	0	0	0	113.3	I623 S624 A625 M629 C630 K631 M702 Y706	I623-A627 PolarHBondContact O-N 3.07Å; S624-A627 PolarHBondContact O-N 2.96Å; A625-A627 VanDerWaalsContact C-N 3.28Å; A625-A627 PolarHBondContact O-N 3.13Å; A627-M629 VanDerWaalsContact C-N 3.29Å; A627-M629 PolarHBondContact O-N 2.98Å; A627-C630 WeakPolarHBondContact O-CB 3.49Å; A627-C630 PolarHBondContact O-N 3.37Å; A627-C630 VanDerWaalsContact O-N 3.13Å; A627-K631 PolarHBondContact O-N 3.25Å; A627-M702 HydrophobicContact CB-CB 4.43Å; A627-M702 HydrophobicContact CB-CG 3.93Å; A627-M702 HydrophobicContact CB-SD 3.01Å; A627-M702 WeakPolarHBondContact CB-SD 3.36Å; A627-Y706 HydrophobicContact CB-CE1 4.35Å
628	R	89.6	Confident	86.7	Confident	48 Å²	48	32.7 Å²	32.7	18%	0.181	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-42.5	171.6	-66.2	170.9	-169.1	131.3	-4.9	110.5	E577 S580 L584 S624 A625 C630 K631 I632	E577-R628 IonicContact OE1-CZ 2.67Å; E577-R628 IonicContact OE1-NH1 3.62Å; E577-R628 PolarHBondContact OE1-NH1 2.93Å; E577-R628 VanDerWaalsContact OE1-NH1 3.11Å; E577-R628 IonicContact OE1-NH2 3.87Å; E577-R628 PolarHBondContact OE1-NH2 3.26Å; S580-R628 VanDerWaalsContact OG-CD 3.27Å; S580-R628 WeakPolarHBondContact OG-CD 3.48Å; S580-R628 PolarHBondContact OG-NH1 3.3Å; L584-R628 HydrophobicContact CD2-CG 4.45Å; S624-R628 WeakPolarHBondContact O-CG 3.4Å; S624-R628 PolarHBondContact O-N 2.94Å; S624-R628 VanDerWaalsContact O-N 3.09Å; A625-R628 PolarHBondContact O-N 2.77Å; R628-C630 VanDerWaalsContact C-N 3.34Å; R628-C630 PolarHBondContact O-N 3.49Å; R628-K631 PolarHBondContact O-N 2.9Å; R628-I632 WeakPolarHBondContact O-CD1 3.3Å; R628-I632 WeakPolarHBondContact O-CG1 3.45Å; R628-I632 PolarHBondContact O-N 2.92Å
629	M	90.3	Very high	87.2	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-41.6	173.7	-66.1	-58.8	168.3	0	0	112.5	F591 V598 M599 L602 A625 W626 A627 I632 L633 F637	F591-M629 HydrophobicContact CE1-CE 4.1Å; F591-M629 HydrophobicContact CE1-SD 3.43Å; F591-M629 WeakPolarHBondContact CE1-SD 3.14Å; F591-M629 HydrophobicContact CZ-CE 3.61Å; F591-M629 HydrophobicContact CZ-SD 3.61Å; V598-M629 HydrophobicContact CG1-CE 3.55Å; M599-M629 HydrophobicContact SD-CB 3.92Å; M599-M629 HydrophobicContact SD-CG 3.73Å; M599-M629 HydrophobicContact SD-SD 4.2Å; L602-M629 HydrophobicContact CD1-CE 4.08Å; L602-M629 HydrophobicContact CD1-CG 4.26Å; A625-M629 VanDerWaalsContact O-CG 3.27Å; A625-M629 WeakPolarHBondContact O-CG 3.41Å; A625-M629 PolarHBondContact O-N 3.05Å; W626-M629 WeakPolarHBondContact O-CB 3.42Å; W626-M629 PolarHBondContact O-N 3.04Å; A627-M629 VanDerWaalsContact C-N 3.29Å; A627-M629 PolarHBondContact O-N 2.98Å; M629-I632 PolarHBondContact O-N 3.37Å; M629-I632 HydrophobicContact SD-CD1 4.37Å; M629-L633 HydrophobicContact CB-CD1 4.43Å; M629-L633 WeakPolarHBondContact O-CB 3.39Å; M629-L633 WeakPolarHBondContact O-CG 3.39Å; M629-L633 PolarHBondContact O-N 3.48Å; M629-F637 HydrophobicContact CB-CD2 4.26Å; M629-F637 HydrophobicContact CB-CE2 3.86Å
630	C	90.2	Very high	87.8	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-61.4	-45.2	174.7	-177.8	0	0	0	0	112.1	W626 A627 R628 I632 G634 F637 Y706	W626-C630 PolarHBondContact O-N 3.04Å; A627-C630 WeakPolarHBondContact O-CB 3.49Å; A627-C630 PolarHBondContact O-N 3.37Å; A627-C630 VanDerWaalsContact O-N 3.13Å; R628-C630 VanDerWaalsContact C-N 3.34Å; R628-C630 PolarHBondContact O-N 3.49Å; C630-I632 VanDerWaalsContact C-N 3.32Å; C630-I632 PolarHBondContact O-N 2.98Å; C630-G634 WeakPolarHBondContact O-CA 3.47Å; C630-G634 PolarHBondContact O-N 2.88Å; C630-F637 HydrophobicContact CB-CB 4.35Å; C630-F637 HydrophobicContact CB-CD1 3.55Å; C630-F637 HydrophobicContact CB-CD2 4.06Å; C630-F637 HydrophobicContact CB-CE1 3.73Å; C630-F637 HydrophobicContact CB-CE2 4.22Å; C630-F637 HydrophobicContact CB-CG 3.73Å; C630-F637 HydrophobicContact CB-CZ 4.06Å; C630-Y706 HydrophobicContact CB-CD1 3.81Å; C630-Y706 HydrophobicContact CB-CE1 3.48Å; C630-Y706 VanDerWaalsContact CB-CE1 3.48Å
631	K	87.9	Confident	88.2	Confident	132 Å²	132	39.1 Å²	39.1	57%	0.574	18%	0.184	S	C	*	.	H	α-helix	trans	-62.1	-38.4	177.3	-165.9	173.4	-178.6	-176.9	0	112	L584 A627 R628	L584-K631 HydrophobicContact CD1-CB 4.3Å; L584-K631 HydrophobicContact CD1-CD 3.98Å; L584-K631 HydrophobicContact CD1-CG 4.11Å; A627-K631 PolarHBondContact O-N 3.25Å; R628-K631 PolarHBondContact O-N 2.9Å
632	I	89.8	Confident	88.3	Confident	13 Å²	13	41 Å²	41	7%	0.067	20%	0.203	C	C	.	.	H	α-helix	trans	-70.9	-50.2	178.1	-62.8	157.8	0	0	0	111.8	G583 L584 K588 F591 R628 M629 C630	G583-I632 VanDerWaalsContact C-CD1 3.45Å; L584-I632 HydrophobicContact CB-CD1 4.11Å; L584-I632 HydrophobicContact CB-CG1 4.18Å; L584-I632 HydrophobicContact CD1-CG1 3.79Å; K588-I632 HydrophobicContact CB-CG2 4.25Å; K588-I632 WeakPolarHBondContact CB-O 3.37Å; K588-I632 WeakPolarHBondContact CD-O 3.44Å; K588-I632 WeakPolarHBondContact CG-O 3.46Å; F591-I632 HydrophobicContact CB-CG2 4.4Å; F591-I632 HydrophobicContact CD1-CD1 4.38Å; F591-I632 HydrophobicContact CD1-CG2 3.85Å; F591-I632 HydrophobicContact CG-CG2 4.47Å; R628-I632 WeakPolarHBondContact O-CD1 3.3Å; R628-I632 WeakPolarHBondContact O-CG1 3.45Å; R628-I632 PolarHBondContact O-N 2.92Å; M629-I632 PolarHBondContact O-N 3.37Å; M629-I632 HydrophobicContact SD-CD1 4.37Å; C630-I632 VanDerWaalsContact C-N 3.32Å; C630-I632 PolarHBondContact O-N 2.98Å
633	L	89.1	Confident	88.3	Confident	7 Å²	7	44.3 Å²	44.3	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-79.6	-27.2	-172.5	-72.1	159.9	0	0	0	112.4	K588 M592 M599 M629 K635 E636 F637 Y640	K588-L633 PolarHBondContact NZ-O 3.32Å; M592-L633 HydrophobicContact CE-CD2 3.9Å; M592-L633 HydrophobicContact SD-CD2 4.23Å; M599-L633 HydrophobicContact SD-CD1 4.37Å; M629-L633 HydrophobicContact CB-CD1 4.43Å; M629-L633 WeakPolarHBondContact O-CB 3.39Å; M629-L633 WeakPolarHBondContact O-CG 3.39Å; M629-L633 PolarHBondContact O-N 3.48Å; L633-K635 PolarHBondContact O-N 3.49Å; L633-E636 HydrophobicContact CB-CB 4.37Å; L633-E636 PolarHBondContact O-N 3.4Å; L633-F637 HydrophobicContact CB-CB 4.08Å; L633-F637 HydrophobicContact CD1-CD2 3.99Å; L633-Y640 HydrophobicContact CD1-CE2 4.35Å
634	G	87.7	Confident	88.5	Confident	24 Å²	24	44 Å²	44	25%	0.247	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	59.3	-128.4	-173.5	0	0	0	0	0	110.9	C630 E636 F637 L710	C630-G634 WeakPolarHBondContact O-CA 3.47Å; C630-G634 PolarHBondContact O-N 2.88Å; G634-E636 PolarHBondContact O-N 3.42Å; G634-E636 VanDerWaalsContact O-N 3.1Å; G634-F637 WeakPolarHBondContact O-CB 3.47Å; G634-F637 PolarHBondContact O-N 2.94Å; G634-L710 WeakPolarHBondContact O-CD2 3.39Å
635	K	86.8	Confident	88.6	Confident	154 Å²	154	43.3 Å²	43.3	67%	0.67	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-58.9	-25.7	-178.4	-62	-171.8	179.5	-170.8	0	114.4	L633 F637 Q638	L633-K635 PolarHBondContact O-N 3.49Å; K635-F637 PolarHBondContact O-N 3.21Å; K635-Q638 WeakPolarHBondContact O-CB 3.22Å; K635-Q638 VanDerWaalsContact O-CG 3.29Å; K635-Q638 WeakPolarHBondContact O-CG 3.31Å; K635-Q638 PolarHBondContact O-N 3.14Å
636	E	88.9	Confident	88.6	Confident	93 Å²	93	45.6 Å²	45.6	44%	0.435	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-68.9	-14.6	176.4	-73.5	168.1	-144.3	0	0	113	K588 L633 G634 Q638 Q639	K588-E636 IonicContact NZ-OE1 2.75Å; K588-E636 PolarHBondContact NZ-OE1 3Å; K588-E636 IonicContact NZ-OE2 2.67Å; K588-E636 PolarHBondContact NZ-OE2 2.67Å; L633-E636 HydrophobicContact CB-CB 4.37Å; L633-E636 PolarHBondContact O-N 3.4Å; G634-E636 PolarHBondContact O-N 3.42Å; G634-E636 VanDerWaalsContact O-N 3.1Å; E636-Q638 VanDerWaalsContact C-N 3.26Å; E636-Q638 PolarHBondContact O-N 3.4Å; E636-Q639 WeakPolarHBondContact O-CG 3.07Å; E636-Q639 PolarHBondContact O-NE2 3.13Å
637	F	90.8	Very high	88.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-70.6	-21.2	174.9	-169.4	-103.1	0	0	0	113.1	M599 W626 M629 C630 L633 G634 K635 Q639 Y640 V644 Y706 L710	M599-F637 HydrophobicContact CE-CD2 4.26Å; M599-F637 HydrophobicContact CE-CE2 3.9Å; W626-F637 HydrophobicContact CB-CZ 4.46Å; W626-F637 HydrophobicContact CE3-CE2 4.28Å; W626-F637 HydrophobicContact CE3-CZ 4.42Å; W626-F637 WeakPolarHBondContact O-CZ 3.46Å; M629-F637 HydrophobicContact CB-CD2 4.26Å; M629-F637 HydrophobicContact CB-CE2 3.86Å; C630-F637 HydrophobicContact CB-CB 4.35Å; C630-F637 HydrophobicContact CB-CD1 3.55Å; C630-F637 HydrophobicContact CB-CD2 4.06Å; C630-F637 HydrophobicContact CB-CE1 3.73Å; C630-F637 HydrophobicContact CB-CE2 4.22Å; C630-F637 HydrophobicContact CB-CG 3.73Å; C630-F637 HydrophobicContact CB-CZ 4.06Å; L633-F637 HydrophobicContact CB-CB 4.08Å; L633-F637 HydrophobicContact CD1-CD2 3.99Å; G634-F637 WeakPolarHBondContact O-CB 3.47Å; G634-F637 PolarHBondContact O-N 2.94Å; K635-F637 PolarHBondContact O-N 3.21Å; F637-Q639 PolarHBondContact O-N 2.85Å; F637-Y640 HydrophobicContact CD2-CD2 4.1Å; F637-Y640 WeakPolarHBondContact O-CB 3.03Å; F637-Y640 PolarHBondContact O-N 2.79Å; F637-V644 HydrophobicContact CE1-CG2 4.01Å; F637-V644 HydrophobicContact CZ-CG1 4.22Å; F637-V644 HydrophobicContact CZ-CG2 4.07Å; F637-Y706 HydrophobicContact CE1-CD1 4.47Å; F637-Y706 AromaticContact CE1-CE1 3.85Å; F637-Y706 HydrophobicContact CE1-CE1 3.85Å; F637-Y706 AromaticContact CE1-CZ 3.99Å; F637-Y706 HydrophobicContact CZ-CE1 4.32Å; F637-L710 HydrophobicContact CB-CD2 4.49Å; F637-L710 HydrophobicContact CD1-CD1 4.26Å
638	Q	90.3	Very high	88.7	Confident	77 Å²	77	46.2 Å²	46.2	36%	0.36	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-53.5	-33	-175.5	-72.5	175.9	0.7	0	0	113.5	K635 E636 Y640 L641 L710	K635-Q638 WeakPolarHBondContact O-CB 3.22Å; K635-Q638 VanDerWaalsContact O-CG 3.29Å; K635-Q638 WeakPolarHBondContact O-CG 3.31Å; K635-Q638 PolarHBondContact O-N 3.14Å; E636-Q638 VanDerWaalsContact C-N 3.26Å; E636-Q638 PolarHBondContact O-N 3.4Å; Q638-Y640 PolarHBondContact O-N 2.73Å; Q638-L641 HydrophobicContact CB-CD1 4.44Å; Q638-L641 HydrophobicContact CG-CD1 4.41Å; Q638-L641 WeakPolarHBondContact O-CB 3.48Å; Q638-L641 PolarHBondContact O-N 3.17Å; Q638-L710 HydrophobicContact CG-CD2 4.37Å
639	Q	89.6	Confident	88.8	Confident	132 Å²	132	45.2 Å²	45.2	62%	0.617	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-64.1	-20.3	178	70	-170.2	-45.7	0	0	113.9	E636 F637	E636-Q639 WeakPolarHBondContact O-CG 3.07Å; E636-Q639 PolarHBondContact O-NE2 3.13Å; F637-Q639 PolarHBondContact O-N 2.85Å
640	Y	89.4	Confident	88.7	Confident	41 Å²	41	50 Å²	50	16%	0.161	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-97.2	-14.1	-178.8	-55	-72.4	0	0	0	113	M599 L603 L633 F637 Q638 P642 V643 V644	M599-Y640 HydrophobicContact CB-CE1 4.3Å; M599-Y640 HydrophobicContact CE-CD1 3.54Å; M599-Y640 HydrophobicContact CE-CD2 3.3Å; M599-Y640 HydrophobicContact CE-CE1 3.81Å; M599-Y640 HydrophobicContact CE-CE2 3.59Å; M599-Y640 HydrophobicContact CE-CG 3.26Å; L603-Y640 HydrophobicContact CD1-CD1 4.44Å; L633-Y640 HydrophobicContact CD1-CE2 4.35Å; F637-Y640 HydrophobicContact CD2-CD2 4.1Å; F637-Y640 WeakPolarHBondContact O-CB 3.03Å; F637-Y640 PolarHBondContact O-N 2.79Å; Q638-Y640 PolarHBondContact O-N 2.73Å; Y640-P642 VanDerWaalsContact C-CD 3.42Å; Y640-P642 VanDerWaalsContact C-N 3.33Å; Y640-V643 PolarHBondContact O-N 3.47Å; Y640-V644 PolarHBondContact O-N 2.95Å; Y640-V644 VanDerWaalsContact O-N 3.13Å
641	L	90.1	Very high	88.6	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-48	-45.5	177.6	-81.8	170.2	0	0	0	113.5	Q638 V643 V644 M645 Y706 L710 F714 Y717	Q638-L641 HydrophobicContact CB-CD1 4.44Å; Q638-L641 HydrophobicContact CG-CD1 4.41Å; Q638-L641 WeakPolarHBondContact O-CB 3.48Å; Q638-L641 PolarHBondContact O-N 3.17Å; L641-V643 PolarHBondContact O-N 3.49Å; L641-V643 VanDerWaalsContact O-N 3.1Å; L641-V644 HydrophobicContact CD2-CG2 4.46Å; L641-V644 PolarHBondContact O-N 3.31Å; L641-M645 HydrophobicContact CB-CG 4.34Å; L641-M645 HydrophobicContact CD2-CG 3.81Å; L641-M645 HydrophobicContact CD2-SD 4.03Å; L641-M645 WeakPolarHBondContact O-CB 3.43Å; L641-M645 WeakPolarHBondContact O-CG 3.43Å; L641-M645 PolarHBondContact O-N 3.34Å; L641-Y706 HydrophobicContact CD2-CD2 4.49Å; L641-L710 HydrophobicContact CD1-CD1 3.76Å; L641-L710 HydrophobicContact CD2-CD1 3.86Å; L641-L710 HydrophobicContact CG-CD1 4.03Å; L641-F714 HydrophobicContact CD2-CD2 4.25Å; L641-F714 HydrophobicContact CD2-CE2 4.32Å; L641-Y717 HydrophobicContact CB-CE2 3.71Å; L641-Y717 HydrophobicContact CD1-CD2 4.39Å; L641-Y717 HydrophobicContact CD1-CE2 3.89Å; L641-Y717 HydrophobicContact CD2-CE2 4.31Å; L641-Y717 HydrophobicContact CG-CE2 4.21Å
642	P	89.2	Confident	88.8	Confident	90 Å²	90	43.9 Å²	43.9	58%	0.584	24%	0.235	S	C	*	.	H	α-helix	trans	-60	-26.1	-179.4	-25.9	36.1	0	0	0	114.2	Y640 Y717	Y640-P642 VanDerWaalsContact C-CD 3.42Å; Y640-P642 VanDerWaalsContact C-N 3.33Å; P642-Y717 WeakPolarHBondContact CA-OH 3.3Å
643	V	84.2	Confident	88.9	Confident	68 Å²	68	45.9 Å²	45.9	41%	0.412	25%	0.25	S	C	.	.	H	α-helix	trans	-91.2	-36.9	-179.5	-170.1	0	0	0	0	111.9	L603 Y640 L641 P647	L603-V643 HydrophobicContact CD2-CB 3.77Å; L603-V643 HydrophobicContact CD2-CG1 3.34Å; L603-V643 HydrophobicContact CD2-CG2 4.23Å; Y640-V643 PolarHBondContact O-N 3.47Å; L641-V643 PolarHBondContact O-N 3.49Å; L641-V643 VanDerWaalsContact O-N 3.1Å; V643-P647 WeakPolarHBondContact O-CD 3.27Å
644	V	86.8	Confident	88.9	Confident	3 Å²	3	47 Å²	47	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-82.8	-30.7	-177.3	-55.6	0	0	0	0	113	W626 F637 Y640 L641 G646 P647 L648 Y706	W626-V644 HydrophobicContact CB-CG1 4.46Å; W626-V644 HydrophobicContact CD2-CB 4.47Å; W626-V644 HydrophobicContact CD2-CG1 3.47Å; W626-V644 VanDerWaalsContact CD2-CG1 3.47Å; W626-V644 HydrophobicContact CE3-CG1 3.71Å; W626-V644 HydrophobicContact CG-CB 4.39Å; W626-V644 HydrophobicContact CG-CG1 3.86Å; W626-V644 HydrophobicContact CH2-CG1 4.3Å; W626-V644 HydrophobicContact CZ2-CG1 4.09Å; W626-V644 HydrophobicContact CZ3-CG1 4.14Å; F637-V644 HydrophobicContact CE1-CG2 4.01Å; F637-V644 HydrophobicContact CZ-CG1 4.22Å; F637-V644 HydrophobicContact CZ-CG2 4.07Å; Y640-V644 PolarHBondContact O-N 2.95Å; Y640-V644 VanDerWaalsContact O-N 3.13Å; L641-V644 HydrophobicContact CD2-CG2 4.46Å; L641-V644 PolarHBondContact O-N 3.31Å; V644-G646 PolarHBondContact O-N 2.86Å; V644-P647 WeakPolarHBondContact O-CD 3.36Å; V644-L648 VanDerWaalsContact O-CB 3.3Å; V644-L648 WeakPolarHBondContact O-CB 3.34Å; V644-L648 PolarHBondContact O-N 3.16Å; V644-Y706 HydrophobicContact CG2-CE2 4.26Å
645	M	89.8	Confident	88.8	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-34.7	-174.6	-75.9	-61.1	-59	0	0	113.4	L641 L648 M649 L703 Y706 F714 Y717 V721	L641-M645 HydrophobicContact CB-CG 4.34Å; L641-M645 HydrophobicContact CD2-CG 3.81Å; L641-M645 HydrophobicContact CD2-SD 4.03Å; L641-M645 WeakPolarHBondContact O-CB 3.43Å; L641-M645 WeakPolarHBondContact O-CG 3.43Å; L641-M645 PolarHBondContact O-N 3.34Å; M645-L648 HydrophobicContact SD-CD2 4.42Å; M645-M649 HydrophobicContact CE-CG 4.04Å; M645-M649 HydrophobicContact CE-SD 4.1Å; M645-M649 VanDerWaalsContact O-CB 3.31Å; M645-M649 WeakPolarHBondContact O-CB 3.3Å; M645-M649 WeakPolarHBondContact O-CG 3.42Å; M645-M649 PolarHBondContact O-N 3.05Å; M645-L703 HydrophobicContact CE-CD2 3.64Å; M645-L703 HydrophobicContact SD-CD2 4.18Å; M645-Y706 HydrophobicContact SD-CD2 3.99Å; M645-Y706 HydrophobicContact SD-CE2 4.36Å; M645-F714 HydrophobicContact CE-CE2 3.87Å; M645-F714 HydrophobicContact CE-CZ 3.82Å; M645-F714 HydrophobicContact SD-CE2 3.63Å; M645-F714 HydrophobicContact SD-CZ 4.14Å; M645-Y717 HydrophobicContact CB-CD1 4.2Å; M645-Y717 HydrophobicContact CB-CE1 3.88Å; M645-Y717 HydrophobicContact CE-CD1 4.04Å; M645-Y717 HydrophobicContact CE-CG 3.88Å; M645-Y717 HydrophobicContact CG-CD1 4.01Å; M645-Y717 HydrophobicContact CG-CD2 4.12Å; M645-Y717 HydrophobicContact CG-CE1 3.84Å; M645-Y717 HydrophobicContact CG-CE2 4.01Å; M645-Y717 HydrophobicContact CG-CG 4.12Å; M645-Y717 HydrophobicContact SD-CG 4.5Å; M645-V721 HydrophobicContact CE-CG2 4.21Å
646	G	88	Confident	88.6	Confident	47 Å²	47	48.6 Å²	48.6	49%	0.485	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-58.4	-179.8	0	0	0	0	0	112.6	V644 L648 M649 K650	V644-G646 PolarHBondContact O-N 2.86Å; G646-L648 VanDerWaalsContact C-N 3.34Å; G646-L648 PolarHBondContact O-N 3.19Å; G646-M649 PolarHBondContact O-N 2.72Å; G646-K650 PolarHBondContact O-N 2.87Å; G646-K650 VanDerWaalsContact O-N 3.11Å
647	P	84.7	Confident	88.2	Confident	25 Å²	25	50 Å²	50	16%	0.162	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-43.4	175.4	-24.7	34	0	0	0	112.9	Q606 F609 V643 V644 M649 K650 T651	Q606-P647 HydrophobicContact CG-CG 4.15Å; F609-P647 HydrophobicContact CD1-CB 4.16Å; F609-P647 HydrophobicContact CE1-CB 3.97Å; V643-P647 WeakPolarHBondContact O-CD 3.27Å; V644-P647 WeakPolarHBondContact O-CD 3.36Å; P647-M649 PolarHBondContact O-N 3.36Å; P647-K650 WeakPolarHBondContact O-CB 3.42Å; P647-K650 PolarHBondContact O-N 3.48Å; P647-K650 VanDerWaalsContact O-N 3.09Å; P647-T651 PolarHBondContact O-N 3.48Å; P647-T651 PolarHBondContact O-OG1 3.32Å
648	L	89.3	Confident	87.7	Confident	6 Å²	6	53.5 Å²	53.5	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-44.8	-179.9	-175.5	63.3	0	0	0	112.2	I623 V644 M645 G646 K650 T651 A652 A699 M702 L703 Y706	I623-L648 HydrophobicContact CD1-CD1 4.33Å; I623-L648 HydrophobicContact CG1-CD1 4.26Å; I623-L648 HydrophobicContact CG2-CD1 3.74Å; V644-L648 VanDerWaalsContact O-CB 3.3Å; V644-L648 WeakPolarHBondContact O-CB 3.34Å; V644-L648 PolarHBondContact O-N 3.16Å; M645-L648 HydrophobicContact SD-CD2 4.42Å; G646-L648 VanDerWaalsContact C-N 3.34Å; G646-L648 PolarHBondContact O-N 3.19Å; L648-K650 VanDerWaalsContact C-N 3.29Å; L648-K650 PolarHBondContact O-N 2.95Å; L648-T651 PolarHBondContact O-N 2.98Å; L648-A652 WeakPolarHBondContact O-CB 3.34Å; L648-A652 PolarHBondContact O-N 3.29Å; L648-A699 HydrophobicContact CD1-CB 3.68Å; L648-M702 HydrophobicContact CD1-CB 4.07Å; L648-M702 HydrophobicContact CD2-CB 4.22Å; L648-L703 HydrophobicContact CD2-CD2 3.55Å; L648-L703 HydrophobicContact CD2-CG 3.86Å; L648-L703 HydrophobicContact CG-CD2 4.05Å; L648-L703 HydrophobicContact CG-CG 4.14Å; L648-Y706 HydrophobicContact CD2-CD2 3.78Å; L648-Y706 HydrophobicContact CD2-CE2 3.4Å
649	M	91.3	Very high	87	Confident	28 Å²	28	50.7 Å²	50.7	14%	0.138	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-33.6	176.1	-70.1	-66.4	-65.5	0	0	111.9	M645 G646 P647 S653 L703 Q720 V721 L724	M645-M649 HydrophobicContact CE-CG 4.04Å; M645-M649 HydrophobicContact CE-SD 4.1Å; M645-M649 VanDerWaalsContact O-CB 3.31Å; M645-M649 WeakPolarHBondContact O-CB 3.3Å; M645-M649 WeakPolarHBondContact O-CG 3.42Å; M645-M649 PolarHBondContact O-N 3.05Å; G646-M649 PolarHBondContact O-N 2.72Å; P647-M649 PolarHBondContact O-N 3.36Å; M649-S653 WeakPolarHBondContact O-CB 3.38Å; M649-S653 PolarHBondContact O-N 3.25Å; M649-S653 VanDerWaalsContact O-N 3.09Å; M649-S653 PolarHBondContact O-OG 2.9Å; M649-L703 HydrophobicContact SD-CD1 4.09Å; M649-L703 HydrophobicContact SD-CD2 4.05Å; M649-Q720 HydrophobicContact CE-CB 4.25Å; M649-Q720 HydrophobicContact CE-CG 4.21Å; M649-V721 HydrophobicContact CE-CG2 4.36Å; M649-V721 HydrophobicContact SD-CG2 3.78Å; M649-L724 HydrophobicContact CE-CB 4.12Å; M649-L724 HydrophobicContact CE-CD2 3.61Å; M649-L724 HydrophobicContact CE-CG 4.48Å; M649-L724 HydrophobicContact SD-CD2 3.85Å
650	K	88.5	Confident	86	Confident	100 Å²	100	49.9 Å²	49.9	44%	0.435	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-52.7	175.3	-172.3	-167.7	171.2	-150	0	110.3	D614 G646 P647 L648 S653 I654	D614-K650 WeakPolarHBondContact OD1-CE 3.5Å; D614-K650 IonicContact OD1-NZ 3.56Å; D614-K650 PolarHBondContact OD1-NZ 2.93Å; G646-K650 PolarHBondContact O-N 2.87Å; G646-K650 VanDerWaalsContact O-N 3.11Å; P647-K650 WeakPolarHBondContact O-CB 3.42Å; P647-K650 PolarHBondContact O-N 3.48Å; P647-K650 VanDerWaalsContact O-N 3.09Å; L648-K650 VanDerWaalsContact C-N 3.29Å; L648-K650 PolarHBondContact O-N 2.95Å; K650-S653 CarbonylContact O-C 3.55Å; K650-S653 PolarHBondContact O-N 2.87Å; K650-S653 VanDerWaalsContact O-N 3.09Å; K650-I654 PolarHBondContact O-N 3.38Å
651	T	88.4	Confident	85	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-45.5	-179.8	-54.4	0	0	0	0	111.9	I619 I623 P647 L648 S653 I654 E695 A699	I619-T651 HydrophobicContact CG2-CG2 4.12Å; I623-T651 HydrophobicContact CD1-CG2 3.78Å; P647-T651 PolarHBondContact O-N 3.48Å; P647-T651 PolarHBondContact O-OG1 3.32Å; L648-T651 PolarHBondContact O-N 2.98Å; T651-S653 PolarHBondContact O-N 3.18Å; T651-S653 VanDerWaalsContact O-N 3.1Å; T651-I654 HydrophobicContact CG2-CD1 3.85Å; T651-I654 WeakPolarHBondContact O-CB 3.42Å; T651-I654 WeakPolarHBondContact O-CD1 3.49Å; T651-I654 VanDerWaalsContact O-CG1 3.23Å; T651-I654 WeakPolarHBondContact O-CG1 3.49Å; T651-I654 PolarHBondContact O-N 2.95Å; T651-I654 VanDerWaalsContact O-N 3.07Å; T651-E695 HydrophobicContact CG2-CB 3.77Å; T651-E695 WeakPolarHBondContact CG2-O 3.46Å; T651-A699 HydrophobicContact CG2-CB 3.91Å
652	A	91.9	Very high	83.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-19.7	175.6	0	0	0	0	0	113.1	L648 K696 A699 L703 L724	L648-A652 WeakPolarHBondContact O-CB 3.34Å; L648-A652 PolarHBondContact O-N 3.29Å; A652-K696 PolarHBondContact O-NZ 3.39Å; A652-A699 HydrophobicContact CB-CB 3.83Å; A652-L703 HydrophobicContact CB-CD1 3.94Å; A652-L724 HydrophobicContact CB-CD2 3.76Å
653	S	92.5	Very high	82.5	Confident	54 Å²	54	47.1 Å²	47.1	38%	0.378	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	5.5	177.5	-56.4	0	0	0	0	114.3	M649 K650 T651 K655 L724	M649-S653 WeakPolarHBondContact O-CB 3.38Å; M649-S653 PolarHBondContact O-N 3.25Å; M649-S653 VanDerWaalsContact O-N 3.09Å; M649-S653 PolarHBondContact O-OG 2.9Å; K650-S653 CarbonylContact O-C 3.55Å; K650-S653 PolarHBondContact O-N 2.87Å; K650-S653 VanDerWaalsContact O-N 3.09Å; T651-S653 PolarHBondContact O-N 3.18Å; T651-S653 VanDerWaalsContact O-N 3.1Å; S653-K655 PolarHBondContact O-N 3.2Å; S653-L724 VanDerWaalsContact OG-CD1 3.32Å; S653-L724 WeakPolarHBondContact OG-CD1 3.49Å
654	I	88.4	Confident	81.3	Confident	30 Å²	30	49.3 Å²	49.3	15%	0.154	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-53.4	130.4	174.4	-69.2	166.1	0	0	0	108.4	K650 T651 K696	K650-I654 PolarHBondContact O-N 3.38Å; T651-I654 HydrophobicContact CG2-CD1 3.85Å; T651-I654 WeakPolarHBondContact O-CB 3.42Å; T651-I654 WeakPolarHBondContact O-CD1 3.49Å; T651-I654 VanDerWaalsContact O-CG1 3.23Å; T651-I654 WeakPolarHBondContact O-CG1 3.49Å; T651-I654 PolarHBondContact O-N 2.95Å; T651-I654 VanDerWaalsContact O-N 3.07Å; I654-K696 PolarHBondContact O-NZ 2.82Å
655	K	85.9	Confident	80.3	Confident	189 Å²	189	51 Å²	51	82%	0.822	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-100.7	117.3	173.6	-66.4	-174.2	179.5	-175.2	0	106.4	S653	S653-K655 PolarHBondContact O-N 3.2Å
656	P	83.3	Confident	79	Confident	23 Å²	23	53.9 Å²	53.9	15%	0.149	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-61	144	175.8	28	-34.8	0	0	0	109.2	V658 I688 L693 F731 F733	P656-V658 HydrophobicContact CG-CG1 4.37Å; P656-V658 PolarHBondContact O-N 3.08Å; P656-I688 HydrophobicContact CB-CD1 3.89Å; P656-I688 HydrophobicContact CB-CG1 3.97Å; P656-I688 HydrophobicContact CG-CD1 4.09Å; P656-L693 HydrophobicContact CB-CD2 3.95Å; P656-L693 HydrophobicContact CG-CD2 4.29Å; P656-F731 HydrophobicContact CG-CE2 3.76Å; P656-F731 HydrophobicContact CG-CZ 3.74Å; P656-F733 HydrophobicContact CG-CD2 4.14Å; P656-F733 HydrophobicContact CG-CE2 4.37Å
657	E	79.6	Confident	77.9	Confident	122 Å²	122	57.4 Å²	57.4	57%	0.57	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-73.2	123.4	168.1	-160.7	174.3	174.4	0	0	107.4	W675 K689	E657-W675 HydrophobicContact CB-CH2 3.91Å; E657-W675 HydrophobicContact CB-CZ2 4Å; E657-W675 HydrophobicContact CG-CH2 3.8Å; E657-W675 HydrophobicContact CG-CZ2 3.93Å; E657-K689 HydrophobicContact CB-CB 4Å; E657-K689 PolarHBondContact O-N 3.27Å
658	V	79.9	Confident	77	Confident	74 Å²	74	62.1 Å²	62.1	45%	0.448	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.7	-179.9	-63.2	0	0	0	0	108.5	P656 F686 G687 I688 F733	P656-V658 HydrophobicContact CG-CG1 4.37Å; P656-V658 PolarHBondContact O-N 3.08Å; V658-F686 HydrophobicContact CB-CE1 4.33Å; V658-F686 HydrophobicContact CB-CE2 4.33Å; V658-F686 HydrophobicContact CB-CZ 3.71Å; V658-F686 HydrophobicContact CG1-CE1 4.1Å; V658-F686 HydrophobicContact CG1-CZ 3.7Å; V658-G687 WeakPolarHBondContact CA-O 3.44Å; V658-I688 HydrophobicContact CG1-CD1 4.36Å; V658-I688 HydrophobicContact CG1-CG1 4.38Å; V658-F733 HydrophobicContact CG1-CE2 4.5Å; V658-F733 HydrophobicContact CG1-CZ 4.17Å
659	A	75.7	Confident	75.8	Confident	18 Å²	18	65 Å²	65	15%	0.149	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.2	-179	0	0	0	0	0	109.7	L661 W675 G687	A659-L661 HydrophobicContact CB-CD1 4.13Å; A659-L661 HydrophobicContact CB-CD2 3.78Å; A659-L661 HydrophobicContact CB-CG 3.79Å; A659-W675 HydrophobicContact CB-CH2 3.88Å; A659-W675 HydrophobicContact CB-CZ3 3.73Å; A659-G687 PolarHBondContact N-O 2.85Å; A659-G687 PolarHBondContact O-N 2.8Å
660	L	69.2	Low	74.2	Confident	116 Å²	116	67.8 Å²	67.8	61%	0.607	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	109.9	165.3	-82	154.3	0	0	0	107.4	L680 F686	L660-L680 HydrophobicContact CD2-CD1 4.44Å; L660-F686 HydrophobicContact CD2-CD2 4.1Å; L660-F686 HydrophobicContact CG-CD2 4.29Å
661	L	68.9	Low	72.8	Confident	17 Å²	17	70.7 Å²	70.7	9%	0.089	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	157	-172.7	-59	174.8	0	0	0	109.6	A659 D665 M669 F677 S685	A659-L661 HydrophobicContact CB-CD1 4.13Å; A659-L661 HydrophobicContact CB-CD2 3.78Å; A659-L661 HydrophobicContact CB-CG 3.79Å; L661-D665 HydrophobicContact CB-CB 3.94Å; L661-D665 HydrophobicContact CD2-CB 3.82Å; L661-D665 HydrophobicContact CG-CB 4.35Å; L661-M669 HydrophobicContact CD1-SD 3.51Å; L661-M669 VanDerWaalsContact CD1-SD 3.51Å; L661-M669 HydrophobicContact CD2-CE 4.06Å; L661-M669 HydrophobicContact CD2-SD 4.11Å; L661-M669 HydrophobicContact CG-SD 4.46Å; L661-F677 HydrophobicContact CD1-CD1 3.89Å; L661-F677 HydrophobicContact CD1-CE1 3.29Å; L661-F677 HydrophobicContact CD1-CZ 4.21Å; L661-S685 PolarHBondContact N-O 3.41Å; L661-S685 PolarHBondContact O-N 3.46Å
662	D	67.3	Low	71.6	Confident	16 Å²	16	74.1 Å²	74.1	9%	0.086	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	175.1	161.9	65.2	30.6	0	0	0	110.9	R85 Q664 D665 M666	R85-D662 IonicContact CZ-OD2 2.74Å; R85-D662 IonicContact NH2-OD2 3.11Å; R85-D662 PolarHBondContact NH2-OD2 3.4Å; D662-Q664 PolarHBondContact O-N 2.91Å; D662-Q664 VanDerWaalsContact O-N 3.12Å; D662-Q664 WeakPolarHBondContact OD1-CB 3.47Å; D662-Q664 PolarHBondContact OD1-N 3.31Å; D662-D665 PolarHBondContact O-N 3.17Å; D662-D665 VanDerWaalsContact O-N 3.13Å; D662-D665 PolarHBondContact OD1-N 3.36Å; D662-M666 PolarHBondContact O-N 3.19Å; D662-M666 VanDerWaalsContact O-N 3.12Å
663	T	59.2	Low	70.3	Confident	43 Å²	43	80.5 Å²	80.5	26%	0.264	43%	0.425	S	S	.	.	H	α-helix	trans	-55.8	-25.9	178.9	45.7	0	0	0	0	114.3	Q683	T663-Q683 HydrophobicContact CG2-CB 4.09Å; T663-Q683 HydrophobicContact CG2-CG 4.35Å
664	Q	57.9	Low	69.2	Low	115 Å²	115	78.6 Å²	78.6	54%	0.537	42%	0.415	S	S	.	.	H	α-helix	trans	-86	-34.9	178.4	-65.6	-178.7	-5.9	0	0	111.8	D662 M666 N668	D662-Q664 PolarHBondContact O-N 2.91Å; D662-Q664 VanDerWaalsContact O-N 3.12Å; D662-Q664 WeakPolarHBondContact OD1-CB 3.47Å; D662-Q664 PolarHBondContact OD1-N 3.31Å; Q664-M666 VanDerWaalsContact C-N 3.31Å; Q664-N668 PolarHBondContact O-ND2 3.45Å; Q664-N668 VanDerWaalsContact O-ND2 3.12Å
665	D	66.1	Low	68.7	Low	39 Å²	39	78.4 Å²	78.4	21%	0.209	41%	0.412	C	S	.	.	H	α-helix	trans	-70.5	-29	178.4	-67.9	-35.7	0	0	0	111.8	R86 L661 D662 N668	R86-D665 IonicContact CZ-OD2 2.63Å; R86-D665 IonicContact NH2-OD1 3.02Å; R86-D665 IonicContact NH2-OD2 3.09Å; R86-D665 PolarHBondContact NH2-OD2 3.2Å; L661-D665 HydrophobicContact CB-CB 3.94Å; L661-D665 HydrophobicContact CD2-CB 3.82Å; L661-D665 HydrophobicContact CG-CB 4.35Å; D662-D665 PolarHBondContact O-N 3.17Å; D662-D665 VanDerWaalsContact O-N 3.13Å; D662-D665 PolarHBondContact OD1-N 3.36Å; D665-N668 PolarHBondContact O-N 3.49Å
666	M	63.8	Low	68.2	Low	63 Å²	63	75.3 Å²	75.3	31%	0.31	40%	0.4	S	S	.	.	H	α-helix	trans	-62.5	-44.6	175.2	-170.4	-172.8	81.5	0	0	112.8	D662 Q664 N668 M669 S670 F677	D662-M666 PolarHBondContact O-N 3.19Å; D662-M666 VanDerWaalsContact O-N 3.12Å; Q664-M666 VanDerWaalsContact C-N 3.31Å; M666-N668 PolarHBondContact O-N 3.48Å; M666-M669 PolarHBondContact O-N 2.94Å; M666-M669 VanDerWaalsContact O-N 3.07Å; M666-S670 PolarHBondContact O-N 3.14Å; M666-S670 VanDerWaalsContact O-N 3.14Å; M666-F677 HydrophobicContact CG-CB 4.19Å; M666-F677 HydrophobicContact CG-CD1 4.02Å; M666-F677 HydrophobicContact CG-CD2 3.75Å; M666-F677 HydrophobicContact CG-CE1 4.44Å; M666-F677 HydrophobicContact CG-CE2 4.15Å; M666-F677 HydrophobicContact CG-CG 3.68Å; M666-F677 HydrophobicContact CG-CZ 4.49Å; M666-F677 HydrophobicContact SD-CB 4.05Å; M666-F677 HydrophobicContact SD-CD2 4.46Å; M666-F677 HydrophobicContact SD-CG 4.21Å
667	E	63.8	Low	68	Low	122 Å²	122	76.8 Å²	76.8	57%	0.57	40%	0.404	S	S	*	.	H	α-helix	trans	-62.3	-27.4	-179.9	-67.2	179.1	174.5	0	0	112.4
668	N	65.1	Low	67.6	Low	123 Å²	123	75.2 Å²	75.2	66%	0.658	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-15.1	178.5	-61	-48.8	0	0	0	113.6	Q664 D665 M666	Q664-N668 PolarHBondContact O-ND2 3.45Å; Q664-N668 VanDerWaalsContact O-ND2 3.12Å; D665-N668 PolarHBondContact O-N 3.49Å; M666-N668 PolarHBondContact O-N 3.48Å
669	M	64.1	Low	67.1	Low	67 Å²	67	75.7 Å²	75.7	33%	0.33	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-8.1	178.9	-67.1	-172.1	172.6	0	0	112.7	L661 M666 D671 D672 F677	L661-M669 HydrophobicContact CD1-SD 3.51Å; L661-M669 VanDerWaalsContact CD1-SD 3.51Å; L661-M669 HydrophobicContact CD2-CE 4.06Å; L661-M669 HydrophobicContact CD2-SD 4.11Å; L661-M669 HydrophobicContact CG-SD 4.46Å; M666-M669 PolarHBondContact O-N 2.94Å; M666-M669 VanDerWaalsContact O-N 3.07Å; M669-D671 PolarHBondContact O-N 3.38Å; M669-D672 PolarHBondContact O-N 2.87Å; M669-D672 VanDerWaalsContact O-N 3.09Å; M669-F677 HydrophobicContact CB-CE1 4.46Å; M669-F677 HydrophobicContact CB-CE2 4.46Å; M669-F677 HydrophobicContact CB-CZ 3.65Å
670	S	57.9	Low	66.7	Low	87 Å²	87	79.9 Å²	79.9	61%	0.608	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.2	179.1	-167.9	0	0	0	0	114.3	M666 D672	M666-S670 PolarHBondContact O-N 3.14Å; M666-S670 VanDerWaalsContact O-N 3.14Å; S670-D672 VanDerWaalsContact C-N 3.27Å
671	D	60.2	Low	66.4	Low	161 Å²	161	76.1 Å²	76.1	86%	0.861	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11.9	174.5	-66.1	-23.1	0	0	0	112.5	M669	M669-D671 PolarHBondContact O-N 3.38Å
672	D	63.7	Low	66.1	Low	77 Å²	77	78.6 Å²	78.6	41%	0.412	43%	0.425	S	S	.	.			trans	-103.7	97.6	177.3	-169.1	-2.1	0	0	0	109	M669 S670 G674 W675	M669-D672 PolarHBondContact O-N 2.87Å; M669-D672 VanDerWaalsContact O-N 3.09Å; S670-D672 VanDerWaalsContact C-N 3.27Å; D672-G674 PolarHBondContact O-N 3.01Å; D672-G674 PolarHBondContact OD1-N 3.37Å; D672-W675 PolarHBondContact O-N 3.28Å; D672-W675 VanDerWaalsContact O-N 3.08Å
673	D	64.1	Low	65.8	Low	134 Å²	134	79.2 Å²	79.2	72%	0.717	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-15.6	-178.7	-164.9	39.2	0	0	0	113.3	W675	D673-W675 VanDerWaalsContact C-N 3.29Å; D673-W675 PolarHBondContact O-N 3.19Å
674	G	70	Confident	66.1	Low	15 Å²	15	79.4 Å²	79.4	16%	0.155	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	7	175.1	0	0	0	0	0	115.8	D672 K689 T690	D672-G674 PolarHBondContact O-N 3.01Å; D672-G674 PolarHBondContact OD1-N 3.37Å; G674-K689 CarbonylContact O-C 3.33Å; G674-K689 VanDerWaalsContact O-CA 3.24Å; G674-K689 WeakPolarHBondContact O-CA 3.49Å; G674-K689 WeakPolarHBondContact O-CG 3.48Å; G674-T690 PolarHBondContact O-N 3Å; G674-T690 PolarHBondContact O-OG1 3.45Å
675	W	76.8	Confident	66.8	Low	26 Å²	26	74 Å²	74	10%	0.098	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.2	178.4	-78.2	85.6	0	0	0	113.1	E657 A659 D672 D673 F677 G687 I688 K689	E657-W675 HydrophobicContact CB-CH2 3.91Å; E657-W675 HydrophobicContact CB-CZ2 4Å; E657-W675 HydrophobicContact CG-CH2 3.8Å; E657-W675 HydrophobicContact CG-CZ2 3.93Å; A659-W675 HydrophobicContact CB-CH2 3.88Å; A659-W675 HydrophobicContact CB-CZ3 3.73Å; D672-W675 PolarHBondContact O-N 3.28Å; D672-W675 VanDerWaalsContact O-N 3.08Å; D673-W675 VanDerWaalsContact C-N 3.29Å; D673-W675 PolarHBondContact O-N 3.19Å; W675-F677 HydrophobicContact CB-CE1 4.43Å; W675-F677 HydrophobicContact CB-CE2 3.9Å; W675-F677 HydrophobicContact CB-CZ 3.63Å; W675-F677 HydrophobicContact CE3-CE1 4.19Å; W675-F677 HydrophobicContact CE3-CZ 4.41Å; W675-F677 HydrophobicContact CG-CZ 4.3Å; W675-G687 WeakPolarHBondContact CZ3-O 3.46Å; W675-I688 WeakPolarHBondContact CA-O 3.44Å; W675-K689 HydrophobicContact CD2-CB 4.07Å; W675-K689 HydrophobicContact CE3-CB 4.43Å; W675-K689 HydrophobicContact CH2-CB 4.29Å; W675-K689 HydrophobicContact CZ2-CB 3.93Å
676	E	75.9	Confident	67.2	Low	124 Å²	124	74.3 Å²	74.3	58%	0.579	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	145.8	170.2	-76.6	174.3	-158.6	0	0	111	G687 I688 T690	E676-G687 CarbonylContact O-C 3.06Å; E676-G687 WeakPolarHBondContact O-CA 3.5Å; E676-I688 HydrophobicContact CB-CG2 4.27Å; E676-I688 PolarHBondContact N-O 3.1Å; E676-I688 PolarHBondContact O-N 3.4Å; E676-T690 HydrophobicContact CB-CG2 3.73Å; E676-T690 HydrophobicContact CG-CG2 3.54Å; E676-T690 WeakPolarHBondContact OE1-CG2 3.45Å
677	F	78.4	Confident	67.8	Low	54 Å²	54	71.3 Å²	71.3	24%	0.237	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.2	-176.9	-57.6	-78	0	0	0	111.6	L661 M666 M669 W675 F686	L661-F677 HydrophobicContact CD1-CD1 3.89Å; L661-F677 HydrophobicContact CD1-CE1 3.29Å; L661-F677 HydrophobicContact CD1-CZ 4.21Å; M666-F677 HydrophobicContact CG-CB 4.19Å; M666-F677 HydrophobicContact CG-CD1 4.02Å; M666-F677 HydrophobicContact CG-CD2 3.75Å; M666-F677 HydrophobicContact CG-CE1 4.44Å; M666-F677 HydrophobicContact CG-CE2 4.15Å; M666-F677 HydrophobicContact CG-CG 3.68Å; M666-F677 HydrophobicContact CG-CZ 4.49Å; M666-F677 HydrophobicContact SD-CB 4.05Å; M666-F677 HydrophobicContact SD-CD2 4.46Å; M666-F677 HydrophobicContact SD-CG 4.21Å; M669-F677 HydrophobicContact CB-CE1 4.46Å; M669-F677 HydrophobicContact CB-CE2 4.46Å; M669-F677 HydrophobicContact CB-CZ 3.65Å; W675-F677 HydrophobicContact CB-CE1 4.43Å; W675-F677 HydrophobicContact CB-CE2 3.9Å; W675-F677 HydrophobicContact CB-CZ 3.63Å; W675-F677 HydrophobicContact CE3-CE1 4.19Å; W675-F677 HydrophobicContact CE3-CZ 4.41Å; W675-F677 HydrophobicContact CG-CZ 4.3Å; F677-F686 CarbonylContact C-O 3.57Å; F677-F686 WeakPolarHBondContact CA-O 3.4Å
678	V	72.1	Confident	68.7	Low	88 Å²	88	66 Å²	66	53%	0.533	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.2	170.7	-178.3	0	0	0	0	108.8	L680 S685 F686	V678-L680 HydrophobicContact CG1-CD2 4.43Å; V678-L680 PolarHBondContact O-N 3.08Å; V678-S685 WeakPolarHBondContact O-CA 3.4Å; V678-F686 PolarHBondContact N-O 3.25Å; V678-F686 PolarHBondContact O-N 2.99Å
679	N	69.8	Low	69.5	Low	84 Å²	84	63.1 Å²	63.1	45%	0.449	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	112.1	177.9	-162.4	-7.7	0	0	0	109.3	G681 Q684	N679-G681 PolarHBondContact O-N 3.17Å; N679-Q684 PolarHBondContact OD1-O 3.42Å
680	L	67.3	Low	70.2	Confident	107 Å²	107	61.6 Å²	61.6	56%	0.56	34%	0.336	S	S	*	.			trans	-80.8	4.5	-175.6	-62.6	176.2	0	0	0	113	L660 V678 Q684 F686	L660-L680 HydrophobicContact CD2-CD1 4.44Å; V678-L680 HydrophobicContact CG1-CD2 4.43Å; V678-L680 PolarHBondContact O-N 3.08Å; L680-Q684 PolarHBondContact N-O 2.97Å; L680-F686 HydrophobicContact CD1-CB 3.98Å; L680-F686 HydrophobicContact CG-CB 4.16Å
681	G	61.4	Low	71.3	Confident	36 Å²	36	59.6 Å²	59.6	37%	0.371	33%	0.325	S	S	.	.	S	Bend	trans	84.4	174.9	-165.5	0	0	0	0	0	111.5	N679 Q683 Q684	N679-G681 PolarHBondContact O-N 3.17Å; G681-Q683 PolarHBondContact O-N 2.83Å; G681-Q684 PolarHBondContact O-N 3.28Å; G681-Q684 VanDerWaalsContact O-N 3.09Å
682	D	62.9	Low	72.3	Confident	70 Å²	70	52.2 Å²	52.2	37%	0.374	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	19.7	173.5	-76.4	-38.8	0	0	0	115.3	R136 N175 Q684	R136-D682 IonicContact CZ-OD1 3.38Å; R136-D682 IonicContact CZ-OD2 2.97Å; R136-D682 IonicContact NE-OD1 3.13Å; R136-D682 PolarHBondContact NE-OD1 3.27Å; R136-D682 IonicContact NE-OD2 3.66Å; R136-D682 PolarHBondContact NE-OD2 3.2Å; R136-D682 IonicContact NH2-OD1 3.41Å; R136-D682 PolarHBondContact NH2-OD1 2.99Å; R136-D682 IonicContact NH2-OD2 2.88Å; N175-D682 VanDerWaalsContact O-OD1 3.14Å; D682-Q684 VanDerWaalsContact C-N 3.26Å; D682-Q684 PolarHBondContact O-N 3.29Å
683	Q	62.1	Low	73.4	Confident	29 Å²	29	49.1 Å²	49.1	14%	0.136	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	23.3	-176.8	-54.1	173.4	39.1	0	0	115.2	W174 T663 G681	W174-Q683 VanDerWaalsContact CE2-NE2 3.28Å; W174-Q683 HydrophobicContact CH2-CG 4.22Å; W174-Q683 HydrophobicContact CZ2-CG 4.05Å; T663-Q683 HydrophobicContact CG2-CB 4.09Å; T663-Q683 HydrophobicContact CG2-CG 4.35Å; G681-Q683 PolarHBondContact O-N 2.83Å
684	Q	65.6	Low	74.4	Confident	47 Å²	47	48.2 Å²	48.2	22%	0.22	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123	166.2	-65.1	-172.7	12.7	0	0	109.1	S89 N679 L680 G681 D682	S89-Q684 PolarHBondContact OG-NE2 3.34Å; N679-Q684 PolarHBondContact OD1-O 3.42Å; L680-Q684 PolarHBondContact N-O 2.97Å; G681-Q684 PolarHBondContact O-N 3.28Å; G681-Q684 VanDerWaalsContact O-N 3.09Å; D682-Q684 VanDerWaalsContact C-N 3.26Å; D682-Q684 PolarHBondContact O-N 3.29Å
685	S	71.3	Confident	75.2	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.007	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.8	172.7	-59.8	0	0	0	0	108.9	L661 V678	L661-S685 PolarHBondContact N-O 3.41Å; L661-S685 PolarHBondContact O-N 3.46Å; V678-S685 WeakPolarHBondContact O-CA 3.4Å
686	F	74.1	Confident	75.9	Confident	45 Å²	45	48.4 Å²	48.4	20%	0.197	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	107.9	169.2	-170.7	-87.7	0	0	0	108.2	V658 L660 F677 V678 L680 I688 F733	V658-F686 HydrophobicContact CB-CE1 4.33Å; V658-F686 HydrophobicContact CB-CE2 4.33Å; V658-F686 HydrophobicContact CB-CZ 3.71Å; V658-F686 HydrophobicContact CG1-CE1 4.1Å; V658-F686 HydrophobicContact CG1-CZ 3.7Å; L660-F686 HydrophobicContact CD2-CD2 4.1Å; L660-F686 HydrophobicContact CG-CD2 4.29Å; F677-F686 CarbonylContact C-O 3.57Å; F677-F686 WeakPolarHBondContact CA-O 3.4Å; V678-F686 PolarHBondContact N-O 3.25Å; V678-F686 PolarHBondContact O-N 2.99Å; L680-F686 HydrophobicContact CD1-CB 3.98Å; L680-F686 HydrophobicContact CG-CB 4.16Å; F686-I688 HydrophobicContact CE1-CB 4.25Å; F686-F733 HydrophobicContact CD1-CE1 4.46Å; F686-F733 HydrophobicContact CE1-CD1 4.15Å; F686-F733 AromaticContact CE1-CE1 3.37Å; F686-F733 HydrophobicContact CE1-CE1 3.37Å; F686-F733 HydrophobicContact CE1-CZ 4.06Å; F686-F733 AromaticContact CZ-CE1 3.54Å; F686-F733 HydrophobicContact CZ-CE1 3.54Å; F686-F733 AromaticContact CZ-CZ 3.78Å; F686-F733 HydrophobicContact CZ-CZ 3.78Å
687	G	78.1	Confident	76.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	137.1	171.9	0	0	0	0	0	111.1	V658 A659 W675 E676	V658-G687 WeakPolarHBondContact CA-O 3.44Å; A659-G687 PolarHBondContact N-O 2.85Å; A659-G687 PolarHBondContact O-N 2.8Å; W675-G687 WeakPolarHBondContact CZ3-O 3.46Å; E676-G687 CarbonylContact O-C 3.06Å; E676-G687 WeakPolarHBondContact O-CA 3.5Å
688	I	81.2	Confident	77.2	Confident	11 Å²	11	41 Å²	41	6%	0.056	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.1	170.4	-175.8	158.1	0	0	0	110.3	P656 V658 W675 E676 F686 T690 L693 F733	P656-I688 HydrophobicContact CB-CD1 3.89Å; P656-I688 HydrophobicContact CB-CG1 3.97Å; P656-I688 HydrophobicContact CG-CD1 4.09Å; V658-I688 HydrophobicContact CG1-CD1 4.36Å; V658-I688 HydrophobicContact CG1-CG1 4.38Å; W675-I688 WeakPolarHBondContact CA-O 3.44Å; E676-I688 HydrophobicContact CB-CG2 4.27Å; E676-I688 PolarHBondContact N-O 3.1Å; E676-I688 PolarHBondContact O-N 3.4Å; F686-I688 HydrophobicContact CE1-CB 4.25Å; I688-T690 HydrophobicContact CG2-CG2 4.43Å; I688-T690 PolarHBondContact O-N 3.35Å; I688-L693 HydrophobicContact CD1-CD1 4.13Å; I688-L693 HydrophobicContact CG1-CD1 4.41Å; I688-F733 HydrophobicContact CD1-CB 3.5Å; I688-F733 VanDerWaalsContact CD1-CB 3.5Å; I688-F733 HydrophobicContact CD1-CD1 3.37Å; I688-F733 HydrophobicContact CD1-CD2 3.88Å; I688-F733 HydrophobicContact CD1-CE1 4.04Å; I688-F733 HydrophobicContact CD1-CE2 4.46Å; I688-F733 HydrophobicContact CD1-CG 3.28Å
689	K	81.8	Confident	78.1	Confident	62 Å²	62	36.8 Å²	36.8	27%	0.27	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	110.5	168.8	-163.1	174.4	-172.5	171.5	0	109.2	E657 G674 W675 A691	E657-K689 HydrophobicContact CB-CB 4Å; E657-K689 PolarHBondContact O-N 3.27Å; G674-K689 CarbonylContact O-C 3.33Å; G674-K689 VanDerWaalsContact O-CA 3.24Å; G674-K689 WeakPolarHBondContact O-CA 3.49Å; G674-K689 WeakPolarHBondContact O-CG 3.48Å; W675-K689 HydrophobicContact CD2-CB 4.07Å; W675-K689 HydrophobicContact CE3-CB 4.43Å; W675-K689 HydrophobicContact CH2-CB 4.29Å; W675-K689 HydrophobicContact CZ2-CB 3.93Å; K689-A691 VanDerWaalsContact C-N 3.33Å; K689-A691 HydrophobicContact CD-CB 4.44Å; K689-A691 HydrophobicContact CG-CB 4.1Å
690	T	80.4	Confident	79.4	Confident	35 Å²	35	32.8 Å²	32.8	22%	0.215	18%	0.181	C	C	.	.			trans	-76.4	-22.2	-178.9	55.2	0	0	0	0	112.8	G674 E676 I688 G692 L693	G674-T690 PolarHBondContact O-N 3Å; G674-T690 PolarHBondContact O-OG1 3.45Å; E676-T690 HydrophobicContact CB-CG2 3.73Å; E676-T690 HydrophobicContact CG-CG2 3.54Å; E676-T690 WeakPolarHBondContact OE1-CG2 3.45Å; I688-T690 HydrophobicContact CG2-CG2 4.43Å; I688-T690 PolarHBondContact O-N 3.35Å; T690-G692 PolarHBondContact O-N 3.47Å; T690-L693 HydrophobicContact CG2-CD1 4.34Å; T690-L693 WeakPolarHBondContact O-CB 3.35Å; T690-L693 WeakPolarHBondContact O-CG 3.39Å; T690-L693 PolarHBondContact O-N 3.36Å
691	A	80.4	Confident	80.6	Confident	45 Å²	45	31.6 Å²	31.6	37%	0.372	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	123.6	172.7	0	0	0	0	0	111.4	K689	K689-A691 VanDerWaalsContact C-N 3.33Å; K689-A691 HydrophobicContact CD-CB 4.44Å; K689-A691 HydrophobicContact CG-CB 4.1Å
692	G	81.1	Confident	82	Confident	6 Å²	6	30.8 Å²	30.8	6%	0.062	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	-8.2	-179.1	0	0	0	0	0	115.3	T690 E695 K696	T690-G692 PolarHBondContact O-N 3.47Å; G692-E695 WeakPolarHBondContact CA-OE2 3.49Å; G692-E695 PolarHBondContact N-OE2 2.97Å; G692-K696 VanDerWaalsContact O-CB 3.27Å; G692-K696 WeakPolarHBondContact O-CB 3.49Å; G692-K696 PolarHBondContact O-N 2.83Å
693	L	86.6	Confident	83.6	Confident	13 Å²	13	27.5 Å²	27.5	7%	0.068	14%	0.141	C	C	.	.	H	α-helix	trans	-69.4	-42.9	179.3	-69.9	-173.8	0	0	0	112	P656 I688 T690 K696 S697 F731	P656-L693 HydrophobicContact CB-CD2 3.95Å; P656-L693 HydrophobicContact CG-CD2 4.29Å; I688-L693 HydrophobicContact CD1-CD1 4.13Å; I688-L693 HydrophobicContact CG1-CD1 4.41Å; T690-L693 HydrophobicContact CG2-CD1 4.34Å; T690-L693 WeakPolarHBondContact O-CB 3.35Å; T690-L693 WeakPolarHBondContact O-CG 3.39Å; T690-L693 PolarHBondContact O-N 3.36Å; L693-K696 WeakPolarHBondContact O-CB 3.27Å; L693-K696 PolarHBondContact O-N 3.07Å; L693-S697 PolarHBondContact O-N 3.31Å; L693-F731 HydrophobicContact CD2-CE1 3.86Å; L693-F731 HydrophobicContact CD2-CZ 3.63Å
694	E	86.4	Confident	85.2	Confident	115 Å²	115	26.5 Å²	26.5	54%	0.537	14%	0.137	S	C	.	.	H	α-helix	trans	-67.3	-39.8	176	-74.2	-61.8	164.2	0	0	111.8	K696 S697 T698 H734	E694-K696 VanDerWaalsContact C-N 3.29Å; E694-K696 PolarHBondContact O-N 2.77Å; E694-S697 WeakPolarHBondContact O-CB 3.26Å; E694-S697 PolarHBondContact O-N 2.92Å; E694-T698 WeakPolarHBondContact O-CB 3.16Å; E694-T698 PolarHBondContact O-N 3.07Å; E694-T698 PolarHBondContact O-OG1 2.94Å; E694-H734 IonicContact OE1-NE2 3.28Å; E694-H734 PolarHBondContact OE1-NE2 3.08Å; E694-H734 IonicContact OE2-NE2 3.77Å; E694-H734 PolarHBondContact OE2-NE2 2.99Å
695	E	86.1	Confident	86.4	Confident	39 Å²	39	26.6 Å²	26.6	18%	0.182	14%	0.142	C	C	.	.	H	α-helix	trans	-61.8	-40.1	173.2	-70.8	69.3	-154.7	0	0	111.1	I619 T651 G692 A699	I619-E695 HydrophobicContact CG2-CG 4.41Å; T651-E695 HydrophobicContact CG2-CB 3.77Å; T651-E695 WeakPolarHBondContact CG2-O 3.46Å; G692-E695 WeakPolarHBondContact CA-OE2 3.49Å; G692-E695 PolarHBondContact N-OE2 2.97Å; E695-A699 WeakPolarHBondContact O-CB 3.45Å; E695-A699 PolarHBondContact O-N 3.27Å
696	K	91.1	Very high	87.5	Confident	6 Å²	6	26.7 Å²	26.7	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-63.9	-46	175.2	-178.2	-170.6	-178.4	69.6	0	111.1	A652 I654 G692 L693 E694 A699 C700 L728 F731 V737	A652-K696 PolarHBondContact O-NZ 3.39Å; I654-K696 PolarHBondContact O-NZ 2.82Å; G692-K696 VanDerWaalsContact O-CB 3.27Å; G692-K696 WeakPolarHBondContact O-CB 3.49Å; G692-K696 PolarHBondContact O-N 2.83Å; L693-K696 WeakPolarHBondContact O-CB 3.27Å; L693-K696 PolarHBondContact O-N 3.07Å; E694-K696 VanDerWaalsContact C-N 3.29Å; E694-K696 PolarHBondContact O-N 2.77Å; K696-A699 PolarHBondContact O-N 2.83Å; K696-C700 PolarHBondContact O-N 3.19Å; K696-C700 PolarHBondContact O-SG 3.37Å; K696-L728 VanDerWaalsContact CE-CD2 3.48Å; K696-F731 HydrophobicContact CD-CE1 4.01Å; K696-F731 HydrophobicContact CD-CE2 4.34Å; K696-F731 HydrophobicContact CD-CZ 3.79Å; K696-V737 HydrophobicContact CD-CG2 4.25Å; K696-V737 HydrophobicContact CG-CG2 4.23Å
697	S	92.2	Very high	88.5	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-57.5	-53.9	176.2	-177.1	0	0	0	0	110.9	L693 E694 A699 C700 Q701 H734	L693-S697 PolarHBondContact O-N 3.31Å; E694-S697 WeakPolarHBondContact O-CB 3.26Å; E694-S697 PolarHBondContact O-N 2.92Å; S697-A699 VanDerWaalsContact C-N 3.33Å; S697-A699 PolarHBondContact O-N 2.86Å; S697-C700 WeakPolarHBondContact O-CB 3.4Å; S697-C700 PolarHBondContact O-N 3.36Å; S697-C700 VanDerWaalsContact O-N 3.07Å; S697-Q701 WeakPolarHBondContact O-CG 3.44Å; S697-Q701 PolarHBondContact O-N 3.04Å; S697-H734 PolarHBondContact OG-CE1 3.33Å; S697-H734 VanDerWaalsContact OG-CE1 3.31Å
698	T	89.4	Confident	89.1	Confident	19 Å²	19	30.4 Å²	30.4	12%	0.117	16%	0.159	C	C	.	.	H	α-helix	trans	-55.3	-46.9	176.5	-57.5	0	0	0	0	111.2	I623 E694 C700 Q701 M702	I623-T698 HydrophobicContact CG2-CG2 4.05Å; E694-T698 WeakPolarHBondContact O-CB 3.16Å; E694-T698 PolarHBondContact O-N 3.07Å; E694-T698 PolarHBondContact O-OG1 2.94Å; T698-C700 VanDerWaalsContact C-N 3.34Å; T698-C700 PolarHBondContact O-N 3.08Å; T698-Q701 PolarHBondContact O-N 3.26Å; T698-M702 HydrophobicContact CG2-CE 4.46Å; T698-M702 VanDerWaalsContact O-CG 3.29Å; T698-M702 WeakPolarHBondContact O-CG 3.28Å; T698-M702 PolarHBondContact O-N 3.17Å
699	A	91.9	Very high	89.6	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-39.7	178.2	0	0	0	0	0	112.8	I623 L648 T651 A652 E695 K696 S697 M702 L703	I623-A699 HydrophobicContact CD1-CB 4.22Å; L648-A699 HydrophobicContact CD1-CB 3.68Å; T651-A699 HydrophobicContact CG2-CB 3.91Å; A652-A699 HydrophobicContact CB-CB 3.83Å; E695-A699 WeakPolarHBondContact O-CB 3.45Å; E695-A699 PolarHBondContact O-N 3.27Å; K696-A699 PolarHBondContact O-N 2.83Å; S697-A699 VanDerWaalsContact C-N 3.33Å; S697-A699 PolarHBondContact O-N 2.86Å; A699-M702 PolarHBondContact O-N 2.98Å; A699-L703 PolarHBondContact O-N 3.04Å; A699-L703 VanDerWaalsContact O-N 3.15Å
700	C	95.7	Very high	90.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.7	-45.2	176.4	-66.1	0	0	0	0	111.5	K696 S697 T698 M702 L703 V704 M725 A740	K696-C700 PolarHBondContact O-N 3.19Å; K696-C700 PolarHBondContact O-SG 3.37Å; S697-C700 WeakPolarHBondContact O-CB 3.4Å; S697-C700 PolarHBondContact O-N 3.36Å; S697-C700 VanDerWaalsContact O-N 3.07Å; T698-C700 VanDerWaalsContact C-N 3.34Å; T698-C700 PolarHBondContact O-N 3.08Å; C700-M702 PolarHBondContact O-N 3.16Å; C700-L703 WeakPolarHBondContact O-CB 3.44Å; C700-L703 PolarHBondContact O-N 2.83Å; C700-L703 VanDerWaalsContact O-N 3.13Å; C700-V704 PolarHBondContact O-N 3.09Å; C700-V704 VanDerWaalsContact O-N 3.14Å; C700-M725 HydrophobicContact CB-CE 3.99Å; C700-M725 HydrophobicContact CB-SD 4.36Å; C700-M725 WeakPolarHBondContact O-CE 3.2Å; C700-A740 HydrophobicContact CB-CB 3.75Å
701	Q	92.8	Very high	90.6	Very high	81 Å²	81	36 Å²	36	38%	0.379	18%	0.182	S	C	.	.	H	α-helix	trans	-58.8	-37.3	174.2	-68.3	172.5	-2.2	0	0	111.7	S697 T698 L703 V704 C705 A740	S697-Q701 WeakPolarHBondContact O-CG 3.44Å; S697-Q701 PolarHBondContact O-N 3.04Å; T698-Q701 PolarHBondContact O-N 3.26Å; Q701-L703 VanDerWaalsContact C-N 3.35Å; Q701-L703 PolarHBondContact O-N 3.16Å; Q701-V704 VanDerWaalsContact O-CB 3.29Å; Q701-V704 WeakPolarHBondContact O-CB 3.38Å; Q701-V704 PolarHBondContact O-N 2.97Å; Q701-C705 PolarHBondContact O-N 3.04Å; Q701-C705 PolarHBondContact O-SG 3.46Å; Q701-C705 VanDerWaalsContact O-SG 3.36Å; Q701-A740 HydrophobicContact CG-CB 3.99Å
702	M	91.4	Very high	91.1	Very high	20 Å²	20	40.1 Å²	40.1	10%	0.099	19%	0.193	C	C	.	.	H	α-helix	trans	-69.4	-33	178	-65.7	-40.2	101.7	0	0	112.6	I623 A627 L648 T698 A699 C700 V704 C705 Y706	I623-M702 HydrophobicContact CG2-CB 4.07Å; I623-M702 HydrophobicContact CG2-CG 3.35Å; A627-M702 HydrophobicContact CB-CB 4.43Å; A627-M702 HydrophobicContact CB-CG 3.93Å; A627-M702 HydrophobicContact CB-SD 3.01Å; A627-M702 WeakPolarHBondContact CB-SD 3.36Å; L648-M702 HydrophobicContact CD1-CB 4.07Å; L648-M702 HydrophobicContact CD2-CB 4.22Å; T698-M702 HydrophobicContact CG2-CE 4.46Å; T698-M702 VanDerWaalsContact O-CG 3.29Å; T698-M702 WeakPolarHBondContact O-CG 3.28Å; T698-M702 PolarHBondContact O-N 3.17Å; A699-M702 PolarHBondContact O-N 2.98Å; C700-M702 PolarHBondContact O-N 3.16Å; M702-V704 VanDerWaalsContact C-N 3.32Å; M702-C705 WeakPolarHBondContact O-CB 3.32Å; M702-C705 PolarHBondContact O-N 3.25Å; M702-Y706 PolarHBondContact O-N 3.47Å
703	L	95.6	Very high	91.7	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-39.2	170.9	-68.8	169.7	0	0	0	111.4	M645 L648 M649 A652 A699 C700 Q701 Y706 A707 F714 V721 L724 M725	M645-L703 HydrophobicContact CE-CD2 3.64Å; M645-L703 HydrophobicContact SD-CD2 4.18Å; L648-L703 HydrophobicContact CD2-CD2 3.55Å; L648-L703 HydrophobicContact CD2-CG 3.86Å; L648-L703 HydrophobicContact CG-CD2 4.05Å; L648-L703 HydrophobicContact CG-CG 4.14Å; M649-L703 HydrophobicContact SD-CD1 4.09Å; M649-L703 HydrophobicContact SD-CD2 4.05Å; A652-L703 HydrophobicContact CB-CD1 3.94Å; A699-L703 PolarHBondContact O-N 3.04Å; A699-L703 VanDerWaalsContact O-N 3.15Å; C700-L703 WeakPolarHBondContact O-CB 3.44Å; C700-L703 PolarHBondContact O-N 2.83Å; C700-L703 VanDerWaalsContact O-N 3.13Å; Q701-L703 VanDerWaalsContact C-N 3.35Å; Q701-L703 PolarHBondContact O-N 3.16Å; L703-Y706 PolarHBondContact O-N 3.02Å; L703-A707 WeakPolarHBondContact O-CB 3.37Å; L703-A707 PolarHBondContact O-N 3.49Å; L703-F714 HydrophobicContact CD2-CZ 4.17Å; L703-V721 HydrophobicContact CB-CG1 4.36Å; L703-V721 HydrophobicContact CD1-CG1 4.27Å; L703-V721 HydrophobicContact CD2-CG2 4.01Å; L703-L724 HydrophobicContact CD1-CD2 3.93Å; L703-M725 HydrophobicContact CB-CE 3.6Å; L703-M725 HydrophobicContact CD1-CE 3.66Å; L703-M725 HydrophobicContact CG-CE 4.26Å
704	V	95.9	Very high	92.1	Very high	8 Å²	8	40 Å²	40	5%	0.048	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-49.1	171.7	175.2	0	0	0	0	110.4	C700 Q701 M702 Y706 A707 K708 A740 E743 L747	C700-V704 PolarHBondContact O-N 3.09Å; C700-V704 VanDerWaalsContact O-N 3.14Å; Q701-V704 VanDerWaalsContact O-CB 3.29Å; Q701-V704 WeakPolarHBondContact O-CB 3.38Å; Q701-V704 PolarHBondContact O-N 2.97Å; M702-V704 VanDerWaalsContact C-N 3.32Å; V704-Y706 PolarHBondContact O-N 3.38Å; V704-A707 PolarHBondContact O-N 3.45Å; V704-K708 WeakPolarHBondContact O-CB 3.41Å; V704-K708 PolarHBondContact O-N 2.93Å; V704-A740 HydrophobicContact CG2-CB 4.17Å; V704-A740 WeakPolarHBondContact CG2-O 3.2Å; V704-E743 HydrophobicContact CG1-CB 4.13Å; V704-E743 HydrophobicContact CG2-CB 4.36Å; V704-L747 HydrophobicContact CG1-CD1 3.64Å
705	C	91.4	Very high	92.6	Very high	49 Å²	49	35.1 Å²	35.1	33%	0.331	17%	0.173	S	C	.	.	H	α-helix	trans	-57.2	-47.3	177	-66.3	0	0	0	0	112.1	Q701 M702 A707 K708 E709	Q701-C705 PolarHBondContact O-N 3.04Å; Q701-C705 PolarHBondContact O-SG 3.46Å; Q701-C705 VanDerWaalsContact O-SG 3.36Å; M702-C705 WeakPolarHBondContact O-CB 3.32Å; M702-C705 PolarHBondContact O-N 3.25Å; C705-A707 PolarHBondContact O-N 3.5Å; C705-K708 PolarHBondContact O-N 2.95Å; C705-E709 WeakPolarHBondContact O-CB 3.46Å; C705-E709 VanDerWaalsContact O-CG 3.3Å; C705-E709 WeakPolarHBondContact O-CG 3.48Å; C705-E709 PolarHBondContact O-N 3.23Å
706	Y	93.7	Very high	93.1	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-41.7	179.3	-66.5	-21.6	0	0	0	113	W626 A627 C630 F637 L641 V644 M645 L648 M702 L703 V704 K708 L710 F714	W626-Y706 WeakPolarHBondContact CB-OH 3.39Å; A627-Y706 HydrophobicContact CB-CE1 4.35Å; C630-Y706 HydrophobicContact CB-CD1 3.81Å; C630-Y706 HydrophobicContact CB-CE1 3.48Å; C630-Y706 VanDerWaalsContact CB-CE1 3.48Å; F637-Y706 HydrophobicContact CE1-CD1 4.47Å; F637-Y706 AromaticContact CE1-CE1 3.85Å; F637-Y706 HydrophobicContact CE1-CE1 3.85Å; F637-Y706 AromaticContact CE1-CZ 3.99Å; F637-Y706 HydrophobicContact CZ-CE1 4.32Å; L641-Y706 HydrophobicContact CD2-CD2 4.49Å; V644-Y706 HydrophobicContact CG2-CE2 4.26Å; M645-Y706 HydrophobicContact SD-CD2 3.99Å; M645-Y706 HydrophobicContact SD-CE2 4.36Å; L648-Y706 HydrophobicContact CD2-CD2 3.78Å; L648-Y706 HydrophobicContact CD2-CE2 3.4Å; M702-Y706 PolarHBondContact O-N 3.47Å; L703-Y706 PolarHBondContact O-N 3.02Å; V704-Y706 PolarHBondContact O-N 3.38Å; Y706-K708 VanDerWaalsContact C-N 3.34Å; Y706-K708 PolarHBondContact O-N 3.03Å; Y706-L710 VanDerWaalsContact O-CB 3.24Å; Y706-L710 WeakPolarHBondContact O-CB 3.46Å; Y706-L710 PolarHBondContact O-N 3.5Å; Y706-F714 HydrophobicContact CD2-CE2 4.31Å; Y706-F714 HydrophobicContact CG-CE2 4.45Å
707	A	94.7	Very high	93.3	Very high	3 Å²	3	41.7 Å²	41.7	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-44.2	175.5	0	0	0	0	0	111.3	L703 V704 C705 K711 F714 L747 L748 C751	L703-A707 WeakPolarHBondContact O-CB 3.37Å; L703-A707 PolarHBondContact O-N 3.49Å; V704-A707 PolarHBondContact O-N 3.45Å; C705-A707 PolarHBondContact O-N 3.5Å; A707-K711 WeakPolarHBondContact O-CA 3.44Å; A707-K711 PolarHBondContact O-N 2.99Å; A707-K711 VanDerWaalsContact O-N 3.13Å; A707-F714 HydrophobicContact CB-CD1 3.97Å; A707-F714 HydrophobicContact CB-CE1 4.18Å; A707-L747 HydrophobicContact CB-CB 4.07Å; A707-L748 HydrophobicContact CB-CD2 4.39Å; A707-C751 PolarHBondContact O-SG 3.18Å
708	K	91.9	Very high	93.6	Very high	121 Å²	121	41.6 Å²	41.6	53%	0.526	20%	0.202	S	C	.	.	H	α-helix	trans	-65.4	-48.8	179.8	-173.8	176.8	179.9	174.2	0	113.2	V704 C705 Y706 K711 L747	V704-K708 WeakPolarHBondContact O-CB 3.41Å; V704-K708 PolarHBondContact O-N 2.93Å; C705-K708 PolarHBondContact O-N 2.95Å; Y706-K708 VanDerWaalsContact C-N 3.34Å; Y706-K708 PolarHBondContact O-N 3.03Å; K708-K711 WeakPolarHBondContact O-CE 3.42Å; K708-K711 VanDerWaalsContact O-CG 3.3Å; K708-K711 WeakPolarHBondContact O-CG 3.47Å; K708-L747 HydrophobicContact CB-CD1 4.09Å; K708-L747 HydrophobicContact CB-CD2 4.26Å; K708-L747 HydrophobicContact CG-CD2 4.37Å
709	E	90.8	Very high	93.9	Very high	86 Å²	86	44.2 Å²	44.2	40%	0.402	21%	0.213	S	C	.	.	H	α-helix	trans	-80	-38.6	-172.5	-63	-54	147.5	0	0	112.6	C705	C705-E709 WeakPolarHBondContact O-CB 3.46Å; C705-E709 VanDerWaalsContact O-CG 3.3Å; C705-E709 WeakPolarHBondContact O-CG 3.48Å; C705-E709 PolarHBondContact O-N 3.23Å
710	L	92.3	Very high	94.2	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-91.2	-24.3	-174.6	-56.9	178.5	0	0	0	113	G634 F637 Q638 L641 Y706 E712 G713 F714	G634-L710 WeakPolarHBondContact O-CD2 3.39Å; F637-L710 HydrophobicContact CB-CD2 4.49Å; F637-L710 HydrophobicContact CD1-CD1 4.26Å; Q638-L710 HydrophobicContact CG-CD2 4.37Å; L641-L710 HydrophobicContact CD1-CD1 3.76Å; L641-L710 HydrophobicContact CD2-CD1 3.86Å; L641-L710 HydrophobicContact CG-CD1 4.03Å; Y706-L710 VanDerWaalsContact O-CB 3.24Å; Y706-L710 WeakPolarHBondContact O-CB 3.46Å; Y706-L710 PolarHBondContact O-N 3.5Å; L710-E712 PolarHBondContact O-N 3.33Å; L710-G713 PolarHBondContact O-N 3.33Å; L710-F714 HydrophobicContact CB-CB 4.36Å
711	K	91.6	Very high	94.3	Very high	134 Å²	134	48.1 Å²	48.1	58%	0.583	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	46.9	-111.1	179.8	-57.2	-176.2	179.4	-179.7	0	111.5	A707 K708 G713 F714 C751	A707-K711 WeakPolarHBondContact O-CA 3.44Å; A707-K711 PolarHBondContact O-N 2.99Å; A707-K711 VanDerWaalsContact O-N 3.13Å; K708-K711 WeakPolarHBondContact O-CE 3.42Å; K708-K711 VanDerWaalsContact O-CG 3.3Å; K708-K711 WeakPolarHBondContact O-CG 3.47Å; K711-G713 PolarHBondContact O-N 3.38Å; K711-F714 WeakPolarHBondContact O-CB 3.41Å; K711-F714 PolarHBondContact O-N 3.09Å; K711-C751 PolarHBondContact O-SG 3.17Å; K711-C751 VanDerWaalsContact O-SG 3.37Å
712	E	90.7	Very high	94.6	Very high	132 Å²	132	44.3 Å²	44.3	62%	0.617	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-53.5	-25.6	176.3	-58.8	176.6	169.1	0	0	113.8	L710 F714 V715 V754	L710-E712 PolarHBondContact O-N 3.33Å; E712-F714 VanDerWaalsContact C-N 3.27Å; E712-F714 PolarHBondContact O-N 3.11Å; E712-V715 WeakPolarHBondContact O-CG2 3.5Å; E712-V754 HydrophobicContact CG-CB 4.24Å; E712-V754 HydrophobicContact CG-CG2 4.21Å
713	G	93.3	Very high	94.9	Very high	17 Å²	17	48.2 Å²	48.2	18%	0.175	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-70.1	-17.5	175.2	0	0	0	0	0	115.4	L710 K711	L710-G713 PolarHBondContact O-N 3.33Å; K711-G713 PolarHBondContact O-N 3.38Å
714	F	96.2	Very high	95	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-98.4	-1.9	-174.1	-161.7	-112.9	0	0	0	113.7	L641 M645 L703 Y706 A707 L710 K711 E712 E716 Y717 T718 V721 L748	L641-F714 HydrophobicContact CD2-CD2 4.25Å; L641-F714 HydrophobicContact CD2-CE2 4.32Å; M645-F714 HydrophobicContact CE-CE2 3.87Å; M645-F714 HydrophobicContact CE-CZ 3.82Å; M645-F714 HydrophobicContact SD-CE2 3.63Å; M645-F714 HydrophobicContact SD-CZ 4.14Å; L703-F714 HydrophobicContact CD2-CZ 4.17Å; Y706-F714 HydrophobicContact CD2-CE2 4.31Å; Y706-F714 HydrophobicContact CG-CE2 4.45Å; A707-F714 HydrophobicContact CB-CD1 3.97Å; A707-F714 HydrophobicContact CB-CE1 4.18Å; L710-F714 HydrophobicContact CB-CB 4.36Å; K711-F714 WeakPolarHBondContact O-CB 3.41Å; K711-F714 PolarHBondContact O-N 3.09Å; E712-F714 VanDerWaalsContact C-N 3.27Å; E712-F714 PolarHBondContact O-N 3.11Å; F714-E716 VanDerWaalsContact C-N 3.26Å; F714-E716 PolarHBondContact O-N 2.93Å; F714-E716 VanDerWaalsContact O-N 3.13Å; F714-Y717 HydrophobicContact CD2-CD2 4.18Å; F714-Y717 HydrophobicContact CE2-CD2 4.28Å; F714-Y717 PolarHBondContact O-N 3.39Å; F714-T718 PolarHBondContact O-N 3.01Å; F714-T718 PolarHBondContact O-OG1 3.2Å; F714-V721 HydrophobicContact CE1-CB 4.47Å; F714-V721 HydrophobicContact CE1-CG2 3.98Å; F714-V721 HydrophobicContact CZ-CG2 3.93Å; F714-L748 HydrophobicContact CD1-CD2 4.29Å; F714-L748 HydrophobicContact CE1-CD2 3.99Å
715	V	96.1	Very high	95.1	Very high	12 Å²	12	49 Å²	49	7%	0.073	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-57.2	-34.4	-169.5	176.8	0	0	0	0	113.9	E712 Y717 T718 C751 V754 R755	E712-V715 WeakPolarHBondContact O-CG2 3.5Å; V715-Y717 PolarHBondContact O-N 3.22Å; V715-T718 WeakPolarHBondContact CA-OG1 3.45Å; V715-T718 PolarHBondContact O-N 2.96Å; V715-T718 PolarHBondContact O-OG1 3.34Å; V715-C751 VanDerWaalsContact CG2-O 3.31Å; V715-C751 WeakPolarHBondContact CG2-O 3.15Å; V715-V754 HydrophobicContact CB-CG1 4.36Å; V715-V754 HydrophobicContact CG1-CG1 4.22Å; V715-V754 HydrophobicContact CG2-CG1 3.29Å; V715-R755 HydrophobicContact CG1-CG 3.38Å; V715-R755 VanDerWaalsContact CG1-NE 3.32Å
716	E	96	Very high	95.4	Very high	152 Å²	152	47.7 Å²	47.7	71%	0.71	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-65.1	-23.4	179.8	-62.1	-167.1	159	0	0	112.7	F714	F714-E716 VanDerWaalsContact C-N 3.26Å; F714-E716 PolarHBondContact O-N 2.93Å; F714-E716 VanDerWaalsContact O-N 3.13Å
717	Y	96.9	Very high	95.6	Very high	31 Å²	31	51.7 Å²	51.7	12%	0.122	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-104	-6.6	-178	-54.7	-71.8	0	0	0	113	L641 P642 M645 F714 V715 E719 Q720 V721	L641-Y717 HydrophobicContact CB-CE2 3.71Å; L641-Y717 HydrophobicContact CD1-CD2 4.39Å; L641-Y717 HydrophobicContact CD1-CE2 3.89Å; L641-Y717 HydrophobicContact CD2-CE2 4.31Å; L641-Y717 HydrophobicContact CG-CE2 4.21Å; P642-Y717 WeakPolarHBondContact CA-OH 3.3Å; M645-Y717 HydrophobicContact CB-CD1 4.2Å; M645-Y717 HydrophobicContact CB-CE1 3.88Å; M645-Y717 HydrophobicContact CE-CD1 4.04Å; M645-Y717 HydrophobicContact CE-CG 3.88Å; M645-Y717 HydrophobicContact CG-CD1 4.01Å; M645-Y717 HydrophobicContact CG-CD2 4.12Å; M645-Y717 HydrophobicContact CG-CE1 3.84Å; M645-Y717 HydrophobicContact CG-CE2 4.01Å; M645-Y717 HydrophobicContact CG-CG 4.12Å; M645-Y717 HydrophobicContact SD-CG 4.5Å; F714-Y717 HydrophobicContact CD2-CD2 4.18Å; F714-Y717 HydrophobicContact CE2-CD2 4.28Å; F714-Y717 PolarHBondContact O-N 3.39Å; V715-Y717 PolarHBondContact O-N 3.22Å; Y717-E719 PolarHBondContact O-N 3.33Å; Y717-Q720 VanDerWaalsContact CD1-NE2 3.33Å; Y717-Q720 WeakPolarHBondContact O-CG 3.46Å; Y717-Q720 PolarHBondContact O-N 2.99Å; Y717-V721 VanDerWaalsContact O-CG2 3.31Å; Y717-V721 WeakPolarHBondContact O-CG2 3.22Å; Y717-V721 PolarHBondContact O-N 3.27Å; Y717-V721 VanDerWaalsContact O-N 3.11Å
718	T	96.7	Very high	95.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-56.6	-52.6	-173.6	-54.1	0	0	0	0	112.4	F714 V715 Q720 V721 V722 L748 A752 M763	F714-T718 PolarHBondContact O-N 3.01Å; F714-T718 PolarHBondContact O-OG1 3.2Å; V715-T718 WeakPolarHBondContact CA-OG1 3.45Å; V715-T718 PolarHBondContact O-N 2.96Å; V715-T718 PolarHBondContact O-OG1 3.34Å; T718-Q720 PolarHBondContact O-N 3.47Å; T718-V721 PolarHBondContact O-N 3.31Å; T718-V721 VanDerWaalsContact O-N 3.16Å; T718-V722 HydrophobicContact CG2-CG2 4.14Å; T718-V722 VanDerWaalsContact O-CG2 3.26Å; T718-V722 WeakPolarHBondContact O-CG2 3.45Å; T718-V722 PolarHBondContact O-N 3.32Å; T718-L748 HydrophobicContact CG2-CB 4.11Å; T718-L748 HydrophobicContact CG2-CD2 4.1Å; T718-L748 VanDerWaalsContact CG2-O 3.29Å; T718-L748 WeakPolarHBondContact CG2-O 3.46Å; T718-A752 HydrophobicContact CG2-CB 4.16Å; T718-M763 HydrophobicContact CG2-CG 4.47Å; T718-M763 HydrophobicContact CG2-SD 4.47Å
719	E	97.5	Very high	95.9	Very high	74 Å²	74	46.5 Å²	46.5	35%	0.346	23%	0.228	S	C	.	.	H	α-helix	trans	-60.6	-41.5	-175.5	-179.8	178.8	165.5	0	0	113.1	Y717 K723 Y759 M763	Y717-E719 PolarHBondContact O-N 3.33Å; E719-K723 HydrophobicContact CG-CD 4.48Å; E719-K723 WeakPolarHBondContact O-CG 3.42Å; E719-K723 PolarHBondContact O-N 2.95Å; E719-K723 VanDerWaalsContact O-N 3.15Å; E719-K723 WeakPolarHBondContact OE1-CE 3.44Å; E719-K723 IonicContact OE1-NZ 2.91Å; E719-K723 PolarHBondContact OE1-NZ 3.41Å; E719-Y759 PolarHBondContact N-OH 3.25Å; E719-M763 HydrophobicContact CB-CE 4.14Å; E719-M763 HydrophobicContact CB-SD 3.97Å; E719-M763 HydrophobicContact CG-CE 3.98Å; E719-M763 HydrophobicContact CG-SD 4.3Å
720	Q	97.4	Very high	96.1	Very high	82 Å²	82	47 Å²	47	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-67.7	-37.4	178.9	58.8	167.4	37.8	0	0	111.8	M649 Y717 T718 K723 L724	M649-Q720 HydrophobicContact CE-CB 4.25Å; M649-Q720 HydrophobicContact CE-CG 4.21Å; Y717-Q720 VanDerWaalsContact CD1-NE2 3.33Å; Y717-Q720 WeakPolarHBondContact O-CG 3.46Å; Y717-Q720 PolarHBondContact O-N 2.99Å; T718-Q720 PolarHBondContact O-N 3.47Å; Q720-K723 PolarHBondContact O-N 3.16Å; Q720-L724 PolarHBondContact O-N 3.38Å; Q720-L724 VanDerWaalsContact O-N 3.11Å
721	V	98.1	Very high	96	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-72.9	-38.9	179.4	178.1	0	0	0	0	110.2	M645 M649 L703 F714 Y717 T718 K723 L724 M725 L748	M645-V721 HydrophobicContact CE-CG2 4.21Å; M649-V721 HydrophobicContact CE-CG2 4.36Å; M649-V721 HydrophobicContact SD-CG2 3.78Å; L703-V721 HydrophobicContact CB-CG1 4.36Å; L703-V721 HydrophobicContact CD1-CG1 4.27Å; L703-V721 HydrophobicContact CD2-CG2 4.01Å; F714-V721 HydrophobicContact CE1-CB 4.47Å; F714-V721 HydrophobicContact CE1-CG2 3.98Å; F714-V721 HydrophobicContact CZ-CG2 3.93Å; Y717-V721 VanDerWaalsContact O-CG2 3.31Å; Y717-V721 WeakPolarHBondContact O-CG2 3.22Å; Y717-V721 PolarHBondContact O-N 3.27Å; Y717-V721 VanDerWaalsContact O-N 3.11Å; T718-V721 PolarHBondContact O-N 3.31Å; T718-V721 VanDerWaalsContact O-N 3.16Å; V721-K723 VanDerWaalsContact C-N 3.33Å; V721-K723 PolarHBondContact O-N 3.33Å; V721-L724 WeakPolarHBondContact O-CB 3.46Å; V721-L724 PolarHBondContact O-N 3.15Å; V721-L724 VanDerWaalsContact O-N 3.1Å; V721-M725 HydrophobicContact CG1-CE 4.27Å; V721-M725 HydrophobicContact CG1-CG 3.82Å; V721-M725 WeakPolarHBondContact O-CB 3.47Å; V721-M725 VanDerWaalsContact O-CG 3.31Å; V721-M725 WeakPolarHBondContact O-CG 3.43Å; V721-M725 PolarHBondContact O-N 3.49Å; V721-L748 HydrophobicContact CB-CD1 4.48Å; V721-L748 HydrophobicContact CB-CD2 4.02Å; V721-L748 HydrophobicContact CG1-CD1 3.87Å; V721-L748 HydrophobicContact CG1-CD2 3.86Å; V721-L748 HydrophobicContact CG1-CG 4.49Å
722	V	98.4	Very high	95.8	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-48.3	173	171.4	0	0	0	0	110.8	T718 L724 M725 V726 L748 M763 F766 M767	T718-V722 HydrophobicContact CG2-CG2 4.14Å; T718-V722 VanDerWaalsContact O-CG2 3.26Å; T718-V722 WeakPolarHBondContact O-CG2 3.45Å; T718-V722 PolarHBondContact O-N 3.32Å; V722-L724 PolarHBondContact O-N 3.14Å; V722-M725 PolarHBondContact O-N 3.3Å; V722-V726 HydrophobicContact CG1-CG2 4.21Å; V722-V726 VanDerWaalsContact O-CG2 3.3Å; V722-V726 WeakPolarHBondContact O-CG2 3.4Å; V722-V726 PolarHBondContact O-N 3.47Å; V722-V726 VanDerWaalsContact O-N 3.08Å; V722-L748 HydrophobicContact CG2-CB 3.95Å; V722-L748 HydrophobicContact CG2-CD1 3.8Å; V722-L748 HydrophobicContact CG2-CG 4.33Å; V722-M763 HydrophobicContact CB-SD 4.43Å; V722-M763 HydrophobicContact CG2-SD 4.12Å; V722-F766 HydrophobicContact CG1-CB 3.79Å; V722-F766 HydrophobicContact CG1-CD2 4.34Å; V722-F766 HydrophobicContact CG1-CG 4.36Å; V722-M767 HydrophobicContact CB-CE 4.07Å; V722-M767 HydrophobicContact CG1-CE 3.65Å; V722-M767 HydrophobicContact CG1-CG 4.1Å; V722-M767 HydrophobicContact CG2-CE 3.28Å
723	K	97.6	Very high	95.6	Very high	102 Å²	102	43.8 Å²	43.8	44%	0.443	21%	0.211	S	C	.	.	H	α-helix	trans	-65	-27.3	178.8	-71.2	177.7	-173.1	169.7	0	113.3	E719 Q720 V721 P727	E719-K723 HydrophobicContact CG-CD 4.48Å; E719-K723 WeakPolarHBondContact O-CG 3.42Å; E719-K723 PolarHBondContact O-N 2.95Å; E719-K723 VanDerWaalsContact O-N 3.15Å; E719-K723 WeakPolarHBondContact OE1-CE 3.44Å; E719-K723 IonicContact OE1-NZ 2.91Å; E719-K723 PolarHBondContact OE1-NZ 3.41Å; Q720-K723 PolarHBondContact O-N 3.16Å; V721-K723 VanDerWaalsContact C-N 3.33Å; V721-K723 PolarHBondContact O-N 3.33Å; K723-P727 VanDerWaalsContact O-CD 3.27Å; K723-P727 WeakPolarHBondContact O-CD 3.44Å
724	L	97.9	Very high	95.5	Very high	25 Å²	25	44.3 Å²	44.3	13%	0.131	21%	0.209	C	C	.	.	H	α-helix	trans	-76.4	-47.8	174.4	174.3	62.3	0	0	0	111.7	M649 A652 S653 L703 Q720 V721 V722 P727 L728	M649-L724 HydrophobicContact CE-CB 4.12Å; M649-L724 HydrophobicContact CE-CD2 3.61Å; M649-L724 HydrophobicContact CE-CG 4.48Å; M649-L724 HydrophobicContact SD-CD2 3.85Å; A652-L724 HydrophobicContact CB-CD2 3.76Å; S653-L724 VanDerWaalsContact OG-CD1 3.32Å; S653-L724 WeakPolarHBondContact OG-CD1 3.49Å; L703-L724 HydrophobicContact CD1-CD2 3.93Å; Q720-L724 PolarHBondContact O-N 3.38Å; Q720-L724 VanDerWaalsContact O-N 3.11Å; V721-L724 WeakPolarHBondContact O-CB 3.46Å; V721-L724 PolarHBondContact O-N 3.15Å; V721-L724 VanDerWaalsContact O-N 3.1Å; V722-L724 PolarHBondContact O-N 3.14Å; L724-P727 WeakPolarHBondContact O-CD 3.43Å; L724-L728 HydrophobicContact CD1-CD1 4.36Å; L724-L728 HydrophobicContact CG-CD1 4.32Å; L724-L728 WeakPolarHBondContact O-CG 3.32Å
725	M	98.2	Very high	95.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-75.5	-32.7	-171.4	-66.7	-61.1	-159.4	0	0	113.3	C700 L703 V721 V722 L728 L729 A741 S744 M745	C700-M725 HydrophobicContact CB-CE 3.99Å; C700-M725 HydrophobicContact CB-SD 4.36Å; C700-M725 WeakPolarHBondContact O-CE 3.2Å; L703-M725 HydrophobicContact CB-CE 3.6Å; L703-M725 HydrophobicContact CD1-CE 3.66Å; L703-M725 HydrophobicContact CG-CE 4.26Å; V721-M725 HydrophobicContact CG1-CE 4.27Å; V721-M725 HydrophobicContact CG1-CG 3.82Å; V721-M725 WeakPolarHBondContact O-CB 3.47Å; V721-M725 VanDerWaalsContact O-CG 3.31Å; V721-M725 WeakPolarHBondContact O-CG 3.43Å; V721-M725 PolarHBondContact O-N 3.49Å; V722-M725 PolarHBondContact O-N 3.3Å; M725-L728 WeakPolarHBondContact O-CA 3.31Å; M725-L728 WeakPolarHBondContact O-CB 3.49Å; M725-L728 PolarHBondContact O-N 2.91Å; M725-L728 HydrophobicContact SD-CD1 4.05Å; M725-L729 PolarHBondContact O-N 3.3Å; M725-A741 HydrophobicContact CB-CB 4.41Å; M725-A741 HydrophobicContact SD-CB 4.41Å; M725-S744 WeakPolarHBondContact CG-OG 3.35Å; M725-M745 HydrophobicContact CB-CE 3.74Å
726	V	98.3	Very high	95.2	Very high	23 Å²	23	48.2 Å²	48.2	14%	0.139	23%	0.233	C	C	.	.	H	α-helix	trans	-57.6	-48.4	-177.4	164	0	0	0	0	113	V722 L728 L729 M745 F766 M767 A770	V722-V726 HydrophobicContact CG1-CG2 4.21Å; V722-V726 VanDerWaalsContact O-CG2 3.3Å; V722-V726 WeakPolarHBondContact O-CG2 3.4Å; V722-V726 PolarHBondContact O-N 3.47Å; V722-V726 VanDerWaalsContact O-N 3.08Å; V726-L728 PolarHBondContact O-N 2.62Å; V726-L729 PolarHBondContact O-N 3.39Å; V726-M745 HydrophobicContact CG2-CE 3.96Å; V726-M745 HydrophobicContact CG2-SD 4.13Å; V726-F766 WeakPolarHBondContact CG1-O 3.47Å; V726-M767 HydrophobicContact CG2-CB 4.43Å; V726-M767 HydrophobicContact CG2-CG 3.97Å; V726-A770 HydrophobicContact CG1-CB 3.58Å
727	P	97.4	Very high	95.3	Very high	86 Å²	86	41 Å²	41	56%	0.558	20%	0.2	S	C	*	.	H	α-helix	trans	-62.9	-26.8	173.6	-24.4	34.1	0	0	0	114.2	K723 L724 L729 K730	K723-P727 VanDerWaalsContact O-CD 3.27Å; K723-P727 WeakPolarHBondContact O-CD 3.44Å; L724-P727 WeakPolarHBondContact O-CD 3.43Å; P727-L729 PolarHBondContact O-N 3.23Å; P727-K730 PolarHBondContact O-N 3.15Å
728	L	97.5	Very high	95.3	Very high	13 Å²	13	39.8 Å²	39.8	7%	0.068	20%	0.195	C	C	.	.	H	α-helix	trans	-73.2	-14.8	-176.8	-63.9	179.7	0	0	0	113.4	K696 L724 M725 V726 K730 F731 V737 R738 A741	K696-L728 VanDerWaalsContact CE-CD2 3.48Å; L724-L728 HydrophobicContact CD1-CD1 4.36Å; L724-L728 HydrophobicContact CG-CD1 4.32Å; L724-L728 WeakPolarHBondContact O-CG 3.32Å; M725-L728 WeakPolarHBondContact O-CA 3.31Å; M725-L728 WeakPolarHBondContact O-CB 3.49Å; M725-L728 PolarHBondContact O-N 2.91Å; M725-L728 HydrophobicContact SD-CD1 4.05Å; V726-L728 PolarHBondContact O-N 2.62Å; L728-K730 PolarHBondContact O-N 3.3Å; L728-K730 VanDerWaalsContact O-N 3.16Å; L728-F731 HydrophobicContact CD2-CB 4.25Å; L728-F731 HydrophobicContact CD2-CD2 4.19Å; L728-F731 HydrophobicContact CD2-CG 4.3Å; L728-F731 VanDerWaalsContact O-CB 3.25Å; L728-F731 WeakPolarHBondContact O-CB 3.49Å; L728-F731 PolarHBondContact O-N 3.43Å; L728-F731 VanDerWaalsContact O-N 3.09Å; L728-V737 HydrophobicContact CB-CG1 3.98Å; L728-V737 HydrophobicContact CD1-CG1 4.15Å; L728-V737 HydrophobicContact CD2-CG1 4.1Å; L728-V737 HydrophobicContact CG-CG1 4.29Å; L728-R738 WeakPolarHBondContact O-CG 3.38Å; L728-A741 HydrophobicContact CB-CB 3.88Å
729	L	96.1	Very high	95.4	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-23.6	167.4	-67.7	171	0	0	0	112.9	M725 V726 P727 A741 A742 M745 A770 L771 A774 I787	M725-L729 PolarHBondContact O-N 3.3Å; V726-L729 PolarHBondContact O-N 3.39Å; P727-L729 PolarHBondContact O-N 3.23Å; L729-A741 HydrophobicContact CD2-CB 4.09Å; L729-A741 HydrophobicContact CG-CB 4.36Å; L729-A742 HydrophobicContact CD2-CB 4.12Å; L729-M745 HydrophobicContact CD1-CE 4.01Å; L729-M745 HydrophobicContact CD2-CE 4.37Å; L729-M745 HydrophobicContact CG-CE 4.1Å; L729-A770 HydrophobicContact CD1-CB 4.23Å; L729-L771 HydrophobicContact CD1-CD2 3.79Å; L729-L771 HydrophobicContact CD1-CG 4.08Å; L729-L771 HydrophobicContact CD2-CD2 4.2Å; L729-A774 HydrophobicContact CB-CB 4.39Å; L729-I787 HydrophobicContact CD2-CG1 4.3Å
730	K	93.1	Very high	95.4	Very high	97 Å²	97	38 Å²	38	42%	0.422	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	19.4	179.6	-61.7	-177.3	178.2	-176.2	0	112.5	P727 L728 Y732	P727-K730 PolarHBondContact O-N 3.15Å; L728-K730 PolarHBondContact O-N 3.3Å; L728-K730 VanDerWaalsContact O-N 3.16Å; K730-Y732 VanDerWaalsContact C-N 3.28Å; K730-Y732 HydrophobicContact CB-CE2 4.29Å; K730-Y732 WeakPolarHBondContact O-CD2 3.45Å; K730-Y732 PolarHBondContact O-N 3.04Å; K730-Y732 VanDerWaalsContact O-N 3.1Å
731	F	91.9	Very high	95.4	Very high	19 Å²	19	34.1 Å²	34.1	8%	0.083	17%	0.171	C	C	.	.			trans	-84.8	73	177.6	-166.3	-98.7	0	0	0	109.7	P656 L693 K696 L728 F733 H734 V737 R738	P656-F731 HydrophobicContact CG-CE2 3.76Å; P656-F731 HydrophobicContact CG-CZ 3.74Å; L693-F731 HydrophobicContact CD2-CE1 3.86Å; L693-F731 HydrophobicContact CD2-CZ 3.63Å; K696-F731 HydrophobicContact CD-CE1 4.01Å; K696-F731 HydrophobicContact CD-CE2 4.34Å; K696-F731 HydrophobicContact CD-CZ 3.79Å; L728-F731 HydrophobicContact CD2-CB 4.25Å; L728-F731 HydrophobicContact CD2-CD2 4.19Å; L728-F731 HydrophobicContact CD2-CG 4.3Å; L728-F731 VanDerWaalsContact O-CB 3.25Å; L728-F731 WeakPolarHBondContact O-CB 3.49Å; L728-F731 PolarHBondContact O-N 3.43Å; L728-F731 VanDerWaalsContact O-N 3.09Å; F731-F733 HydrophobicContact CD1-CB 4.12Å; F731-F733 HydrophobicContact CD1-CD2 4.36Å; F731-F733 AromaticContact CD2-CD2 3.8Å; F731-F733 HydrophobicContact CD2-CD2 3.8Å; F731-F733 HydrophobicContact CD2-CE2 4.4Å; F731-F733 HydrophobicContact CE1-CB 3.74Å; F731-F733 HydrophobicContact CE1-CD2 4.14Å; F731-F733 HydrophobicContact CE1-CG 4.46Å; F731-F733 AromaticContact CE2-CD2 3.56Å; F731-F733 HydrophobicContact CE2-CD2 3.56Å; F731-F733 HydrophobicContact CE2-CE2 4.24Å; F731-F733 HydrophobicContact CG-CD2 4.21Å; F731-F733 HydrophobicContact CZ-CB 4.05Å; F731-F733 AromaticContact CZ-CD2 3.73Å; F731-F733 HydrophobicContact CZ-CD2 3.73Å; F731-F733 HydrophobicContact CZ-CG 4.38Å; F731-F733 PolarHBondContact O-N 2.88Å; F731-H734 HydrophobicContact CD1-CB 4.19Å; F731-H734 HydrophobicContact CE1-CB 4.02Å; F731-H734 PolarHBondContact O-N 3.13Å; F731-V737 HydrophobicContact CB-CG1 4.12Å; F731-V737 HydrophobicContact CD1-CB 3.93Å; F731-V737 HydrophobicContact CD1-CG1 3.75Å; F731-V737 HydrophobicContact CD1-CG2 4.18Å; F731-V737 HydrophobicContact CE1-CG1 4.45Å; F731-V737 HydrophobicContact CE1-CG2 4.27Å; F731-V737 HydrophobicContact CG-CG1 4.1Å; F731-R738 HydrophobicContact CB-CG 4.4Å; F731-R738 WeakPolarHBondContact O-CD 3.41Å; F731-R738 WeakPolarHBondContact O-CG 3.21Å; F731-R738 PolarHBondContact O-NE 2.77Å
732	Y	87.2	Confident	95.4	Very high	98 Å²	98	34 Å²	34	38%	0.384	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	5.1	-176	-58.6	-61.1	0	0	0	115	K730 T777 P779	K730-Y732 VanDerWaalsContact C-N 3.28Å; K730-Y732 HydrophobicContact CB-CE2 4.29Å; K730-Y732 WeakPolarHBondContact O-CD2 3.45Å; K730-Y732 PolarHBondContact O-N 3.04Å; K730-Y732 VanDerWaalsContact O-N 3.1Å; Y732-T777 PolarHBondContact OH-OG1 2.97Å; Y732-T777 VanDerWaalsContact OH-OG1 3.13Å; Y732-P779 HydrophobicContact CD1-CG 4.37Å
733	F	86.6	Confident	95.4	Very high	86 Å²	86	37.7 Å²	37.7	38%	0.377	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-16.9	179.1	-52.4	-55.4	0	0	0	113.2	P656 V658 F686 I688 F731	P656-F733 HydrophobicContact CG-CD2 4.14Å; P656-F733 HydrophobicContact CG-CE2 4.37Å; V658-F733 HydrophobicContact CG1-CE2 4.5Å; V658-F733 HydrophobicContact CG1-CZ 4.17Å; F686-F733 HydrophobicContact CD1-CE1 4.46Å; F686-F733 HydrophobicContact CE1-CD1 4.15Å; F686-F733 AromaticContact CE1-CE1 3.37Å; F686-F733 HydrophobicContact CE1-CE1 3.37Å; F686-F733 HydrophobicContact CE1-CZ 4.06Å; F686-F733 AromaticContact CZ-CE1 3.54Å; F686-F733 HydrophobicContact CZ-CE1 3.54Å; F686-F733 AromaticContact CZ-CZ 3.78Å; F686-F733 HydrophobicContact CZ-CZ 3.78Å; I688-F733 HydrophobicContact CD1-CB 3.5Å; I688-F733 VanDerWaalsContact CD1-CB 3.5Å; I688-F733 HydrophobicContact CD1-CD1 3.37Å; I688-F733 HydrophobicContact CD1-CD2 3.88Å; I688-F733 HydrophobicContact CD1-CE1 4.04Å; I688-F733 HydrophobicContact CD1-CE2 4.46Å; I688-F733 HydrophobicContact CD1-CG 3.28Å; F731-F733 HydrophobicContact CD1-CB 4.12Å; F731-F733 HydrophobicContact CD1-CD2 4.36Å; F731-F733 AromaticContact CD2-CD2 3.8Å; F731-F733 HydrophobicContact CD2-CD2 3.8Å; F731-F733 HydrophobicContact CD2-CE2 4.4Å; F731-F733 HydrophobicContact CE1-CB 3.74Å; F731-F733 HydrophobicContact CE1-CD2 4.14Å; F731-F733 HydrophobicContact CE1-CG 4.46Å; F731-F733 AromaticContact CE2-CD2 3.56Å; F731-F733 HydrophobicContact CE2-CD2 3.56Å; F731-F733 HydrophobicContact CE2-CE2 4.24Å; F731-F733 HydrophobicContact CG-CD2 4.21Å; F731-F733 HydrophobicContact CZ-CB 4.05Å; F731-F733 AromaticContact CZ-CD2 3.73Å; F731-F733 HydrophobicContact CZ-CD2 3.73Å; F731-F733 HydrophobicContact CZ-CG 4.38Å; F731-F733 PolarHBondContact O-N 2.88Å
734	H	89.8	Confident	95.5	Very high	29 Å²	29	32.9 Å²	32.9	13%	0.134	17%	0.167	C	C	.	.			trans	-157	126.4	-178.8	-168.7	-48.8	0	0	0	111.4	E694 S697 F731 G736 V737 R738	E694-H734 IonicContact OE1-NE2 3.28Å; E694-H734 PolarHBondContact OE1-NE2 3.08Å; E694-H734 IonicContact OE2-NE2 3.77Å; E694-H734 PolarHBondContact OE2-NE2 2.99Å; S697-H734 PolarHBondContact OG-CE1 3.33Å; S697-H734 VanDerWaalsContact OG-CE1 3.31Å; F731-H734 HydrophobicContact CD1-CB 4.19Å; F731-H734 HydrophobicContact CE1-CB 4.02Å; F731-H734 PolarHBondContact O-N 3.13Å; H734-G736 PolarHBondContact ND1-N 3.39Å; H734-V737 HydrophobicContact CB-CB 4.29Å; H734-V737 HydrophobicContact CB-CG2 3.92Å; H734-V737 PolarHBondContact O-N 3Å; H734-R738 PolarHBondContact O-N 3.14Å
735	D	93.1	Very high	95.5	Very high	75 Å²	75	31.7 Å²	31.7	40%	0.401	16%	0.161	S	C	.	.	H	α-helix	trans	-71.9	-48.4	-172.5	-61.6	1.5	0	0	0	111.3	V737 R738 V739 V783	D735-V737 PolarHBondContact O-N 2.83Å; D735-V737 VanDerWaalsContact O-N 3.13Å; D735-R738 WeakPolarHBondContact O-CA 3.45Å; D735-R738 WeakPolarHBondContact O-CB 3.14Å; D735-R738 PolarHBondContact O-N 3.21Å; D735-R738 IonicContact OD1-CZ 3.8Å; D735-R738 IonicContact OD1-NE 3.59Å; D735-R738 IonicContact OD1-NH2 3.16Å; D735-R738 PolarHBondContact OD1-NH2 2.97Å; D735-V739 WeakPolarHBondContact O-CG2 3.3Å; D735-V739 PolarHBondContact O-N 2.85Å; D735-V783 HydrophobicContact CB-CG2 3.88Å
736	G	94.3	Very high	95.5	Very high	18 Å²	18	32.6 Å²	32.6	19%	0.186	17%	0.166	C	C	.	.	H	α-helix	trans	-53.1	-32.8	174.6	0	0	0	0	0	115	H734 A740	H734-G736 PolarHBondContact ND1-N 3.39Å; G736-A740 VanDerWaalsContact O-CB 3.26Å; G736-A740 WeakPolarHBondContact O-CB 3.41Å; G736-A740 PolarHBondContact O-N 2.82Å
737	V	96.4	Very high	95.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.4	-43.3	173.5	173.4	0	0	0	0	111.2	K696 L728 F731 H734 D735 A741	K696-V737 HydrophobicContact CD-CG2 4.25Å; K696-V737 HydrophobicContact CG-CG2 4.23Å; L728-V737 HydrophobicContact CB-CG1 3.98Å; L728-V737 HydrophobicContact CD1-CG1 4.15Å; L728-V737 HydrophobicContact CD2-CG1 4.1Å; L728-V737 HydrophobicContact CG-CG1 4.29Å; F731-V737 HydrophobicContact CB-CG1 4.12Å; F731-V737 HydrophobicContact CD1-CB 3.93Å; F731-V737 HydrophobicContact CD1-CG1 3.75Å; F731-V737 HydrophobicContact CD1-CG2 4.18Å; F731-V737 HydrophobicContact CE1-CG1 4.45Å; F731-V737 HydrophobicContact CE1-CG2 4.27Å; F731-V737 HydrophobicContact CG-CG1 4.1Å; H734-V737 HydrophobicContact CB-CB 4.29Å; H734-V737 HydrophobicContact CB-CG2 3.92Å; H734-V737 PolarHBondContact O-N 3Å; D735-V737 PolarHBondContact O-N 2.83Å; D735-V737 VanDerWaalsContact O-N 3.13Å; V737-A741 WeakPolarHBondContact O-CB 3.34Å; V737-A741 PolarHBondContact O-N 3.01Å
738	R	97.9	Very high	95.5	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-69.1	-41.7	179.6	-68	-177.8	-74.6	157.6	-1.3	111.6	L728 F731 H734 D735 A741 A742 E778 V783	L728-R738 WeakPolarHBondContact O-CG 3.38Å; F731-R738 HydrophobicContact CB-CG 4.4Å; F731-R738 WeakPolarHBondContact O-CD 3.41Å; F731-R738 WeakPolarHBondContact O-CG 3.21Å; F731-R738 PolarHBondContact O-NE 2.77Å; H734-R738 PolarHBondContact O-N 3.14Å; D735-R738 WeakPolarHBondContact O-CA 3.45Å; D735-R738 WeakPolarHBondContact O-CB 3.14Å; D735-R738 PolarHBondContact O-N 3.21Å; D735-R738 IonicContact OD1-CZ 3.8Å; D735-R738 IonicContact OD1-NE 3.59Å; D735-R738 IonicContact OD1-NH2 3.16Å; D735-R738 PolarHBondContact OD1-NH2 2.97Å; R738-A741 WeakPolarHBondContact O-CB 3.3Å; R738-A741 PolarHBondContact O-N 2.73Å; R738-A742 PolarHBondContact O-N 3.39Å; R738-E778 IonicContact CZ-OE1 3.8Å; R738-E778 IonicContact CZ-OE2 3.35Å; R738-E778 IonicContact NH1-OE1 3.73Å; R738-E778 PolarHBondContact NH1-OE1 3.41Å; R738-E778 IonicContact NH1-OE2 3.07Å; R738-E778 PolarHBondContact NH1-OE2 2.94Å; R738-E778 IonicContact NH2-OE1 2.8Å; R738-V783 HydrophobicContact CB-CG1 3.68Å
739	V	98.3	Very high	95.5	Very high	35 Å²	35	28.9 Å²	28.9	21%	0.212	14%	0.141	C	C	.	.	H	α-helix	trans	-59.5	-51.8	173.1	174.6	0	0	0	0	110.5	D735 A741 A742 E743 V783 E786	D735-V739 WeakPolarHBondContact O-CG2 3.3Å; D735-V739 PolarHBondContact O-N 2.85Å; V739-A741 VanDerWaalsContact C-N 3.28Å; V739-A741 PolarHBondContact O-N 3.18Å; V739-A742 WeakPolarHBondContact O-CB 3.47Å; V739-A742 PolarHBondContact O-N 2.96Å; V739-A742 VanDerWaalsContact O-N 3.08Å; V739-E743 HydrophobicContact CG1-CG 4.29Å; V739-E743 WeakPolarHBondContact CG1-OE1 3.42Å; V739-E743 WeakPolarHBondContact O-CG 3.38Å; V739-E743 PolarHBondContact O-N 2.75Å; V739-V783 HydrophobicContact CG2-CB 4.47Å; V739-V783 HydrophobicContact CG2-CG1 4.43Å; V739-V783 HydrophobicContact CG2-CG2 3.96Å; V739-E786 HydrophobicContact CG1-CG 4.26Å
740	A	97.8	Very high	95.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.008	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-37.5	178.2	0	0	0	0	0	112.4	C700 Q701 V704 G736 S744	C700-A740 HydrophobicContact CB-CB 3.75Å; Q701-A740 HydrophobicContact CG-CB 3.99Å; V704-A740 HydrophobicContact CG2-CB 4.17Å; V704-A740 WeakPolarHBondContact CG2-O 3.2Å; G736-A740 VanDerWaalsContact O-CB 3.26Å; G736-A740 WeakPolarHBondContact O-CB 3.41Å; G736-A740 PolarHBondContact O-N 2.82Å; A740-S744 WeakPolarHBondContact O-CB 3.26Å; A740-S744 PolarHBondContact O-N 3.29Å; A740-S744 VanDerWaalsContact O-N 3.09Å
741	A	98.4	Very high	95.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-48.7	173.2	0	0	0	0	0	111.2	M725 L728 L729 V737 R738 V739 S744 M745	M725-A741 HydrophobicContact CB-CB 4.41Å; M725-A741 HydrophobicContact SD-CB 4.41Å; L728-A741 HydrophobicContact CB-CB 3.88Å; L729-A741 HydrophobicContact CD2-CB 4.09Å; L729-A741 HydrophobicContact CG-CB 4.36Å; V737-A741 WeakPolarHBondContact O-CB 3.34Å; V737-A741 PolarHBondContact O-N 3.01Å; R738-A741 WeakPolarHBondContact O-CB 3.3Å; R738-A741 PolarHBondContact O-N 2.73Å; V739-A741 VanDerWaalsContact C-N 3.28Å; V739-A741 PolarHBondContact O-N 3.18Å; A741-S744 PolarHBondContact O-N 3.37Å; A741-S744 PolarHBondContact O-OG 3.36Å; A741-M745 VanDerWaalsContact O-CE 3.25Å; A741-M745 WeakPolarHBondContact O-CE 3.23Å; A741-M745 WeakPolarHBondContact O-CG 3.43Å
742	A	98.3	Very high	95.8	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.3	-55.3	177.7	0	0	0	0	0	112	L729 R738 V739 S744 M745 P746 I787 S790	L729-A742 HydrophobicContact CD2-CB 4.12Å; R738-A742 PolarHBondContact O-N 3.39Å; V739-A742 WeakPolarHBondContact O-CB 3.47Å; V739-A742 PolarHBondContact O-N 2.96Å; V739-A742 VanDerWaalsContact O-N 3.08Å; A742-S744 PolarHBondContact O-N 2.97Å; A742-S744 VanDerWaalsContact O-N 3.15Å; A742-M745 WeakPolarHBondContact O-CB 3.43Å; A742-M745 WeakPolarHBondContact O-CG 3.48Å; A742-M745 PolarHBondContact O-N 3.13Å; A742-P746 WeakPolarHBondContact O-CD 3.49Å; A742-I787 HydrophobicContact CB-CB 4.48Å; A742-I787 HydrophobicContact CB-CG1 3.76Å; A742-S790 VanDerWaalsContact O-CB 3.27Å; A742-S790 WeakPolarHBondContact O-CB 3.13Å; A742-S790 PolarHBondContact O-OG 3.21Å; A742-S790 VanDerWaalsContact O-OG 3.06Å
743	E	98.3	Very high	96.1	Very high	77 Å²	77	27.5 Å²	27.5	36%	0.36	14%	0.135	S	C	.	.	H	α-helix	trans	-56.1	-34.7	-180	-72	-176.5	-171.6	0	0	112.6	V704 V739 M745 P746 L747	V704-E743 HydrophobicContact CG1-CB 4.13Å; V704-E743 HydrophobicContact CG2-CB 4.36Å; V739-E743 HydrophobicContact CG1-CG 4.29Å; V739-E743 WeakPolarHBondContact CG1-OE1 3.42Å; V739-E743 WeakPolarHBondContact O-CG 3.38Å; V739-E743 PolarHBondContact O-N 2.75Å; E743-M745 VanDerWaalsContact C-N 3.26Å; E743-M745 PolarHBondContact O-N 3.48Å; E743-P746 WeakPolarHBondContact O-CD 3.12Å; E743-L747 WeakPolarHBondContact O-CD1 3.31Å; E743-L747 WeakPolarHBondContact O-CG 3.2Å
744	S	98.3	Very high	96.5	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-29.8	179.9	80.6	0	0	0	0	113	M725 A740 A741 A742 L747 L748	M725-S744 WeakPolarHBondContact CG-OG 3.35Å; A740-S744 WeakPolarHBondContact O-CB 3.26Å; A740-S744 PolarHBondContact O-N 3.29Å; A740-S744 VanDerWaalsContact O-N 3.09Å; A741-S744 PolarHBondContact O-N 3.37Å; A741-S744 PolarHBondContact O-OG 3.36Å; A742-S744 PolarHBondContact O-N 2.97Å; A742-S744 VanDerWaalsContact O-N 3.15Å; S744-L747 PolarHBondContact O-N 3.48Å; S744-L748 VanDerWaalsContact O-CB 3.31Å; S744-L748 WeakPolarHBondContact O-CB 3.41Å; S744-L748 WeakPolarHBondContact O-CD1 3.45Å; S744-L748 WeakPolarHBondContact O-CG 3.46Å; S744-L748 PolarHBondContact O-N 3.14Å
745	M	98.4	Very high	96.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59	-58.5	-169.9	-59	-63.8	163.2	0	0	112.6	M725 V726 L729 A741 A742 E743 L747 L748 L749 M767 L771	M725-M745 HydrophobicContact CB-CE 3.74Å; V726-M745 HydrophobicContact CG2-CE 3.96Å; V726-M745 HydrophobicContact CG2-SD 4.13Å; L729-M745 HydrophobicContact CD1-CE 4.01Å; L729-M745 HydrophobicContact CD2-CE 4.37Å; L729-M745 HydrophobicContact CG-CE 4.1Å; A741-M745 VanDerWaalsContact O-CE 3.25Å; A741-M745 WeakPolarHBondContact O-CE 3.23Å; A741-M745 WeakPolarHBondContact O-CG 3.43Å; A742-M745 WeakPolarHBondContact O-CB 3.43Å; A742-M745 WeakPolarHBondContact O-CG 3.48Å; A742-M745 PolarHBondContact O-N 3.13Å; E743-M745 VanDerWaalsContact C-N 3.26Å; E743-M745 PolarHBondContact O-N 3.48Å; M745-L747 VanDerWaalsContact C-N 3.3Å; M745-L747 PolarHBondContact O-N 3.34Å; M745-L748 PolarHBondContact O-N 3.04Å; M745-L749 WeakPolarHBondContact O-CG 3.31Å; M745-L749 PolarHBondContact O-N 3.01Å; M745-L749 VanDerWaalsContact O-N 3.14Å; M745-M767 HydrophobicContact CB-SD 4.11Å; M745-M767 HydrophobicContact SD-CB 4.2Å; M745-M767 HydrophobicContact SD-CE 3.99Å; M745-M767 HydrophobicContact SD-CG 3.64Å; M745-M767 HydrophobicContact SD-SD 3.83Å; M745-L771 HydrophobicContact CB-CD1 4.31Å; M745-L771 HydrophobicContact CG-CD1 4.24Å; M745-L771 HydrophobicContact CG-CD2 4.22Å
746	P	98.1	Very high	96.8	Very high	18 Å²	18	30 Å²	30	12%	0.117	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-34.8	178.6	25.7	-35.1	0	0	0	112.3	A742 E743 L749 E750 K793	A742-P746 WeakPolarHBondContact O-CD 3.49Å; E743-P746 WeakPolarHBondContact O-CD 3.12Å; P746-L749 PolarHBondContact O-N 2.98Å; P746-E750 WeakPolarHBondContact O-CG 3.36Å; P746-E750 PolarHBondContact O-N 3.23Å; P746-K793 HydrophobicContact CB-CB 3.76Å; P746-K793 HydrophobicContact CG-CB 4.14Å
747	L	97.9	Very high	96.8	Very high	43 Å²	43	33.1 Å²	33.1	23%	0.225	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-37.8	178.9	-63.2	173.1	0	0	0	112.5	V704 A707 K708 E743 S744 M745 E750 C751	V704-L747 HydrophobicContact CG1-CD1 3.64Å; A707-L747 HydrophobicContact CB-CB 4.07Å; K708-L747 HydrophobicContact CB-CD1 4.09Å; K708-L747 HydrophobicContact CB-CD2 4.26Å; K708-L747 HydrophobicContact CG-CD2 4.37Å; E743-L747 WeakPolarHBondContact O-CD1 3.31Å; E743-L747 WeakPolarHBondContact O-CG 3.2Å; S744-L747 PolarHBondContact O-N 3.48Å; M745-L747 VanDerWaalsContact C-N 3.3Å; M745-L747 PolarHBondContact O-N 3.34Å; L747-E750 WeakPolarHBondContact O-CB 3.14Å; L747-E750 PolarHBondContact O-N 2.91Å; L747-C751 PolarHBondContact O-N 3.37Å; L747-C751 PolarHBondContact O-SG 3.26Å
748	L	98.1	Very high	96.7	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-35.8	175.8	-70.8	166.9	0	0	0	111.1	A707 F714 T718 V721 V722 S744 M745 C751 A752 M767	A707-L748 HydrophobicContact CB-CD2 4.39Å; F714-L748 HydrophobicContact CD1-CD2 4.29Å; F714-L748 HydrophobicContact CE1-CD2 3.99Å; T718-L748 HydrophobicContact CG2-CB 4.11Å; T718-L748 HydrophobicContact CG2-CD2 4.1Å; T718-L748 VanDerWaalsContact CG2-O 3.29Å; T718-L748 WeakPolarHBondContact CG2-O 3.46Å; V721-L748 HydrophobicContact CB-CD1 4.48Å; V721-L748 HydrophobicContact CB-CD2 4.02Å; V721-L748 HydrophobicContact CG1-CD1 3.87Å; V721-L748 HydrophobicContact CG1-CD2 3.86Å; V721-L748 HydrophobicContact CG1-CG 4.49Å; V722-L748 HydrophobicContact CG2-CB 3.95Å; V722-L748 HydrophobicContact CG2-CD1 3.8Å; V722-L748 HydrophobicContact CG2-CG 4.33Å; S744-L748 VanDerWaalsContact O-CB 3.31Å; S744-L748 WeakPolarHBondContact O-CB 3.41Å; S744-L748 WeakPolarHBondContact O-CD1 3.45Å; S744-L748 WeakPolarHBondContact O-CG 3.46Å; S744-L748 PolarHBondContact O-N 3.14Å; M745-L748 PolarHBondContact O-N 3.04Å; L748-C751 PolarHBondContact O-N 2.89Å; L748-A752 WeakPolarHBondContact O-CB 3.32Å; L748-A752 PolarHBondContact O-N 3.22Å; L748-M767 HydrophobicContact CB-CE 4Å; L748-M767 HydrophobicContact CD1-CE 4.45Å
749	L	97.6	Very high	96.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.6	-41.4	171.2	-65.9	180	0	0	0	111.7	M745 P746 C751 A752 R753 L760 M763 W764 M767 C794 V797 M798	M745-L749 WeakPolarHBondContact O-CG 3.31Å; M745-L749 PolarHBondContact O-N 3.01Å; M745-L749 VanDerWaalsContact O-N 3.14Å; P746-L749 PolarHBondContact O-N 2.98Å; L749-C751 VanDerWaalsContact C-N 3.33Å; L749-C751 PolarHBondContact O-N 3.19Å; L749-A752 PolarHBondContact O-N 3.33Å; L749-A752 VanDerWaalsContact O-N 3.15Å; L749-R753 PolarHBondContact O-N 3.33Å; L749-L760 HydrophobicContact CB-CD1 3.86Å; L749-L760 HydrophobicContact CD2-CD1 3.87Å; L749-L760 HydrophobicContact CG-CD1 4.44Å; L749-L760 WeakPolarHBondContact O-CD1 3.29Å; L749-M763 HydrophobicContact CD2-CB 3.95Å; L749-W764 HydrophobicContact CD1-CE3 3.97Å; L749-W764 HydrophobicContact CD2-CB 4.15Å; L749-M767 HydrophobicContact CD1-SD 4.29Å; L749-M767 HydrophobicContact CD2-CE 4.17Å; L749-M767 HydrophobicContact CD2-SD 3.92Å; L749-M767 HydrophobicContact CG-CE 4.3Å; L749-M767 HydrophobicContact CG-SD 3.95Å; L749-C794 HydrophobicContact CD1-CB 3.74Å; L749-V797 HydrophobicContact CB-CG1 3.7Å; L749-V797 HydrophobicContact CD1-CG1 4.31Å; L749-M798 HydrophobicContact CD1-CG 4.31Å
750	E	95.6	Very high	96.5	Very high	77 Å²	77	39.6 Å²	39.6	36%	0.36	19%	0.194	S	C	.	.	H	α-helix	trans	-58.5	-43.6	172.9	-77.3	-67.7	167.4	0	0	112.1	P746 L747 R753 V797	P746-E750 WeakPolarHBondContact O-CG 3.36Å; P746-E750 PolarHBondContact O-N 3.23Å; L747-E750 WeakPolarHBondContact O-CB 3.14Å; L747-E750 PolarHBondContact O-N 2.91Å; E750-R753 VanDerWaalsContact CD-NH2 3.29Å; E750-R753 WeakPolarHBondContact O-CB 3.43Å; E750-R753 PolarHBondContact O-N 2.85Å; E750-R753 IonicContact OE1-CZ 2.62Å; E750-R753 IonicContact OE1-NH1 3.47Å; E750-R753 PolarHBondContact OE1-NH1 2.91Å; E750-R753 IonicContact OE1-NH2 2.74Å; E750-R753 PolarHBondContact OE1-NH2 3.19Å; E750-R753 IonicContact OE2-CZ 2.99Å; E750-R753 IonicContact OE2-NE 3.92Å; E750-R753 IonicContact OE2-NH1 3.66Å; E750-R753 PolarHBondContact OE2-NH1 3.47Å; E750-R753 IonicContact OE2-NH2 2.68Å; E750-R753 PolarHBondContact OE2-NH2 3.17Å; E750-V797 HydrophobicContact CG-CG2 4.38Å
751	C	95.4	Very high	96.4	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.007	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-49.5	172.1	-63.1	0	0	0	0	110.8	A707 K711 V715 L747 L748 L749 R753 V754	A707-C751 PolarHBondContact O-SG 3.18Å; K711-C751 PolarHBondContact O-SG 3.17Å; K711-C751 VanDerWaalsContact O-SG 3.37Å; V715-C751 VanDerWaalsContact CG2-O 3.31Å; V715-C751 WeakPolarHBondContact CG2-O 3.15Å; L747-C751 PolarHBondContact O-N 3.37Å; L747-C751 PolarHBondContact O-SG 3.26Å; L748-C751 PolarHBondContact O-N 2.89Å; L749-C751 VanDerWaalsContact C-N 3.33Å; L749-C751 PolarHBondContact O-N 3.19Å; C751-R753 PolarHBondContact O-N 2.93Å; C751-V754 WeakPolarHBondContact O-CG1 3.45Å
752	A	96	Very high	96.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-27.6	-177.8	0	0	0	0	0	113.6	T718 L748 L749 V754 R755 Y759 L760 M763	T718-A752 HydrophobicContact CG2-CB 4.16Å; L748-A752 WeakPolarHBondContact O-CB 3.32Å; L748-A752 PolarHBondContact O-N 3.22Å; L749-A752 PolarHBondContact O-N 3.33Å; L749-A752 VanDerWaalsContact O-N 3.15Å; A752-V754 PolarHBondContact O-N 3.22Å; A752-V754 VanDerWaalsContact O-N 3.13Å; A752-R755 PolarHBondContact O-N 2.62Å; A752-Y759 HydrophobicContact CB-CD1 3.76Å; A752-Y759 HydrophobicContact CB-CE1 3.76Å; A752-L760 HydrophobicContact CB-CD1 3.94Å; A752-M763 HydrophobicContact CB-CG 4Å
753	R	94.4	Very high	96.3	Very high	109 Å²	109	47.5 Å²	47.5	41%	0.411	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-52.9	-36.4	-175.5	-169.7	-178.4	-72.5	164.2	-6.2	113.4	L749 E750 C751 R755 G756	L749-R753 PolarHBondContact O-N 3.33Å; E750-R753 VanDerWaalsContact CD-NH2 3.29Å; E750-R753 WeakPolarHBondContact O-CB 3.43Å; E750-R753 PolarHBondContact O-N 2.85Å; E750-R753 IonicContact OE1-CZ 2.62Å; E750-R753 IonicContact OE1-NH1 3.47Å; E750-R753 PolarHBondContact OE1-NH1 2.91Å; E750-R753 IonicContact OE1-NH2 2.74Å; E750-R753 PolarHBondContact OE1-NH2 3.19Å; E750-R753 IonicContact OE2-CZ 2.99Å; E750-R753 IonicContact OE2-NE 3.92Å; E750-R753 IonicContact OE2-NH1 3.66Å; E750-R753 PolarHBondContact OE2-NH1 3.47Å; E750-R753 IonicContact OE2-NH2 2.68Å; E750-R753 PolarHBondContact OE2-NH2 3.17Å; C751-R753 PolarHBondContact O-N 2.93Å; R753-R755 PolarHBondContact O-N 3.07Å; R753-G756 PolarHBondContact O-N 2.56Å; R753-G756 VanDerWaalsContact O-N 3.09Å
754	V	94.8	Very high	96.3	Very high	82 Å²	82	44 Å²	44	50%	0.497	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-67.3	-21.2	-178.8	74.9	0	0	0	0	113.7	E712 V715 C751 A752 G756	E712-V754 HydrophobicContact CG-CB 4.24Å; E712-V754 HydrophobicContact CG-CG2 4.21Å; V715-V754 HydrophobicContact CB-CG1 4.36Å; V715-V754 HydrophobicContact CG1-CG1 4.22Å; V715-V754 HydrophobicContact CG2-CG1 3.29Å; C751-V754 WeakPolarHBondContact O-CG1 3.45Å; A752-V754 PolarHBondContact O-N 3.22Å; A752-V754 VanDerWaalsContact O-N 3.13Å; V754-G756 VanDerWaalsContact C-N 3.28Å
755	R	94.1	Very high	96.2	Very high	141 Å²	141	50.1 Å²	50.1	53%	0.532	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-80.2	-8.8	174.5	-71.7	-122	177.6	164	2.1	113.5	V715 A752 R753 Y759	V715-R755 HydrophobicContact CG1-CG 3.38Å; V715-R755 VanDerWaalsContact CG1-NE 3.32Å; A752-R755 PolarHBondContact O-N 2.62Å; R753-R755 PolarHBondContact O-N 3.07Å; R755-Y759 HydrophobicContact CB-CD1 3.6Å; R755-Y759 HydrophobicContact CB-CE1 4.37Å; R755-Y759 HydrophobicContact CB-CG 3.85Å; R755-Y759 HydrophobicContact CG-CD1 3.98Å; R755-Y759 HydrophobicContact CG-CE1 4.26Å; R755-Y759 HydrophobicContact CG-CG 4.42Å
756	G	94.4	Very high	96.1	Very high	19 Å²	19	54.6 Å²	54.6	20%	0.196	27%	0.267	C	S	.	.			trans	100.7	168.5	-178.6	0	0	0	0	0	114	R753 V754 E758 Y759 L760	R753-G756 PolarHBondContact O-N 2.56Å; R753-G756 VanDerWaalsContact O-N 3.09Å; V754-G756 VanDerWaalsContact C-N 3.28Å; G756-E758 VanDerWaalsContact C-N 3.34Å; G756-E758 PolarHBondContact O-N 2.81Å; G756-Y759 PolarHBondContact O-N 3.09Å; G756-L760 PolarHBondContact O-N 3.1Å; G756-L760 VanDerWaalsContact O-N 3.16Å
757	P	93.3	Very high	96	Very high	83 Å²	83	53.8 Å²	53.8	54%	0.539	26%	0.261	S	S	.	.	H	α-helix	trans	-67.1	-29.2	-169	26.9	-34.5	0	0	0	113.5	L760 T761	P757-L760 PolarHBondContact O-N 2.85Å; P757-T761 WeakPolarHBondContact O-CB 3.29Å; P757-T761 PolarHBondContact O-N 2.91Å; P757-T761 PolarHBondContact O-OG1 3.25Å
758	E	94.9	Very high	96.1	Very high	134 Å²	134	51.8 Å²	51.8	63%	0.626	25%	0.251	S	S	*	.	H	α-helix	trans	-65.9	-45	179.4	-61.6	77.6	-171.3	0	0	111.5	G756 T761 Q762	G756-E758 VanDerWaalsContact C-N 3.34Å; G756-E758 PolarHBondContact O-N 2.81Å; E758-T761 PolarHBondContact O-N 2.83Å; E758-Q762 WeakPolarHBondContact O-CG 3.22Å; E758-Q762 PolarHBondContact O-N 2.91Å; E758-Q762 VanDerWaalsContact O-N 3.08Å
759	Y	96.3	Very high	96	Very high	29 Å²	29	54.4 Å²	54.4	11%	0.114	27%	0.265	C	S	.	.	H	α-helix	trans	-67.6	-42.7	176.6	-176.7	-103.6	0	0	0	111	E719 A752 R755 G756 T761 Q762 M763	E719-Y759 PolarHBondContact N-OH 3.25Å; A752-Y759 HydrophobicContact CB-CD1 3.76Å; A752-Y759 HydrophobicContact CB-CE1 3.76Å; R755-Y759 HydrophobicContact CB-CD1 3.6Å; R755-Y759 HydrophobicContact CB-CE1 4.37Å; R755-Y759 HydrophobicContact CB-CG 3.85Å; R755-Y759 HydrophobicContact CG-CD1 3.98Å; R755-Y759 HydrophobicContact CG-CE1 4.26Å; R755-Y759 HydrophobicContact CG-CG 4.42Å; G756-Y759 PolarHBondContact O-N 3.09Å; Y759-T761 VanDerWaalsContact C-N 3.32Å; Y759-T761 PolarHBondContact O-N 2.91Å; Y759-Q762 WeakPolarHBondContact O-CB 3.48Å; Y759-Q762 PolarHBondContact O-N 3.03Å; Y759-Q762 VanDerWaalsContact O-N 3.16Å; Y759-M763 HydrophobicContact CD1-CG 4.31Å; Y759-M763 HydrophobicContact CD2-CE 4.43Å; Y759-M763 HydrophobicContact CE1-CG 3.99Å; Y759-M763 HydrophobicContact CE1-SD 4.37Å; Y759-M763 HydrophobicContact CE2-CE 3.95Å; Y759-M763 HydrophobicContact CE2-SD 4.45Å; Y759-M763 WeakPolarHBondContact O-CG 3.22Å; Y759-M763 PolarHBondContact O-N 3.29Å
760	L	95.8	Very high	96	Very high	15 Å²	15	55 Å²	55	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-56.4	-46.5	175.2	-177.2	65.8	0	0	0	111.6	L749 A752 G756 P757 Q762 M763 W764 V797 M798	L749-L760 HydrophobicContact CB-CD1 3.86Å; L749-L760 HydrophobicContact CD2-CD1 3.87Å; L749-L760 HydrophobicContact CG-CD1 4.44Å; L749-L760 WeakPolarHBondContact O-CD1 3.29Å; A752-L760 HydrophobicContact CB-CD1 3.94Å; G756-L760 PolarHBondContact O-N 3.1Å; G756-L760 VanDerWaalsContact O-N 3.16Å; P757-L760 PolarHBondContact O-N 2.85Å; L760-Q762 VanDerWaalsContact C-N 3.35Å; L760-Q762 PolarHBondContact O-N 3.39Å; L760-M763 PolarHBondContact O-N 3.15Å; L760-W764 PolarHBondContact O-N 2.81Å; L760-V797 HydrophobicContact CD1-CG1 4.46Å; L760-M798 HydrophobicContact CD1-SD 4.12Å; L760-M798 HydrophobicContact CD2-SD 3.82Å; L760-M798 HydrophobicContact CG-CE 4.36Å; L760-M798 HydrophobicContact CG-SD 3.53Å; L760-M798 VanDerWaalsContact CG-SD 3.53Å
761	T	96.1	Very high	96.1	Very high	55 Å²	55	51.4 Å²	51.4	34%	0.337	25%	0.253	S	S	.	.	H	α-helix	trans	-63.1	-41.2	177.7	-50.1	0	0	0	0	111	P757 E758 Y759 M763 W764 H765	P757-T761 WeakPolarHBondContact O-CB 3.29Å; P757-T761 PolarHBondContact O-N 2.91Å; P757-T761 PolarHBondContact O-OG1 3.25Å; E758-T761 PolarHBondContact O-N 2.83Å; Y759-T761 VanDerWaalsContact C-N 3.32Å; Y759-T761 PolarHBondContact O-N 2.91Å; T761-M763 VanDerWaalsContact C-N 3.34Å; T761-M763 PolarHBondContact O-N 2.92Å; T761-W764 PolarHBondContact O-N 2.91Å; T761-H765 WeakPolarHBondContact CG2-CE1 3.44Å; T761-H765 PolarHBondContact O-N 3.5Å; T761-H765 PolarHBondContact O-ND1 3.02Å
762	Q	96.4	Very high	96.3	Very high	111 Å²	111	51.3 Å²	51.3	52%	0.519	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-40.8	175.7	-72.5	171.3	5.8	0	0	112.4	E758 Y759 L760 H765 F766	E758-Q762 WeakPolarHBondContact O-CG 3.22Å; E758-Q762 PolarHBondContact O-N 2.91Å; E758-Q762 VanDerWaalsContact O-N 3.08Å; Y759-Q762 WeakPolarHBondContact O-CB 3.48Å; Y759-Q762 PolarHBondContact O-N 3.03Å; Y759-Q762 VanDerWaalsContact O-N 3.16Å; L760-Q762 VanDerWaalsContact C-N 3.35Å; L760-Q762 PolarHBondContact O-N 3.39Å; Q762-H765 PolarHBondContact O-N 3.19Å; Q762-F766 VanDerWaalsContact O-CD2 3.23Å; Q762-F766 WeakPolarHBondContact O-CD2 3.44Å
763	M	97.8	Very high	96.3	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-45	176.1	-64.1	-55.5	95.5	0	0	111.2	T718 E719 V722 L749 A752 Y759 L760 T761 H765 F766	T718-M763 HydrophobicContact CG2-CG 4.47Å; T718-M763 HydrophobicContact CG2-SD 4.47Å; E719-M763 HydrophobicContact CB-CE 4.14Å; E719-M763 HydrophobicContact CB-SD 3.97Å; E719-M763 HydrophobicContact CG-CE 3.98Å; E719-M763 HydrophobicContact CG-SD 4.3Å; V722-M763 HydrophobicContact CB-SD 4.43Å; V722-M763 HydrophobicContact CG2-SD 4.12Å; L749-M763 HydrophobicContact CD2-CB 3.95Å; A752-M763 HydrophobicContact CB-CG 4Å; Y759-M763 HydrophobicContact CD1-CG 4.31Å; Y759-M763 HydrophobicContact CD2-CE 4.43Å; Y759-M763 HydrophobicContact CE1-CG 3.99Å; Y759-M763 HydrophobicContact CE1-SD 4.37Å; Y759-M763 HydrophobicContact CE2-CE 3.95Å; Y759-M763 HydrophobicContact CE2-SD 4.45Å; Y759-M763 WeakPolarHBondContact O-CG 3.22Å; Y759-M763 PolarHBondContact O-N 3.29Å; L760-M763 PolarHBondContact O-N 3.15Å; T761-M763 VanDerWaalsContact C-N 3.34Å; T761-M763 PolarHBondContact O-N 2.92Å; M763-H765 VanDerWaalsContact C-N 3.31Å; M763-H765 PolarHBondContact O-N 3.49Å; M763-F766 HydrophobicContact CE-CD2 4.22Å; M763-F766 HydrophobicContact CE-CE2 4.01Å; M763-F766 WeakPolarHBondContact O-CB 2.98Å; M763-F766 PolarHBondContact O-N 3.1Å; M763-F766 VanDerWaalsContact O-N 3.13Å
764	W	98	Very high	96.4	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-38	178	175.8	-122	0	0	0	113.4	L749 L760 T761 F766 M767 C768 L771 F791 C794 M798 C802 L803	L749-W764 HydrophobicContact CD1-CE3 3.97Å; L749-W764 HydrophobicContact CD2-CB 4.15Å; L760-W764 PolarHBondContact O-N 2.81Å; T761-W764 PolarHBondContact O-N 2.91Å; W764-F766 PolarHBondContact O-N 3.07Å; W764-M767 HydrophobicContact CE3-CB 4.03Å; W764-M767 HydrophobicContact CE3-SD 4.38Å; W764-M767 HydrophobicContact CZ3-CB 4.19Å; W764-M767 PolarHBondContact O-N 2.98Å; W764-C768 HydrophobicContact CD2-CB 4.01Å; W764-C768 HydrophobicContact CE3-CB 4.36Å; W764-C768 HydrophobicContact CH2-CB 4Å; W764-C768 HydrophobicContact CZ2-CB 3.59Å; W764-C768 WeakPolarHBondContact CZ2-SG 3.46Å; W764-C768 HydrophobicContact CZ3-CB 4.35Å; W764-C768 PolarHBondContact O-N 3.06Å; W764-L771 HydrophobicContact CH2-CD1 4.36Å; W764-L771 HydrophobicContact CZ3-CD1 3.88Å; W764-F791 AromaticContact CH2-CD2 3.82Å; W764-F791 HydrophobicContact CH2-CD2 3.82Å; W764-F791 AromaticContact CH2-CE2 3.66Å; W764-F791 HydrophobicContact CH2-CE2 3.66Å; W764-F791 HydrophobicContact CZ2-CE2 4.12Å; W764-C794 HydrophobicContact CE3-CB 3.97Å; W764-C794 HydrophobicContact CH2-CB 3.73Å; W764-C794 HydrophobicContact CZ3-CB 3.29Å; W764-M798 HydrophobicContact CB-CE 3.81Å; W764-M798 HydrophobicContact CB-CG 4.26Å; W764-M798 HydrophobicContact CB-SD 3.83Å; W764-M798 HydrophobicContact CD2-CG 4.15Å; W764-M798 HydrophobicContact CG-CE 3.99Å; W764-M798 HydrophobicContact CG-CG 3.93Å; W764-M798 HydrophobicContact CG-SD 4.12Å; W764-C802 PolarHBondContact NE1-O 2.99Å; W764-L803 HydrophobicContact CZ2-CD2 4.23Å
765	H	96.4	Very high	96.6	Very high	130 Å²	130	45.6 Å²	45.6	60%	0.602	22%	0.224	S	C	*	.	H	α-helix	trans	-60.8	-28.7	176.9	-77.6	101.1	0	0	0	113.6	T761 Q762 M763 M767	T761-H765 WeakPolarHBondContact CG2-CE1 3.44Å; T761-H765 PolarHBondContact O-N 3.5Å; T761-H765 PolarHBondContact O-ND1 3.02Å; Q762-H765 PolarHBondContact O-N 3.19Å; M763-H765 VanDerWaalsContact C-N 3.31Å; M763-H765 PolarHBondContact O-N 3.49Å; H765-M767 VanDerWaalsContact C-N 3.33Å
766	F	95.7	Very high	96.6	Very high	94 Å²	94	40.7 Å²	40.7	41%	0.412	22%	0.218	S	C	.	.	H	α-helix	trans	-70.7	-31.7	173.5	-71.7	-68.7	0	0	0	112.2	V722 V726 Q762 M763 W764	V722-F766 HydrophobicContact CG1-CB 3.79Å; V722-F766 HydrophobicContact CG1-CD2 4.34Å; V722-F766 HydrophobicContact CG1-CG 4.36Å; V726-F766 WeakPolarHBondContact CG1-O 3.47Å; Q762-F766 VanDerWaalsContact O-CD2 3.23Å; Q762-F766 WeakPolarHBondContact O-CD2 3.44Å; M763-F766 HydrophobicContact CE-CD2 4.22Å; M763-F766 HydrophobicContact CE-CE2 4.01Å; M763-F766 WeakPolarHBondContact O-CB 2.98Å; M763-F766 PolarHBondContact O-N 3.1Å; M763-F766 VanDerWaalsContact O-N 3.13Å; W764-F766 PolarHBondContact O-N 3.07Å
767	M	98.1	Very high	96.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-93.1	-40.3	-169.4	-56.5	170.7	175.9	0	0	113.2	V722 V726 M745 L748 L749 W764 H765 D769 A770 L771	V722-M767 HydrophobicContact CB-CE 4.07Å; V722-M767 HydrophobicContact CG1-CE 3.65Å; V722-M767 HydrophobicContact CG1-CG 4.1Å; V722-M767 HydrophobicContact CG2-CE 3.28Å; V726-M767 HydrophobicContact CG2-CB 4.43Å; V726-M767 HydrophobicContact CG2-CG 3.97Å; M745-M767 HydrophobicContact CB-SD 4.11Å; M745-M767 HydrophobicContact SD-CB 4.2Å; M745-M767 HydrophobicContact SD-CE 3.99Å; M745-M767 HydrophobicContact SD-CG 3.64Å; M745-M767 HydrophobicContact SD-SD 3.83Å; L748-M767 HydrophobicContact CB-CE 4Å; L748-M767 HydrophobicContact CD1-CE 4.45Å; L749-M767 HydrophobicContact CD1-SD 4.29Å; L749-M767 HydrophobicContact CD2-CE 4.17Å; L749-M767 HydrophobicContact CD2-SD 3.92Å; L749-M767 HydrophobicContact CG-CE 4.3Å; L749-M767 HydrophobicContact CG-SD 3.95Å; W764-M767 HydrophobicContact CE3-CB 4.03Å; W764-M767 HydrophobicContact CE3-SD 4.38Å; W764-M767 HydrophobicContact CZ3-CB 4.19Å; W764-M767 PolarHBondContact O-N 2.98Å; H765-M767 VanDerWaalsContact C-N 3.33Å; M767-D769 PolarHBondContact O-N 2.91Å; M767-A770 PolarHBondContact O-N 3.3Å; M767-A770 VanDerWaalsContact O-N 3.16Å; M767-L771 HydrophobicContact CB-CD1 4.07Å; M767-L771 PolarHBondContact O-N 3.47Å
768	C	97.9	Very high	96.7	Very high	2 Å²	2	40 Å²	40	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-55.1	-53	-164.2	-173.9	0	0	0	0	113.7	W764 A770 L771 I772 L803 H807	W764-C768 HydrophobicContact CD2-CB 4.01Å; W764-C768 HydrophobicContact CE3-CB 4.36Å; W764-C768 HydrophobicContact CH2-CB 4Å; W764-C768 HydrophobicContact CZ2-CB 3.59Å; W764-C768 WeakPolarHBondContact CZ2-SG 3.46Å; W764-C768 HydrophobicContact CZ3-CB 4.35Å; W764-C768 PolarHBondContact O-N 3.06Å; C768-A770 PolarHBondContact O-N 3.41Å; C768-L771 PolarHBondContact O-N 2.83Å; C768-I772 VanDerWaalsContact O-CG1 3.31Å; C768-I772 WeakPolarHBondContact O-CG1 3.48Å; C768-I772 PolarHBondContact O-N 3.2Å; C768-I772 VanDerWaalsContact O-N 3.11Å; C768-L803 VanDerWaalsContact SG-CD2 3.55Å; C768-H807 VanDerWaalsContact SG-CE1 3.52Å; C768-H807 PolarHBondContact SG-ND1 3.38Å
769	D	97.3	Very high	96.5	Very high	55 Å²	55	38.3 Å²	38.3	29%	0.294	21%	0.208	S	C	.	.	H	α-helix	trans	-64.1	-40.7	-179.4	174.7	87.4	0	0	0	111.8	M767 I772 K773	M767-D769 PolarHBondContact O-N 2.91Å; D769-I772 PolarHBondContact O-N 2.84Å; D769-K773 WeakPolarHBondContact O-CB 3.21Å; D769-K773 WeakPolarHBondContact O-CG 3.49Å; D769-K773 PolarHBondContact O-N 3.42Å; D769-K773 VanDerWaalsContact OD1-CE 3.29Å; D769-K773 WeakPolarHBondContact OD1-CE 3.43Å; D769-K773 IonicContact OD1-NZ 2.78Å; D769-K773 PolarHBondContact OD1-NZ 3.4Å; D769-K773 WeakPolarHBondContact OD2-CE 3.47Å; D769-K773 IonicContact OD2-NZ 3.97Å; D769-K773 PolarHBondContact OD2-NZ 3.43Å
770	A	97.7	Very high	96.4	Very high	14 Å²	14	39.4 Å²	39.4	12%	0.116	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-40.3	-179.7	0	0	0	0	0	112.2	V726 L729 M767 C768 A774	V726-A770 HydrophobicContact CG1-CB 3.58Å; L729-A770 HydrophobicContact CD1-CB 4.23Å; M767-A770 PolarHBondContact O-N 3.3Å; M767-A770 VanDerWaalsContact O-N 3.16Å; C768-A770 PolarHBondContact O-N 3.41Å; A770-A774 WeakPolarHBondContact O-CB 3.27Å; A770-A774 PolarHBondContact O-N 3.39Å
771	L	98.4	Very high	96.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-46.9	176	-77.9	168.1	0	0	0	111.6	L729 M745 W764 M767 C768 K773 A774 I775 I787 F791	L729-L771 HydrophobicContact CD1-CD2 3.79Å; L729-L771 HydrophobicContact CD1-CG 4.08Å; L729-L771 HydrophobicContact CD2-CD2 4.2Å; M745-L771 HydrophobicContact CB-CD1 4.31Å; M745-L771 HydrophobicContact CG-CD1 4.24Å; M745-L771 HydrophobicContact CG-CD2 4.22Å; W764-L771 HydrophobicContact CH2-CD1 4.36Å; W764-L771 HydrophobicContact CZ3-CD1 3.88Å; M767-L771 HydrophobicContact CB-CD1 4.07Å; M767-L771 PolarHBondContact O-N 3.47Å; C768-L771 PolarHBondContact O-N 2.83Å; L771-K773 VanDerWaalsContact C-N 3.32Å; L771-K773 PolarHBondContact O-N 3.47Å; L771-A774 PolarHBondContact O-N 3.31Å; L771-I775 WeakPolarHBondContact O-CG1 3.23Å; L771-I775 PolarHBondContact O-N 2.85Å; L771-I787 HydrophobicContact CD2-CG2 4.1Å; L771-F791 HydrophobicContact CB-CD2 3.77Å; L771-F791 HydrophobicContact CB-CE2 4.44Å; L771-F791 HydrophobicContact CD1-CD2 4.1Å
772	I	98.3	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.9	-47.2	177.8	-67.3	168.5	0	0	0	110.2	C768 D769 A774 I775 G776 F791 L803 H807 E810 I814	C768-I772 VanDerWaalsContact O-CG1 3.31Å; C768-I772 WeakPolarHBondContact O-CG1 3.48Å; C768-I772 PolarHBondContact O-N 3.2Å; C768-I772 VanDerWaalsContact O-N 3.11Å; D769-I772 PolarHBondContact O-N 2.84Å; I772-A774 VanDerWaalsContact C-N 3.33Å; I772-A774 PolarHBondContact O-N 3.05Å; I772-I775 PolarHBondContact O-N 3.02Å; I772-G776 PolarHBondContact O-N 3.12Å; I772-F791 HydrophobicContact CD1-CE2 4.21Å; I772-F791 HydrophobicContact CD1-CZ 4.04Å; I772-F791 HydrophobicContact CG1-CE1 4.48Å; I772-F791 HydrophobicContact CG1-CE2 3.65Å; I772-F791 HydrophobicContact CG1-CZ 3.6Å; I772-L803 HydrophobicContact CD1-CD2 4.38Å; I772-H807 HydrophobicContact CD1-CB 3.58Å; I772-E810 HydrophobicContact CG2-CB 4.17Å; I772-E810 HydrophobicContact CG2-CG 3.75Å; I772-I814 HydrophobicContact CG2-CD1 3.76Å; I772-I814 VanDerWaalsContact O-CD1 3.28Å; I772-I814 WeakPolarHBondContact O-CD1 3.39Å
773	K	96.2	Very high	96.1	Very high	70 Å²	70	37.4 Å²	37.4	30%	0.304	21%	0.211	S	C	.	.	H	α-helix	trans	-61.2	-41	177.1	-75.3	172.1	-177.8	159.2	0	112.5	D769 L771 G776 T777 E810	D769-K773 WeakPolarHBondContact O-CB 3.21Å; D769-K773 WeakPolarHBondContact O-CG 3.49Å; D769-K773 PolarHBondContact O-N 3.42Å; D769-K773 VanDerWaalsContact OD1-CE 3.29Å; D769-K773 WeakPolarHBondContact OD1-CE 3.43Å; D769-K773 IonicContact OD1-NZ 2.78Å; D769-K773 PolarHBondContact OD1-NZ 3.4Å; D769-K773 WeakPolarHBondContact OD2-CE 3.47Å; D769-K773 IonicContact OD2-NZ 3.97Å; D769-K773 PolarHBondContact OD2-NZ 3.43Å; L771-K773 VanDerWaalsContact C-N 3.32Å; L771-K773 PolarHBondContact O-N 3.47Å; K773-G776 PolarHBondContact O-N 3.11Å; K773-G776 VanDerWaalsContact O-N 3.16Å; K773-T777 PolarHBondContact O-N 3.25Å; K773-T777 PolarHBondContact O-OG1 3.05Å; K773-T777 VanDerWaalsContact O-OG1 3.13Å; K773-E810 WeakPolarHBondContact CG-OE1 3.47Å
774	A	97.6	Very high	96.2	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-41.6	178.9	0	0	0	0	0	111.7	L729 A770 L771 I772 G776 T777 E778 I787	L729-A774 HydrophobicContact CB-CB 4.39Å; A770-A774 WeakPolarHBondContact O-CB 3.27Å; A770-A774 PolarHBondContact O-N 3.39Å; L771-A774 PolarHBondContact O-N 3.31Å; I772-A774 VanDerWaalsContact C-N 3.33Å; I772-A774 PolarHBondContact O-N 3.05Å; A774-G776 PolarHBondContact O-N 3Å; A774-T777 PolarHBondContact O-N 3.01Å; A774-T777 VanDerWaalsContact O-N 3.1Å; A774-E778 WeakPolarHBondContact O-CB 3.45Å; A774-E778 PolarHBondContact O-N 3.05Å; A774-I787 HydrophobicContact CB-CD1 4.12Å; A774-I787 HydrophobicContact CB-CG2 4.04Å
775	I	98.1	Very high	96.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.9	-35.7	174.9	-61.7	166.3	0	0	0	111.5	L771 I772 L784 I787 M788 F791 I814 I863	L771-I775 WeakPolarHBondContact O-CG1 3.23Å; L771-I775 PolarHBondContact O-N 2.85Å; I772-I775 PolarHBondContact O-N 3.02Å; I775-L784 HydrophobicContact CB-CD1 4.38Å; I775-L784 HydrophobicContact CG2-CD1 4.12Å; I775-I787 HydrophobicContact CG1-CG2 3.74Å; I775-M788 HydrophobicContact CD1-CG 4.37Å; I775-M788 HydrophobicContact CG1-CG 4.01Å; I775-M788 HydrophobicContact CG2-CG 3.91Å; I775-M788 HydrophobicContact CG2-SD 4.37Å; I775-F791 HydrophobicContact CD1-CB 4.02Å; I775-F791 HydrophobicContact CD1-CD1 3.84Å; I775-F791 HydrophobicContact CD1-CE1 4.48Å; I775-F791 HydrophobicContact CD1-CG 3.94Å; I775-I814 HydrophobicContact CB-CG2 4.29Å; I775-I814 HydrophobicContact CG2-CG2 3.62Å; I775-I863 HydrophobicContact CD1-CD1 4.04Å
776	G	94.2	Very high	96.2	Very high	38 Å²	38	33.9 Å²	33.9	39%	0.392	20%	0.195	S	C	.	.	H	α-helix	trans	-78	-18.6	179.3	0	0	0	0	0	115.3	I772 K773 A774	I772-G776 PolarHBondContact O-N 3.12Å; K773-G776 PolarHBondContact O-N 3.11Å; K773-G776 VanDerWaalsContact O-N 3.16Å; A774-G776 PolarHBondContact O-N 3Å
777	T	93.8	Very high	96.4	Very high	79 Å²	79	29.4 Å²	29.4	49%	0.485	18%	0.175	S	C	.	.	H	α-helix	trans	-125.5	-9.1	-170.4	64.3	0	0	0	0	115.4	Y732 K773 A774 P779	Y732-T777 PolarHBondContact OH-OG1 2.97Å; Y732-T777 VanDerWaalsContact OH-OG1 3.13Å; K773-T777 PolarHBondContact O-N 3.25Å; K773-T777 PolarHBondContact O-OG1 3.05Å; K773-T777 VanDerWaalsContact O-OG1 3.13Å; A774-T777 PolarHBondContact O-N 3.01Å; A774-T777 VanDerWaalsContact O-N 3.1Å; T777-P779 WeakPolarHBondContact O-CD 2.96Å
778	E	96.3	Very high	96.4	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.037	18%	0.175	C	C	.	.			trans	-66.4	121.5	-177.4	176.5	51.8	-115.7	0	0	111.4	R738 A774 D780 V783 L784 I787	R738-E778 IonicContact CZ-OE1 3.8Å; R738-E778 IonicContact CZ-OE2 3.35Å; R738-E778 IonicContact NH1-OE1 3.73Å; R738-E778 PolarHBondContact NH1-OE1 3.41Å; R738-E778 IonicContact NH1-OE2 3.07Å; R738-E778 PolarHBondContact NH1-OE2 2.94Å; R738-E778 IonicContact NH2-OE1 2.8Å; A774-E778 WeakPolarHBondContact O-CB 3.45Å; A774-E778 PolarHBondContact O-N 3.05Å; E778-D780 PolarHBondContact OE1-N 3.41Å; E778-V783 HydrophobicContact CG-CB 4.27Å; E778-V783 HydrophobicContact CG-CG1 4.18Å; E778-L784 HydrophobicContact CB-CB 4.21Å; E778-L784 HydrophobicContact CB-CD1 4.13Å; E778-L784 HydrophobicContact CG-CB 3.69Å; E778-L784 HydrophobicContact CG-CD1 4.48Å; E778-I787 HydrophobicContact CB-CD1 4.35Å; E778-I787 HydrophobicContact CG-CD1 4.09Å
779	P	89.3	Confident	96.4	Very high	99 Å²	99	32 Å²	32	64%	0.643	19%	0.187	S	C	*	.			trans	-78	-31.3	179.9	29.6	-37.8	0	0	0	114.9	Y732 T777	Y732-P779 HydrophobicContact CD1-CG 4.37Å; T777-P779 WeakPolarHBondContact O-CD 2.96Å
780	D	94.2	Very high	96.4	Very high	51 Å²	51	29.5 Å²	29.5	27%	0.273	17%	0.174	S	C	.	.			trans	-90.8	133.6	-174.6	-177.8	-93.4	0	0	0	111.6	E778 D782 V783 L784	E778-D780 PolarHBondContact OE1-N 3.41Å; D780-D782 PolarHBondContact OD1-N 2.65Å; D780-V783 HydrophobicContact CB-CB 4.09Å; D780-V783 HydrophobicContact CB-CG2 3.98Å; D780-V783 WeakPolarHBondContact OD1-CG2 3.34Å; D780-V783 PolarHBondContact OD1-N 3.12Å; D780-L784 WeakPolarHBondContact O-CB 3.46Å; D780-L784 PolarHBondContact O-N 3.13Å
781	S	92.5	Very high	96.5	Very high	46 Å²	46	28.8 Å²	28.8	32%	0.322	17%	0.168	S	C	.	.	H	α-helix	trans	-72	-36.9	-173.6	-65.5	0	0	0	0	112.7	S785 I856	S781-S785 WeakPolarHBondContact O-CB 3.4Å; S781-S785 PolarHBondContact O-N 3.03Å; S781-I856 WeakPolarHBondContact O-CD1 3.47Å
782	D	93.6	Very high	96.5	Very high	92 Å²	92	28.8 Å²	28.8	49%	0.492	17%	0.168	S	C	.	.	H	α-helix	trans	-72.8	-44.8	-179.6	-70.5	-28.9	0	0	0	110.3	D780 L784 S785 E786	D780-D782 PolarHBondContact OD1-N 2.65Å; D782-L784 VanDerWaalsContact C-N 3.35Å; D782-L784 PolarHBondContact O-N 3.12Å; D782-S785 WeakPolarHBondContact O-CB 3.35Å; D782-S785 PolarHBondContact O-N 3.22Å; D782-S785 PolarHBondContact O-OG 3.06Å; D782-E786 PolarHBondContact O-N 3.13Å
783	V	97.7	Very high	96.5	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-43.2	173.5	-177.9	0	0	0	0	111	D735 R738 V739 E778 D780 S785 E786 I787	D735-V783 HydrophobicContact CB-CG2 3.88Å; R738-V783 HydrophobicContact CB-CG1 3.68Å; V739-V783 HydrophobicContact CG2-CB 4.47Å; V739-V783 HydrophobicContact CG2-CG1 4.43Å; V739-V783 HydrophobicContact CG2-CG2 3.96Å; E778-V783 HydrophobicContact CG-CB 4.27Å; E778-V783 HydrophobicContact CG-CG1 4.18Å; D780-V783 HydrophobicContact CB-CB 4.09Å; D780-V783 HydrophobicContact CB-CG2 3.98Å; D780-V783 WeakPolarHBondContact OD1-CG2 3.34Å; D780-V783 PolarHBondContact OD1-N 3.12Å; V783-S785 VanDerWaalsContact C-N 3.29Å; V783-S785 PolarHBondContact O-N 2.91Å; V783-E786 PolarHBondContact O-N 3.18Å; V783-I787 HydrophobicContact CG1-CD1 3.96Å; V783-I787 WeakPolarHBondContact O-CG1 3.43Å; V783-I787 PolarHBondContact O-N 3.49Å
784	L	98.1	Very high	96.6	Very high	6 Å²	6	28.9 Å²	28.9	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-43.4	176.1	174.6	59.8	0	0	0	111.2	I775 E778 D780 D782 E786 I787 M788 K818 I856	I775-L784 HydrophobicContact CB-CD1 4.38Å; I775-L784 HydrophobicContact CG2-CD1 4.12Å; E778-L784 HydrophobicContact CB-CB 4.21Å; E778-L784 HydrophobicContact CB-CD1 4.13Å; E778-L784 HydrophobicContact CG-CB 3.69Å; E778-L784 HydrophobicContact CG-CD1 4.48Å; D780-L784 WeakPolarHBondContact O-CB 3.46Å; D780-L784 PolarHBondContact O-N 3.13Å; D782-L784 VanDerWaalsContact C-N 3.35Å; D782-L784 PolarHBondContact O-N 3.12Å; L784-E786 VanDerWaalsContact C-N 3.28Å; L784-E786 PolarHBondContact O-N 3.38Å; L784-I787 PolarHBondContact O-N 3.34Å; L784-M788 HydrophobicContact CD1-CG 3.87Å; L784-M788 HydrophobicContact CD1-SD 3.91Å; L784-M788 HydrophobicContact CD2-SD 4.39Å; L784-M788 HydrophobicContact CG-CG 4.27Å; L784-M788 HydrophobicContact CG-SD 3.85Å; L784-M788 WeakPolarHBondContact O-CB 3.23Å; L784-M788 VanDerWaalsContact O-CG 3.27Å; L784-M788 WeakPolarHBondContact O-CG 3.26Å; L784-M788 PolarHBondContact O-N 3.46Å; L784-K818 HydrophobicContact CD2-CD 4.45Å; L784-I856 HydrophobicContact CB-CD1 4.23Å; L784-I856 HydrophobicContact CD2-CD1 3.86Å; L784-I856 HydrophobicContact CG-CD1 3.93Å
785	S	97.3	Very high	96.6	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-60	-39.3	-179.3	84.9	0	0	0	0	112.2	S781 D782 V783 M788 H789 Y855	S781-S785 WeakPolarHBondContact O-CB 3.4Å; S781-S785 PolarHBondContact O-N 3.03Å; D782-S785 WeakPolarHBondContact O-CB 3.35Å; D782-S785 PolarHBondContact O-N 3.22Å; D782-S785 PolarHBondContact O-OG 3.06Å; V783-S785 VanDerWaalsContact C-N 3.29Å; V783-S785 PolarHBondContact O-N 2.91Å; S785-M788 PolarHBondContact O-N 2.96Å; S785-H789 WeakPolarHBondContact O-CB 3.28Å; S785-H789 PolarHBondContact O-N 3.19Å; S785-Y855 VanDerWaalsContact CB-CE1 3.47Å; S785-Y855 VanDerWaalsContact OG-CE1 3.26Å; S785-Y855 WeakPolarHBondContact OG-CE1 3.38Å
786	E	98.2	Very high	96.6	Very high	51 Å²	51	34.1 Å²	34.1	24%	0.238	19%	0.193	C	C	.	.	H	α-helix	trans	-72.6	-38.3	178	-73	-56	143.9	0	0	112.3	V739 D782 V783 L784 S790	V739-E786 HydrophobicContact CG1-CG 4.26Å; D782-E786 PolarHBondContact O-N 3.13Å; V783-E786 PolarHBondContact O-N 3.18Å; L784-E786 VanDerWaalsContact C-N 3.28Å; L784-E786 PolarHBondContact O-N 3.38Å; E786-S790 WeakPolarHBondContact O-CB 3.32Å; E786-S790 PolarHBondContact O-N 3.4Å; E786-S790 PolarHBondContact O-OG 3.07Å
787	I	98.7	Very high	96.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-45.8	172.8	-66.9	168.9	0	0	0	110.4	L729 A742 L771 A774 I775 E778 V783 L784 S790 F791	L729-I787 HydrophobicContact CD2-CG1 4.3Å; A742-I787 HydrophobicContact CB-CB 4.48Å; A742-I787 HydrophobicContact CB-CG1 3.76Å; L771-I787 HydrophobicContact CD2-CG2 4.1Å; A774-I787 HydrophobicContact CB-CD1 4.12Å; A774-I787 HydrophobicContact CB-CG2 4.04Å; I775-I787 HydrophobicContact CG1-CG2 3.74Å; E778-I787 HydrophobicContact CB-CD1 4.35Å; E778-I787 HydrophobicContact CG-CD1 4.09Å; V783-I787 HydrophobicContact CG1-CD1 3.96Å; V783-I787 WeakPolarHBondContact O-CG1 3.43Å; V783-I787 PolarHBondContact O-N 3.49Å; L784-I787 PolarHBondContact O-N 3.34Å; I787-S790 PolarHBondContact O-N 2.73Å; I787-F791 WeakPolarHBondContact O-CB 3.46Å; I787-F791 PolarHBondContact O-N 3.14Å
788	M	98.7	Very high	96.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-45.2	179	-72	179.8	75.3	0	0	111.8	I775 L784 S785 F791 A792 L815 I856 K859 V860 I863	I775-M788 HydrophobicContact CD1-CG 4.37Å; I775-M788 HydrophobicContact CG1-CG 4.01Å; I775-M788 HydrophobicContact CG2-CG 3.91Å; I775-M788 HydrophobicContact CG2-SD 4.37Å; L784-M788 HydrophobicContact CD1-CG 3.87Å; L784-M788 HydrophobicContact CD1-SD 3.91Å; L784-M788 HydrophobicContact CD2-SD 4.39Å; L784-M788 HydrophobicContact CG-CG 4.27Å; L784-M788 HydrophobicContact CG-SD 3.85Å; L784-M788 WeakPolarHBondContact O-CB 3.23Å; L784-M788 VanDerWaalsContact O-CG 3.27Å; L784-M788 WeakPolarHBondContact O-CG 3.26Å; L784-M788 PolarHBondContact O-N 3.46Å; S785-M788 PolarHBondContact O-N 2.96Å; M788-F791 PolarHBondContact O-N 3.39Å; M788-A792 PolarHBondContact O-N 2.85Å; M788-L815 HydrophobicContact CE-CD2 4.42Å; M788-I856 HydrophobicContact SD-CG2 4.16Å; M788-K859 HydrophobicContact CB-CB 3.7Å; M788-K859 HydrophobicContact CB-CG 4.46Å; M788-K859 HydrophobicContact CE-CB 3.9Å; M788-K859 HydrophobicContact CG-CB 4.49Å; M788-K859 HydrophobicContact SD-CB 4.04Å; M788-V860 HydrophobicContact CE-CB 4.41Å; M788-V860 HydrophobicContact CE-CG2 3.68Å; M788-I863 HydrophobicContact CB-CD1 3.82Å; M788-I863 HydrophobicContact CB-CG1 4.49Å; M788-I863 HydrophobicContact CE-CD1 3.75Å; M788-I863 HydrophobicContact CG-CD1 3.97Å; M788-I863 WeakPolarHBondContact O-CG1 3.35Å
789	H	98.3	Very high	96.7	Very high	57 Å²	57	32 Å²	32	26%	0.264	17%	0.174	S	C	.	.	H	α-helix	trans	-61.2	-46.5	175.1	-178.1	56.3	0	0	0	111.8	S785 F791 A792 K793 K859 D862	S785-H789 WeakPolarHBondContact O-CB 3.28Å; S785-H789 PolarHBondContact O-N 3.19Å; H789-F791 VanDerWaalsContact C-N 3.3Å; H789-F791 PolarHBondContact O-N 3.23Å; H789-A792 WeakPolarHBondContact O-CB 3.41Å; H789-A792 PolarHBondContact O-N 2.86Å; H789-K793 PolarHBondContact O-N 3.14Å; H789-K859 HydrophobicContact CB-CD 4.32Å; H789-D862 IonicContact CE1-OD2 2.89Å; H789-D862 IonicContact CG-OD2 2.75Å; H789-D862 IonicContact ND1-OD2 3.99Å; H789-D862 PolarHBondContact ND1-OD2 3.45Å
790	S	98.3	Very high	97	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-39.3	178.8	-65.2	0	0	0	0	111.8	A742 E786 I787 K793 C794	A742-S790 VanDerWaalsContact O-CB 3.27Å; A742-S790 WeakPolarHBondContact O-CB 3.13Å; A742-S790 PolarHBondContact O-OG 3.21Å; A742-S790 VanDerWaalsContact O-OG 3.06Å; E786-S790 WeakPolarHBondContact O-CB 3.32Å; E786-S790 PolarHBondContact O-N 3.4Å; E786-S790 PolarHBondContact O-OG 3.07Å; I787-S790 PolarHBondContact O-N 2.73Å; S790-K793 PolarHBondContact O-N 2.72Å; S790-C794 PolarHBondContact O-N 3.15Å; S790-C794 PolarHBondContact O-SG 3.23Å
791	F	98.8	Very high	97	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-45.4	174.4	-177.3	-110.8	0	0	0	112.1	W764 L771 I772 I775 I787 M788 H789 K793 C794 I795 L803 L811 I863	W764-F791 AromaticContact CH2-CD2 3.82Å; W764-F791 HydrophobicContact CH2-CD2 3.82Å; W764-F791 AromaticContact CH2-CE2 3.66Å; W764-F791 HydrophobicContact CH2-CE2 3.66Å; W764-F791 HydrophobicContact CZ2-CE2 4.12Å; L771-F791 HydrophobicContact CB-CD2 3.77Å; L771-F791 HydrophobicContact CB-CE2 4.44Å; L771-F791 HydrophobicContact CD1-CD2 4.1Å; I772-F791 HydrophobicContact CD1-CE2 4.21Å; I772-F791 HydrophobicContact CD1-CZ 4.04Å; I772-F791 HydrophobicContact CG1-CE1 4.48Å; I772-F791 HydrophobicContact CG1-CE2 3.65Å; I772-F791 HydrophobicContact CG1-CZ 3.6Å; I775-F791 HydrophobicContact CD1-CB 4.02Å; I775-F791 HydrophobicContact CD1-CD1 3.84Å; I775-F791 HydrophobicContact CD1-CE1 4.48Å; I775-F791 HydrophobicContact CD1-CG 3.94Å; I787-F791 WeakPolarHBondContact O-CB 3.46Å; I787-F791 PolarHBondContact O-N 3.14Å; M788-F791 PolarHBondContact O-N 3.39Å; H789-F791 VanDerWaalsContact C-N 3.3Å; H789-F791 PolarHBondContact O-N 3.23Å; F791-K793 VanDerWaalsContact C-N 3.33Å; F791-K793 PolarHBondContact O-N 3.3Å; F791-C794 PolarHBondContact O-N 3.26Å; F791-I795 HydrophobicContact CD1-CD1 3.9Å; F791-I795 HydrophobicContact CE1-CD1 3.5Å; F791-I795 VanDerWaalsContact CE1-CD1 3.5Å; F791-I795 HydrophobicContact CE1-CG1 4.47Å; F791-I795 HydrophobicContact CE2-CD1 4.48Å; F791-I795 HydrophobicContact CZ-CD1 3.82Å; F791-I795 HydrophobicContact CZ-CG1 4.44Å; F791-I795 WeakPolarHBondContact O-CG1 3.21Å; F791-I795 PolarHBondContact O-N 3.31Å; F791-L803 HydrophobicContact CE2-CD2 4.49Å; F791-L803 HydrophobicContact CZ-CD2 4.08Å; F791-L811 HydrophobicContact CE1-CD1 3.91Å; F791-L811 HydrophobicContact CE1-CD2 3.81Å; F791-L811 HydrophobicContact CZ-CD2 4.22Å; F791-I863 HydrophobicContact CD1-CD1 4.07Å; F791-I863 HydrophobicContact CD1-CG1 4.15Å; F791-I863 HydrophobicContact CD1-CG2 4.07Å; F791-I863 HydrophobicContact CE1-CG2 4.08Å
792	A	98.5	Very high	97.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.7	-45.4	174.9	0	0	0	0	0	111.7	M788 H789 C794 I795 E796 D862 I863 S866	M788-A792 PolarHBondContact O-N 2.85Å; H789-A792 WeakPolarHBondContact O-CB 3.41Å; H789-A792 PolarHBondContact O-N 2.86Å; A792-C794 PolarHBondContact O-N 3.12Å; A792-I795 WeakPolarHBondContact O-CB 3.21Å; A792-I795 PolarHBondContact O-N 3.09Å; A792-E796 PolarHBondContact O-N 3.19Å; A792-D862 HydrophobicContact CB-CB 4.26Å; A792-I863 HydrophobicContact CB-CG1 4.05Å; A792-S866 VanDerWaalsContact O-CB 3.3Å; A792-S866 WeakPolarHBondContact O-CB 3.26Å; A792-S866 PolarHBondContact O-OG 3.34Å
793	K	98.3	Very high	97.3	Very high	72 Å²	72	26.4 Å²	26.4	31%	0.313	15%	0.15	S	C	.	.	H	α-helix	trans	-64.1	-37.7	176.2	-71.3	-69.2	164.9	-160.4	0	113.2	P746 H789 S790 F791 I795 E796 V797	P746-K793 HydrophobicContact CB-CB 3.76Å; P746-K793 HydrophobicContact CG-CB 4.14Å; H789-K793 PolarHBondContact O-N 3.14Å; S790-K793 PolarHBondContact O-N 2.72Å; F791-K793 VanDerWaalsContact C-N 3.33Å; F791-K793 PolarHBondContact O-N 3.3Å; K793-I795 VanDerWaalsContact C-N 3.33Å; K793-I795 PolarHBondContact O-N 3.38Å; K793-E796 IonicContact NZ-OE2 2.83Å; K793-E796 PolarHBondContact NZ-OE2 3.1Å; K793-E796 PolarHBondContact O-N 3.24Å; K793-V797 VanDerWaalsContact O-CG2 3.26Å; K793-V797 WeakPolarHBondContact O-CG2 3.18Å; K793-V797 PolarHBondContact O-N 2.93Å
794	C	98.4	Very high	97.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.1	-39.6	174.3	-68.2	0	0	0	0	112.1	L749 W764 S790 F791 A792 V797 M798	L749-C794 HydrophobicContact CD1-CB 3.74Å; W764-C794 HydrophobicContact CE3-CB 3.97Å; W764-C794 HydrophobicContact CH2-CB 3.73Å; W764-C794 HydrophobicContact CZ3-CB 3.29Å; S790-C794 PolarHBondContact O-N 3.15Å; S790-C794 PolarHBondContact O-SG 3.23Å; F791-C794 PolarHBondContact O-N 3.26Å; A792-C794 PolarHBondContact O-N 3.12Å; C794-V797 PolarHBondContact O-N 3.38Å; C794-M798 WeakPolarHBondContact O-CB 3.38Å; C794-M798 VanDerWaalsContact O-CG 3.27Å; C794-M798 WeakPolarHBondContact O-CG 3.34Å; C794-M798 PolarHBondContact O-N 3.42Å
795	I	98.3	Very high	97	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.5	-45.1	175	-67.2	168.6	0	0	0	110.3	F791 A792 K793 V797 M798 G799 L803 I867	F791-I795 HydrophobicContact CD1-CD1 3.9Å; F791-I795 HydrophobicContact CE1-CD1 3.5Å; F791-I795 VanDerWaalsContact CE1-CD1 3.5Å; F791-I795 HydrophobicContact CE1-CG1 4.47Å; F791-I795 HydrophobicContact CE2-CD1 4.48Å; F791-I795 HydrophobicContact CZ-CD1 3.82Å; F791-I795 HydrophobicContact CZ-CG1 4.44Å; F791-I795 WeakPolarHBondContact O-CG1 3.21Å; F791-I795 PolarHBondContact O-N 3.31Å; A792-I795 WeakPolarHBondContact O-CB 3.21Å; A792-I795 PolarHBondContact O-N 3.09Å; K793-I795 VanDerWaalsContact C-N 3.33Å; K793-I795 PolarHBondContact O-N 3.38Å; I795-V797 VanDerWaalsContact C-N 3.32Å; I795-V797 PolarHBondContact O-N 2.97Å; I795-M798 PolarHBondContact O-N 2.99Å; I795-G799 PolarHBondContact O-N 3.34Å; I795-L803 HydrophobicContact CD1-CD1 4.2Å; I795-I867 HydrophobicContact CD1-CD1 4.33Å; I795-I867 HydrophobicContact CD1-CG1 3.86Å; I795-I867 HydrophobicContact CG2-CG1 4.43Å
796	E	96.7	Very high	96.9	Very high	111 Å²	111	42.2 Å²	42.2	52%	0.519	23%	0.23	S	C	.	.	H	α-helix	trans	-59.3	-42	176.9	-166.7	-175.2	167.7	0	0	111.9	A792 K793 M798	A792-E796 PolarHBondContact O-N 3.19Å; K793-E796 IonicContact NZ-OE2 2.83Å; K793-E796 PolarHBondContact NZ-OE2 3.1Å; K793-E796 PolarHBondContact O-N 3.24Å; E796-M798 PolarHBondContact O-N 3.23Å
797	V	95.4	Very high	96.9	Very high	24 Å²	24	40.8 Å²	40.8	15%	0.145	22%	0.224	C	C	.	.	H	α-helix	trans	-64.8	-37.7	177.4	166.2	0	0	0	0	112.4	L749 E750 L760 K793 C794 I795	L749-V797 HydrophobicContact CB-CG1 3.7Å; L749-V797 HydrophobicContact CD1-CG1 4.31Å; E750-V797 HydrophobicContact CG-CG2 4.38Å; L760-V797 HydrophobicContact CD1-CG1 4.46Å; K793-V797 VanDerWaalsContact O-CG2 3.26Å; K793-V797 WeakPolarHBondContact O-CG2 3.18Å; K793-V797 PolarHBondContact O-N 2.93Å; C794-V797 PolarHBondContact O-N 3.38Å; I795-V797 VanDerWaalsContact C-N 3.32Å; I795-V797 PolarHBondContact O-N 2.97Å
798	M	96.3	Very high	96.8	Very high	38 Å²	38	42 Å²	42	19%	0.187	23%	0.229	C	C	.	.	H	α-helix	trans	-87.5	-38.8	-174.7	-69.4	-61.6	-62	0	0	113.6	L749 L760 W764 C794 I795 E796 C802	L749-M798 HydrophobicContact CD1-CG 4.31Å; L760-M798 HydrophobicContact CD1-SD 4.12Å; L760-M798 HydrophobicContact CD2-SD 3.82Å; L760-M798 HydrophobicContact CG-CE 4.36Å; L760-M798 HydrophobicContact CG-SD 3.53Å; L760-M798 VanDerWaalsContact CG-SD 3.53Å; W764-M798 HydrophobicContact CB-CE 3.81Å; W764-M798 HydrophobicContact CB-CG 4.26Å; W764-M798 HydrophobicContact CB-SD 3.83Å; W764-M798 HydrophobicContact CD2-CG 4.15Å; W764-M798 HydrophobicContact CG-CE 3.99Å; W764-M798 HydrophobicContact CG-CG 3.93Å; W764-M798 HydrophobicContact CG-SD 4.12Å; C794-M798 WeakPolarHBondContact O-CB 3.38Å; C794-M798 VanDerWaalsContact O-CG 3.27Å; C794-M798 WeakPolarHBondContact O-CG 3.34Å; C794-M798 PolarHBondContact O-N 3.42Å; I795-M798 PolarHBondContact O-N 2.99Å; E796-M798 PolarHBondContact O-N 3.23Å; M798-C802 HydrophobicContact CB-CB 3.46Å; M798-C802 VanDerWaalsContact CB-CB 3.46Å; M798-C802 HydrophobicContact CG-CB 4.26Å
799	G	94.9	Very high	96.8	Very high	18 Å²	18	49.2 Å²	49.2	19%	0.186	26%	0.262	C	S	.	.			trans	73.7	-158.5	-176.7	0	0	0	0	0	115.2	I795 G801 C802	I795-G799 PolarHBondContact O-N 3.34Å; G799-G801 PolarHBondContact O-N 2.73Å; G799-C802 WeakPolarHBondContact O-CB 3.37Å; G799-C802 PolarHBondContact O-N 2.9Å; G799-C802 PolarHBondContact O-SG 3.36Å
800	D	95.6	Very high	96.7	Very high	85 Å²	85	49.3 Å²	49.3	46%	0.455	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	131.9	-176.2	-167.2	-25.9	0	0	0	112.5	K874	D800-K874 IonicContact OD1-NZ 3.31Å; D800-K874 IonicContact OD2-NZ 3.04Å; D800-K874 PolarHBondContact OD2-NZ 3.01Å
801	G	93.8	Very high	96.7	Very high	59 Å²	59	49.2 Å²	49.2	61%	0.608	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	4.8	178.7	0	0	0	0	0	115.1	G799 L803 Y871	G799-G801 PolarHBondContact O-N 2.73Å; G801-L803 VanDerWaalsContact C-N 3.34Å; G801-Y871 PolarHBondContact N-OH 3.17Å
802	C	96.6	Very high	96.7	Very high	14 Å²	14	49.2 Å²	49.2	10%	0.095	26%	0.263	C	S	.	.			trans	-71.7	-20.8	178	69.2	0	0	0	0	114.7	W764 M798 G799 Y871	W764-C802 PolarHBondContact NE1-O 2.99Å; M798-C802 HydrophobicContact CB-CB 3.46Å; M798-C802 VanDerWaalsContact CB-CB 3.46Å; M798-C802 HydrophobicContact CG-CB 4.26Å; G799-C802 WeakPolarHBondContact O-CB 3.37Å; G799-C802 PolarHBondContact O-N 2.9Å; G799-C802 PolarHBondContact O-SG 3.36Å; C802-Y871 PolarHBondContact N-OH 3.06Å; C802-Y871 PolarHBondContact SG-OH 2.7Å; C802-Y871 VanDerWaalsContact SG-OH 3.32Å
803	L	97.2	Very high	96.6	Very high	12 Å²	12	51.1 Å²	51.1	6%	0.063	28%	0.282	C	S	.	.	S	Bend	trans	-115.1	135.6	-178.2	-65.6	172.9	0	0	0	109.9	W764 C768 I772 F791 I795 G801 H807 F808 L811 Y871	W764-L803 HydrophobicContact CZ2-CD2 4.23Å; C768-L803 VanDerWaalsContact SG-CD2 3.55Å; I772-L803 HydrophobicContact CD1-CD2 4.38Å; F791-L803 HydrophobicContact CE2-CD2 4.49Å; F791-L803 HydrophobicContact CZ-CD2 4.08Å; I795-L803 HydrophobicContact CD1-CD1 4.2Å; G801-L803 VanDerWaalsContact C-N 3.34Å; L803-H807 HydrophobicContact CD2-CB 4.1Å; L803-F808 HydrophobicContact CB-CD2 3.9Å; L803-F808 HydrophobicContact CB-CE2 3.56Å; L803-F808 HydrophobicContact CB-CZ 3.93Å; L803-F808 HydrophobicContact CD1-CD1 4.37Å; L803-F808 HydrophobicContact CD1-CE1 3.89Å; L803-F808 HydrophobicContact CD1-CE2 4.37Å; L803-F808 HydrophobicContact CD1-CZ 3.9Å; L803-L811 HydrophobicContact CD1-CD2 4.5Å; L803-Y871 PolarHBondContact N-OH 2.95Å
804	N	94.6	Very high	96.6	Very high	69 Å²	69	48.8 Å²	48.8	37%	0.369	27%	0.273	S	S	.	.			trans	-89.5	174.1	172.3	71.2	37.2	0	0	0	110.4	E806 H807 F808	N804-E806 VanDerWaalsContact C-N 3.33Å; N804-E806 PolarHBondContact O-N 3.09Å; N804-E806 WeakPolarHBondContact OD1-CB 3.32Å; N804-E806 PolarHBondContact OD1-N 2.94Å; N804-H807 PolarHBondContact ND2-CE1 3.37Å; N804-H807 PolarHBondContact ND2-ND1 3.22Å; N804-H807 PolarHBondContact ND2-NE2 2.91Å; N804-H807 PolarHBondContact O-N 3.05Å; N804-H807 WeakPolarHBondContact OD1-CB 3.39Å; N804-H807 PolarHBondContact OD1-CD2 3.37Å; N804-H807 PolarHBondContact OD1-N 3.2Å; N804-F808 WeakPolarHBondContact O-CD2 3.5Å; N804-F808 PolarHBondContact O-N 2.9Å
805	N	95	Very high	96.6	Very high	142 Å²	142	48.8 Å²	48.8	76%	0.759	27%	0.273	S	S	*	.	H	α-helix	trans	-65.1	-34.5	-176.9	-65.9	-16.4	0	0	0	113.5	F808 E809	N805-F808 PolarHBondContact O-N 3.36Å; N805-E809 PolarHBondContact O-N 2.93Å
806	E	95.6	Very high	96.7	Very high	132 Å²	132	52.7 Å²	52.7	62%	0.617	29%	0.29	S	S	*	.	H	α-helix	trans	-67.1	-45.7	178.6	-178.5	176.8	-176.8	0	0	110.4	N804 F808 E809 E810	N804-E806 VanDerWaalsContact C-N 3.33Å; N804-E806 PolarHBondContact O-N 3.09Å; N804-E806 WeakPolarHBondContact OD1-CB 3.32Å; N804-E806 PolarHBondContact OD1-N 2.94Å; E806-F808 VanDerWaalsContact C-N 3.31Å; E806-F808 PolarHBondContact O-N 2.99Å; E806-E809 PolarHBondContact O-N 2.99Å; E806-E809 VanDerWaalsContact O-N 3.14Å; E806-E810 PolarHBondContact O-N 3.48Å
807	H	97	Very high	96.7	Very high	22 Å²	22	49.8 Å²	49.8	10%	0.102	29%	0.285	C	S	.	.	H	α-helix	trans	-60	-40.1	174	-62.9	169.6	0	0	0	112	C768 I772 L803 N804 L811	C768-H807 VanDerWaalsContact SG-CE1 3.52Å; C768-H807 PolarHBondContact SG-ND1 3.38Å; I772-H807 HydrophobicContact CD1-CB 3.58Å; L803-H807 HydrophobicContact CD2-CB 4.1Å; N804-H807 PolarHBondContact ND2-CE1 3.37Å; N804-H807 PolarHBondContact ND2-ND1 3.22Å; N804-H807 PolarHBondContact ND2-NE2 2.91Å; N804-H807 PolarHBondContact O-N 3.05Å; N804-H807 WeakPolarHBondContact OD1-CB 3.39Å; N804-H807 PolarHBondContact OD1-CD2 3.37Å; N804-H807 PolarHBondContact OD1-N 3.2Å; H807-L811 WeakPolarHBondContact O-CB 3.42Å; H807-L811 PolarHBondContact O-N 3.38Å
808	F	97.6	Very high	96.8	Very high	25 Å²	25	50.4 Å²	50.4	11%	0.11	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-42.2	174.4	-90	-62.7	0	0	0	112.2	L803 N804 N805 E806 G812 I867 Y871 V875 W878	L803-F808 HydrophobicContact CB-CD2 3.9Å; L803-F808 HydrophobicContact CB-CE2 3.56Å; L803-F808 HydrophobicContact CB-CZ 3.93Å; L803-F808 HydrophobicContact CD1-CD1 4.37Å; L803-F808 HydrophobicContact CD1-CE1 3.89Å; L803-F808 HydrophobicContact CD1-CE2 4.37Å; L803-F808 HydrophobicContact CD1-CZ 3.9Å; N804-F808 WeakPolarHBondContact O-CD2 3.5Å; N804-F808 PolarHBondContact O-N 2.9Å; N805-F808 PolarHBondContact O-N 3.36Å; E806-F808 VanDerWaalsContact C-N 3.31Å; E806-F808 PolarHBondContact O-N 2.99Å; F808-G812 PolarHBondContact O-N 3.33Å; F808-I867 HydrophobicContact CE1-CG2 4.22Å; F808-Y871 AromaticContact CE2-CE1 3.94Å; F808-Y871 HydrophobicContact CE2-CE1 3.94Å; F808-Y871 AromaticContact CE2-CZ 3.98Å; F808-Y871 HydrophobicContact CZ-CD1 4.18Å; F808-Y871 HydrophobicContact CZ-CD2 4.19Å; F808-Y871 AromaticContact CZ-CE1 3.86Å; F808-Y871 HydrophobicContact CZ-CE1 3.86Å; F808-Y871 AromaticContact CZ-CE2 3.89Å; F808-Y871 HydrophobicContact CZ-CE2 3.89Å; F808-Y871 HydrophobicContact CZ-CG 4.33Å; F808-Y871 AromaticContact CZ-CZ 3.71Å; F808-V875 HydrophobicContact CE1-CG2 3.92Å; F808-V875 HydrophobicContact CZ-CG2 4.27Å; F808-W878 AromaticContact CD1-CD1 3.93Å; F808-W878 AromaticContact CD1-CD2 3.95Å; F808-W878 HydrophobicContact CD1-CD2 3.95Å; F808-W878 AromaticContact CD1-CE2 3.71Å; F808-W878 HydrophobicContact CD1-CG 4.09Å; F808-W878 HydrophobicContact CD1-CZ2 4.18Å; F808-W878 AromaticContact CD1-NE1 3.7Å; F808-W878 HydrophobicContact CE1-CD2 4.42Å; F808-W878 PolarHBondContact O-NE1 3.19Å
809	E	96.9	Very high	96.9	Very high	151 Å²	151	48.7 Å²	48.7	71%	0.706	28%	0.277	S	S	*	.	H	α-helix	trans	-63.6	-47.5	178.4	-172.7	171.5	179.8	0	0	111.4	N805 E806 G812 G813	N805-E809 PolarHBondContact O-N 2.93Å; E806-E809 PolarHBondContact O-N 2.99Å; E806-E809 VanDerWaalsContact O-N 3.14Å; E809-G812 PolarHBondContact O-N 2.98Å; E809-G813 PolarHBondContact O-N 2.86Å; E809-G813 VanDerWaalsContact O-N 3.08Å
810	E	97.5	Very high	97	Very high	60 Å²	60	52.4 Å²	52.4	28%	0.28	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-49.1	178	-170.5	174.5	-172.7	0	0	111.7	I772 K773 E806 G812 G813 I814	I772-E810 HydrophobicContact CG2-CB 4.17Å; I772-E810 HydrophobicContact CG2-CG 3.75Å; K773-E810 WeakPolarHBondContact CG-OE1 3.47Å; E806-E810 PolarHBondContact O-N 3.48Å; E810-G812 VanDerWaalsContact C-N 3.3Å; E810-G812 PolarHBondContact O-N 3.18Å; E810-G813 PolarHBondContact O-N 2.83Å; E810-G813 VanDerWaalsContact O-N 3.17Å; E810-I814 HydrophobicContact CG-CD1 3.96Å; E810-I814 WeakPolarHBondContact O-CG1 3.48Å; E810-I814 PolarHBondContact O-N 2.68Å
811	L	98.1	Very high	97	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-39.6	177.2	-176.7	65.8	0	0	0	112	F791 L803 H807 G813 I814 L815 I863 I867 W878	F791-L811 HydrophobicContact CE1-CD1 3.91Å; F791-L811 HydrophobicContact CE1-CD2 3.81Å; F791-L811 HydrophobicContact CZ-CD2 4.22Å; L803-L811 HydrophobicContact CD1-CD2 4.5Å; H807-L811 WeakPolarHBondContact O-CB 3.42Å; H807-L811 PolarHBondContact O-N 3.38Å; L811-G813 VanDerWaalsContact C-N 3.34Å; L811-G813 PolarHBondContact O-N 3.46Å; L811-I814 PolarHBondContact O-N 2.84Å; L811-L815 HydrophobicContact CD1-CD1 4.19Å; L811-L815 HydrophobicContact CD1-CD2 4.43Å; L811-L815 HydrophobicContact CD1-CG 4.02Å; L811-L815 HydrophobicContact CG-CD1 4.01Å; L811-L815 HydrophobicContact CG-CG 4.21Å; L811-L815 WeakPolarHBondContact O-CB 3.42Å; L811-L815 WeakPolarHBondContact O-CG 3.32Å; L811-L815 PolarHBondContact O-N 3.24Å; L811-I863 HydrophobicContact CD2-CG2 4.32Å; L811-I867 HydrophobicContact CD2-CD1 3.68Å; L811-W878 HydrophobicContact CD2-CZ2 4.38Å; L811-W878 HydrophobicContact CG-CZ2 4.42Å
812	G	97.9	Very high	97.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-44.3	176.1	0	0	0	0	0	111.9	F808 E809 E810 K816	F808-G812 PolarHBondContact O-N 3.33Å; E809-G812 PolarHBondContact O-N 2.98Å; E810-G812 VanDerWaalsContact C-N 3.3Å; E810-G812 PolarHBondContact O-N 3.18Å; G812-K816 WeakPolarHBondContact O-CB 3.3Å; G812-K816 PolarHBondContact O-N 2.9Å; G812-K816 VanDerWaalsContact O-N 3.1Å
813	G	98.1	Very high	97.2	Very high	40 Å²	40	50.2 Å²	50.2	41%	0.412	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-43.9	174.3	0	0	0	0	0	113.1	E809 E810 L811 K816 A817	E809-G813 PolarHBondContact O-N 2.86Å; E809-G813 VanDerWaalsContact O-N 3.08Å; E810-G813 PolarHBondContact O-N 2.83Å; E810-G813 VanDerWaalsContact O-N 3.17Å; L811-G813 VanDerWaalsContact C-N 3.34Å; L811-G813 PolarHBondContact O-N 3.46Å; G813-K816 WeakPolarHBondContact O-CB 3.26Å; G813-K816 PolarHBondContact O-N 3.06Å; G813-A817 WeakPolarHBondContact O-CB 3.42Å; G813-A817 PolarHBondContact O-N 3.08Å
814	I	98.4	Very high	97.1	Very high	22 Å²	22	55.9 Å²	55.9	11%	0.113	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-51.2	-179.4	-69.5	169.4	0	0	0	111.5	I772 I775 E810 L811 K816 A817 K818	I772-I814 HydrophobicContact CG2-CD1 3.76Å; I772-I814 VanDerWaalsContact O-CD1 3.28Å; I772-I814 WeakPolarHBondContact O-CD1 3.39Å; I775-I814 HydrophobicContact CB-CG2 4.29Å; I775-I814 HydrophobicContact CG2-CG2 3.62Å; E810-I814 HydrophobicContact CG-CD1 3.96Å; E810-I814 WeakPolarHBondContact O-CG1 3.48Å; E810-I814 PolarHBondContact O-N 2.68Å; L811-I814 PolarHBondContact O-N 2.84Å; I814-K816 PolarHBondContact O-N 3.26Å; I814-A817 PolarHBondContact O-N 3.01Å; I814-A817 VanDerWaalsContact O-N 3.13Å; I814-K818 WeakPolarHBondContact O-CG 3.39Å; I814-K818 PolarHBondContact O-N 3.32Å
815	L	98.4	Very high	97.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-35.7	179	-66.7	-179.5	0	0	0	111.6	M788 L811 K818 L819 V860 I863 L864 W878 L882	M788-L815 HydrophobicContact CE-CD2 4.42Å; L811-L815 HydrophobicContact CD1-CD1 4.19Å; L811-L815 HydrophobicContact CD1-CD2 4.43Å; L811-L815 HydrophobicContact CD1-CG 4.02Å; L811-L815 HydrophobicContact CG-CD1 4.01Å; L811-L815 HydrophobicContact CG-CG 4.21Å; L811-L815 WeakPolarHBondContact O-CB 3.42Å; L811-L815 WeakPolarHBondContact O-CG 3.32Å; L811-L815 PolarHBondContact O-N 3.24Å; L815-K818 PolarHBondContact O-N 2.92Å; L815-L819 WeakPolarHBondContact O-CG 3.48Å; L815-L819 PolarHBondContact O-N 3Å; L815-V860 HydrophobicContact CD2-CG1 4.4Å; L815-V860 HydrophobicContact CD2-CG2 4.37Å; L815-I863 HydrophobicContact CD1-CG2 4.31Å; L815-I863 HydrophobicContact CD2-CD1 4.33Å; L815-L864 HydrophobicContact CD1-CD2 4.15Å; L815-W878 HydrophobicContact CD1-CH2 4.21Å; L815-L882 HydrophobicContact CB-CD1 4.19Å; L815-L882 HydrophobicContact CB-CD2 4.23Å; L815-L882 HydrophobicContact CD1-CD1 4.24Å
816	K	98.4	Very high	96.9	Very high	83 Å²	83	48.3 Å²	48.3	36%	0.361	24%	0.242	S	C	.	.	H	α-helix	trans	-61.8	-48.5	173.1	-171.4	-172	173.2	-165.1	0	111.4	G812 G813 I814 K818 L819 E820 L882 L885	G812-K816 WeakPolarHBondContact O-CB 3.3Å; G812-K816 PolarHBondContact O-N 2.9Å; G812-K816 VanDerWaalsContact O-N 3.1Å; G813-K816 WeakPolarHBondContact O-CB 3.26Å; G813-K816 PolarHBondContact O-N 3.06Å; I814-K816 PolarHBondContact O-N 3.26Å; K816-K818 VanDerWaalsContact C-N 3.34Å; K816-K818 PolarHBondContact O-N 2.89Å; K816-L819 PolarHBondContact O-N 3.34Å; K816-E820 WeakPolarHBondContact CE-OE1 3.25Å; K816-E820 IonicContact NZ-OE1 2.76Å; K816-E820 WeakPolarHBondContact O-CG 3.49Å; K816-E820 PolarHBondContact O-N 3.1Å; K816-L882 HydrophobicContact CB-CD2 3.72Å; K816-L882 HydrophobicContact CG-CD2 4.45Å; K816-L885 HydrophobicContact CB-CD1 4.36Å; K816-L885 HydrophobicContact CG-CD1 3.52Å
817	A	97.4	Very high	96.8	Very high	50 Å²	50	47.9 Å²	47.9	41%	0.413	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-41.9	178.8	0	0	0	0	0	111.9	G813 I814 L819 E820 E821	G813-A817 WeakPolarHBondContact O-CB 3.42Å; G813-A817 PolarHBondContact O-N 3.08Å; I814-A817 PolarHBondContact O-N 3.01Å; I814-A817 VanDerWaalsContact O-N 3.13Å; A817-L819 PolarHBondContact O-N 3.35Å; A817-E820 PolarHBondContact O-N 2.96Å; A817-E821 WeakPolarHBondContact O-CB 3.41Å; A817-E821 PolarHBondContact O-N 3.09Å
818	K	97.6	Very high	96.3	Very high	37 Å²	37	50.9 Å²	50.9	16%	0.161	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-38.5	176.4	-68.7	-68	170.5	-166.3	0	112.9	L784 I814 L815 K816 E821 H822	L784-K818 HydrophobicContact CD2-CD 4.45Å; I814-K818 WeakPolarHBondContact O-CG 3.39Å; I814-K818 PolarHBondContact O-N 3.32Å; L815-K818 PolarHBondContact O-N 2.92Å; K816-K818 VanDerWaalsContact C-N 3.34Å; K816-K818 PolarHBondContact O-N 2.89Å; K818-E821 IonicContact NZ-OE2 3.84Å; K818-E821 PolarHBondContact NZ-OE2 3.1Å; K818-E821 VanDerWaalsContact NZ-OE2 3.12Å; K818-E821 PolarHBondContact O-N 2.93Å; K818-H822 PolarHBondContact O-N 3.47Å
819	L	98.1	Very high	96	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-69.1	-36	172.8	-74.3	165.2	0	0	0	112.8	L815 K816 A817 F823 L857 L885 I886 L889	L815-L819 WeakPolarHBondContact O-CG 3.48Å; L815-L819 PolarHBondContact O-N 3Å; K816-L819 PolarHBondContact O-N 3.34Å; A817-L819 PolarHBondContact O-N 3.35Å; L819-F823 WeakPolarHBondContact O-CD2 3.3Å; L819-F823 PolarHBondContact O-N 3.39Å; L819-L857 HydrophobicContact CD2-CD1 3.85Å; L819-L885 HydrophobicContact CB-CB 4.07Å; L819-L885 HydrophobicContact CB-CD1 3.8Å; L819-L885 HydrophobicContact CB-CG 4.42Å; L819-L885 HydrophobicContact CD1-CB 4.02Å; L819-L885 HydrophobicContact CD1-CD1 4.35Å; L819-I886 HydrophobicContact CD1-CD1 3.67Å; L819-I886 HydrophobicContact CD2-CD1 4.17Å; L819-L889 HydrophobicContact CD2-CD1 4.27Å
820	E	97.9	Very high	95.6	Very high	96 Å²	96	48.4 Å²	48.4	45%	0.449	25%	0.245	S	C	.	.	H	α-helix	trans	-66.7	-41	174.2	-73.3	173.7	165.6	0	0	111.5	K816 A817 F823 K824 L885	K816-E820 WeakPolarHBondContact CE-OE1 3.25Å; K816-E820 IonicContact NZ-OE1 2.76Å; K816-E820 WeakPolarHBondContact O-CG 3.49Å; K816-E820 PolarHBondContact O-N 3.1Å; A817-E820 PolarHBondContact O-N 2.96Å; E820-F823 PolarHBondContact O-N 2.97Å; E820-K824 WeakPolarHBondContact O-CB 3.46Å; E820-K824 PolarHBondContact O-N 2.91Å; E820-K824 VanDerWaalsContact O-N 3.08Å; E820-L885 HydrophobicContact CG-CD1 3.96Å; E820-L885 HydrophobicContact CG-CD2 4.03Å
821	E	95.6	Very high	95.2	Very high	88 Å²	88	50.2 Å²	50.2	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-58.8	-48.9	173.6	-178.2	173.1	-161.4	0	0	111.4	A817 K818 F823 K824 N825	A817-E821 WeakPolarHBondContact O-CB 3.41Å; A817-E821 PolarHBondContact O-N 3.09Å; K818-E821 IonicContact NZ-OE2 3.84Å; K818-E821 PolarHBondContact NZ-OE2 3.1Å; K818-E821 VanDerWaalsContact NZ-OE2 3.12Å; K818-E821 PolarHBondContact O-N 2.93Å; E821-F823 VanDerWaalsContact C-N 3.33Å; E821-F823 PolarHBondContact O-N 3.37Å; E821-K824 WeakPolarHBondContact O-CB 3.36Å; E821-K824 PolarHBondContact O-N 3.07Å; E821-N825 WeakPolarHBondContact O-CB 3.41Å; E821-N825 VanDerWaalsContact O-CG 3.26Å; E821-N825 PolarHBondContact O-N 3.2Å; E821-N825 PolarHBondContact O-OD1 2.98Å
822	H	97.4	Very high	94.6	Very high	9 Å²	9	54.5 Å²	54.5	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-48.8	-51.2	175.4	179.8	78.5	0	0	0	112.7	K818 N825 Q826 D898	K818-H822 PolarHBondContact O-N 3.47Å; H822-N825 PolarHBondContact O-N 2.88Å; H822-Q826 PolarHBondContact NE2-NE2 3.11Å; H822-Q826 VanDerWaalsContact NE2-NE2 3.13Å; H822-Q826 WeakPolarHBondContact O-CG 3.48Å; H822-Q826 PolarHBondContact O-N 3.46Å; H822-D898 IonicContact CD2-OD1 2.78Å; H822-D898 IonicContact CE1-OD1 2.73Å; H822-D898 PolarHBondContact CE1-OD1 3.49Å; H822-D898 IonicContact NE2-OD1 2.7Å; H822-D898 PolarHBondContact NE2-OD1 2.75Å; H822-D898 IonicContact NE2-OD2 3.51Å
823	F	97.1	Very high	94.1	Very high	14 Å²	14	58 Å²	58	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-70	-35.3	-179.8	-64.6	-56	0	0	0	113.1	L819 E820 E821 Q826 E827 L885 N888 L889	L819-F823 WeakPolarHBondContact O-CD2 3.3Å; L819-F823 PolarHBondContact O-N 3.39Å; E820-F823 PolarHBondContact O-N 2.97Å; E821-F823 VanDerWaalsContact C-N 3.33Å; E821-F823 PolarHBondContact O-N 3.37Å; F823-Q826 PolarHBondContact O-N 2.81Å; F823-E827 PolarHBondContact O-N 2.97Å; F823-L885 HydrophobicContact CD2-CD2 4.15Å; F823-L885 HydrophobicContact CE2-CB 4.33Å; F823-L885 HydrophobicContact CE2-CD2 3.99Å; F823-N888 WeakPolarHBondContact CD2-ND2 3.39Å; F823-N888 HydrophobicContact CE1-CB 4.45Å; F823-N888 VanDerWaalsContact CE1-ND2 3.33Å; F823-N888 WeakPolarHBondContact CE1-ND2 3.49Å; F823-N888 HydrophobicContact CE2-CB 4.11Å; F823-N888 VanDerWaalsContact CE2-ND2 3.29Å; F823-N888 WeakPolarHBondContact CE2-ND2 3.4Å; F823-N888 HydrophobicContact CZ-CB 3.79Å; F823-N888 WeakPolarHBondContact CZ-ND2 3.34Å; F823-L889 HydrophobicContact CE1-CD2 3.76Å; F823-L889 HydrophobicContact CE1-CG 4.5Å; F823-L889 HydrophobicContact CZ-CD2 3.52Å; F823-L889 HydrophobicContact CZ-CG 3.88Å
824	K	95	Very high	93.7	Very high	132 Å²	132	63.6 Å²	63.6	57%	0.574	31%	0.307	S	S	*	.	H	α-helix	trans	-66.1	-40.8	176.9	-174.5	-175.8	175.3	-166.6	0	111	E820 E821 Q826 E827 L828	E820-K824 WeakPolarHBondContact O-CB 3.46Å; E820-K824 PolarHBondContact O-N 2.91Å; E820-K824 VanDerWaalsContact O-N 3.08Å; E821-K824 WeakPolarHBondContact O-CB 3.36Å; E821-K824 PolarHBondContact O-N 3.07Å; K824-Q826 VanDerWaalsContact C-N 3.35Å; K824-Q826 PolarHBondContact O-N 3.41Å; K824-E827 WeakPolarHBondContact O-CB 3.36Å; K824-E827 PolarHBondContact O-N 3.2Å; K824-E827 VanDerWaalsContact O-N 3.17Å; K824-L828 HydrophobicContact CG-CD1 4.31Å; K824-L828 WeakPolarHBondContact O-CG 3.11Å; K824-L828 PolarHBondContact O-N 2.98Å
825	N	93.4	Very high	93.1	Very high	36 Å²	36	65.1 Å²	65.1	19%	0.193	32%	0.316	C	S	.	.	H	α-helix	trans	-63.8	-40.4	178.3	-69.1	-6.4	0	0	0	111.2	E821 H822 E827 L828 R829 D853	E821-N825 WeakPolarHBondContact O-CB 3.41Å; E821-N825 VanDerWaalsContact O-CG 3.26Å; E821-N825 PolarHBondContact O-N 3.2Å; E821-N825 PolarHBondContact O-OD1 2.98Å; H822-N825 PolarHBondContact O-N 2.88Å; N825-E827 VanDerWaalsContact C-N 3.32Å; N825-E827 PolarHBondContact O-N 3.43Å; N825-L828 PolarHBondContact O-N 3.43Å; N825-R829 WeakPolarHBondContact O-CG 3.49Å; N825-R829 PolarHBondContact O-N 3.49Å; N825-D853 WeakPolarHBondContact CB-OD2 3.44Å; N825-D853 PolarHBondContact ND2-OD1 2.87Å; N825-D853 VanDerWaalsContact ND2-OD1 3.15Å
826	Q	91.8	Very high	92.4	Very high	16 Å²	16	71.5 Å²	71.5	8%	0.075	35%	0.346	C	S	.	.	H	α-helix	trans	-55.3	-44.7	171.3	-69.9	179.1	-2.7	0	0	112.6	H822 F823 K824 Q830 D898	H822-Q826 PolarHBondContact NE2-NE2 3.11Å; H822-Q826 VanDerWaalsContact NE2-NE2 3.13Å; H822-Q826 WeakPolarHBondContact O-CG 3.48Å; H822-Q826 PolarHBondContact O-N 3.46Å; F823-Q826 PolarHBondContact O-N 2.81Å; K824-Q826 VanDerWaalsContact C-N 3.35Å; K824-Q826 PolarHBondContact O-N 3.41Å; Q826-Q830 WeakPolarHBondContact O-CG 3.39Å; Q826-Q830 PolarHBondContact O-N 3.06Å; Q826-Q830 VanDerWaalsContact O-N 3.15Å; Q826-D898 PolarHBondContact NE2-OD1 2.88Å; Q826-D898 PolarHBondContact NE2-OD2 2.98Å
827	E	92.5	Very high	91.4	Very high	123 Å²	123	68.2 Å²	68.2	58%	0.575	33%	0.332	S	S	*	.	H	α-helix	trans	-65.9	-43.2	177.5	-67	177.9	-174.4	0	0	111.7	F823 K824 N825 Q830 V831	F823-E827 PolarHBondContact O-N 2.97Å; K824-E827 WeakPolarHBondContact O-CB 3.36Å; K824-E827 PolarHBondContact O-N 3.2Å; K824-E827 VanDerWaalsContact O-N 3.17Å; N825-E827 VanDerWaalsContact C-N 3.32Å; N825-E827 PolarHBondContact O-N 3.43Å; E827-Q830 PolarHBondContact O-N 2.88Å; E827-V831 WeakPolarHBondContact O-CG2 3.41Å; E827-V831 PolarHBondContact O-N 2.93Å; E827-V831 VanDerWaalsContact O-N 3.08Å
828	L	88	Confident	90.7	Very high	85 Å²	85	70.4 Å²	70.4	45%	0.445	33%	0.33	S	S	.	.	H	α-helix	trans	-60.8	-45.3	176.9	-71.3	172	0	0	0	111.7	K824 N825 Q830 V831 K832	K824-L828 HydrophobicContact CG-CD1 4.31Å; K824-L828 WeakPolarHBondContact O-CG 3.11Å; K824-L828 PolarHBondContact O-N 2.98Å; N825-L828 PolarHBondContact O-N 3.43Å; L828-Q830 VanDerWaalsContact C-N 3.31Å; L828-Q830 PolarHBondContact O-N 2.95Å; L828-V831 PolarHBondContact O-N 2.87Å; L828-V831 VanDerWaalsContact O-N 3.13Å; L828-K832 WeakPolarHBondContact O-CG 3.3Å; L828-K832 PolarHBondContact O-N 3.07Å
829	R	91	Very high	89.9	Confident	3 Å²	3	70.6 Å²	70.6	1%	0.011	33%	0.333	C	S	.	.	H	α-helix	trans	-59.5	-41	175.5	-70	-165.4	-76.4	-76.3	3.5	111.6	N825 V831 K832 R833 L846 D850 D853	N825-R829 WeakPolarHBondContact O-CG 3.49Å; N825-R829 PolarHBondContact O-N 3.49Å; R829-V831 VanDerWaalsContact C-N 3.32Å; R829-V831 PolarHBondContact O-N 3.25Å; R829-K832 PolarHBondContact O-N 2.98Å; R829-R833 WeakPolarHBondContact O-CG 3.48Å; R829-R833 PolarHBondContact O-N 2.9Å; R829-L846 HydrophobicContact CB-CD2 4.29Å; R829-L846 WeakPolarHBondContact CD-O 3.42Å; R829-L846 HydrophobicContact CG-CD2 3.94Å; R829-D850 IonicContact CZ-OD1 3.82Å; R829-D850 IonicContact NE-OD1 2.64Å; R829-D850 PolarHBondContact NE-OD1 3.11Å; R829-D850 IonicContact NH2-OD1 2.63Å; R829-D850 PolarHBondContact NH2-OD1 3.35Å; R829-D853 IonicContact CZ-OD2 2.88Å; R829-D853 VanDerWaalsContact CZ-OD2 3.25Å; R829-D853 IonicContact NH1-OD2 3.53Å; R829-D853 PolarHBondContact NH1-OD2 2.84Å; R829-D853 IonicContact NH2-OD2 2.79Å; R829-D853 PolarHBondContact NH2-OD2 3.02Å
830	Q	89.2	Confident	89.1	Confident	121 Å²	121	76.2 Å²	76.2	57%	0.565	36%	0.359	S	S	*	.	H	α-helix	trans	-63.9	-35.5	175.8	-73.3	-173.6	19.4	0	0	113.3	Q826 E827 L828 Q834	Q826-Q830 WeakPolarHBondContact O-CG 3.39Å; Q826-Q830 PolarHBondContact O-N 3.06Å; Q826-Q830 VanDerWaalsContact O-N 3.15Å; E827-Q830 PolarHBondContact O-N 2.88Å; L828-Q830 VanDerWaalsContact C-N 3.31Å; L828-Q830 PolarHBondContact O-N 2.95Å; Q830-Q834 PolarHBondContact O-NE2 2.97Å
831	V	88.8	Confident	88	Confident	98 Å²	98	74.1 Å²	74.1	59%	0.594	35%	0.349	S	S	*	.	H	α-helix	trans	-70.5	-42.3	174.4	176.1	0	0	0	0	110.8	E827 L828 R829 R833 Q834	E827-V831 WeakPolarHBondContact O-CG2 3.41Å; E827-V831 PolarHBondContact O-N 2.93Å; E827-V831 VanDerWaalsContact O-N 3.08Å; L828-V831 PolarHBondContact O-N 2.87Å; L828-V831 VanDerWaalsContact O-N 3.13Å; R829-V831 VanDerWaalsContact C-N 3.32Å; R829-V831 PolarHBondContact O-N 3.25Å; V831-R833 VanDerWaalsContact C-N 3.27Å; V831-R833 PolarHBondContact O-N 3.13Å; V831-Q834 WeakPolarHBondContact O-CB 3.35Å; V831-Q834 PolarHBondContact O-N 2.94Å
832	K	84.8	Confident	87.4	Confident	89 Å²	89	71.9 Å²	71.9	39%	0.387	34%	0.341	S	S	.	.	H	α-helix	trans	-57.3	-38.3	175.5	-72	-179.7	-178.1	175.5	0	111.7	L828 R829 Q834 D835 L846 E849	L828-K832 WeakPolarHBondContact O-CG 3.3Å; L828-K832 PolarHBondContact O-N 3.07Å; R829-K832 PolarHBondContact O-N 2.98Å; K832-Q834 PolarHBondContact O-N 3.22Å; K832-D835 WeakPolarHBondContact O-CB 3.46Å; K832-D835 PolarHBondContact O-N 3.22Å; K832-D835 VanDerWaalsContact O-N 3.08Å; K832-L846 HydrophobicContact CB-CD1 4.17Å; K832-L846 HydrophobicContact CB-CD2 4.05Å; K832-L846 HydrophobicContact CD-CD2 3.42Å; K832-L846 VanDerWaalsContact CD-CD2 3.42Å; K832-L846 HydrophobicContact CG-CD2 4.39Å; K832-E849 VanDerWaalsContact NZ-CD 3.3Å; K832-E849 IonicContact NZ-OE1 3.3Å; K832-E849 PolarHBondContact NZ-OE1 3.48Å; K832-E849 IonicContact NZ-OE2 2.74Å; K832-E849 PolarHBondContact NZ-OE2 2.95Å
833	R	87.5	Confident	87	Confident	75 Å²	75	73.7 Å²	73.7	28%	0.283	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.5	174.5	-70.9	179.1	177.2	106	-4.6	115	R829 V831 Y838 E843 L846	R829-R833 WeakPolarHBondContact O-CG 3.48Å; R829-R833 PolarHBondContact O-N 2.9Å; V831-R833 VanDerWaalsContact C-N 3.27Å; V831-R833 PolarHBondContact O-N 3.13Å; R833-Y838 HydrophobicContact CB-CD2 4.3Å; R833-Y838 HydrophobicContact CB-CE2 4.18Å; R833-Y838 HydrophobicContact CG-CD2 4.23Å; R833-Y838 HydrophobicContact CG-CE2 3.74Å; R833-E843 IonicContact CZ-OE1 2.94Å; R833-E843 IonicContact CZ-OE2 2.61Å; R833-E843 IonicContact NE-OE1 2.81Å; R833-E843 PolarHBondContact NE-OE1 2.87Å; R833-E843 IonicContact NE-OE2 2.8Å; R833-E843 PolarHBondContact NE-OE2 3.31Å; R833-E843 IonicContact NH2-OE1 3.42Å; R833-E843 PolarHBondContact NH2-OE1 3.39Å; R833-E843 IonicContact NH2-OE2 3.18Å; R833-L846 HydrophobicContact CG-CD1 3.66Å
834	Q	88.9	Confident	86.3	Confident	156 Å²	156	77.1 Å²	77.1	73%	0.729	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-2.7	177.8	-61.6	172.5	26.3	0	0	112.5	Q830 V831 K832	Q830-Q834 PolarHBondContact O-NE2 2.97Å; V831-Q834 WeakPolarHBondContact O-CB 3.35Å; V831-Q834 PolarHBondContact O-N 2.94Å; K832-Q834 PolarHBondContact O-N 3.22Å
835	D	85.9	Confident	85.7	Confident	54 Å²	54	74 Å²	74	29%	0.289	36%	0.361	S	S	.	.	S	Bend	trans	-66.9	149.5	178.1	-164.6	-63.6	0	0	0	110.8	K267 K832 D837 Y838	K267-D835 IonicContact NZ-OD2 3.35Å; K267-D835 PolarHBondContact NZ-OD2 2.72Å; K832-D835 WeakPolarHBondContact O-CB 3.46Å; K832-D835 PolarHBondContact O-N 3.22Å; K832-D835 VanDerWaalsContact O-N 3.08Å; D835-D837 PolarHBondContact O-N 3.45Å; D835-D837 PolarHBondContact OD1-N 2.9Å; D835-Y838 WeakPolarHBondContact O-CB 3.41Å; D835-Y838 PolarHBondContact O-N 3.48Å; D835-Y838 VanDerWaalsContact O-N 3.15Å
836	E	83.9	Confident	85.5	Confident	135 Å²	135	72.4 Å²	72.4	63%	0.631	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.1	-179.1	44.1	169	173.2	0	0	113.7	R270 K314	R270-E836 VanDerWaalsContact CZ-CG 3.47Å; R270-E836 IonicContact CZ-OE1 3.39Å; R270-E836 IonicContact CZ-OE2 3.42Å; R270-E836 VanDerWaalsContact CZ-OE2 3.31Å; R270-E836 IonicContact NE-OE1 3.84Å; R270-E836 PolarHBondContact NE-OE1 3.36Å; R270-E836 VanDerWaalsContact NE-OE1 3.17Å; R270-E836 IonicContact NE-OE2 2.71Å; R270-E836 VanDerWaalsContact NH1-CD 3.3Å; R270-E836 IonicContact NH1-OE1 2.73Å; R270-E836 PolarHBondContact NH1-OE1 3.08Å; R270-E836 VanDerWaalsContact NH1-OE1 3.09Å; R270-E836 IonicContact NH2-OE1 3.5Å; R270-E836 PolarHBondContact NH2-OE1 3.07Å; R270-E836 IonicContact NH2-OE2 3.38Å; R270-E836 PolarHBondContact NH2-OE2 2.8Å; K314-E836 PolarHBondContact NZ-O 2.83Å
837	D	77.7	Confident	85.4	Confident	13 Å²	13	75.2 Å²	75.2	7%	0.07	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7	172.2	-57.4	-32.6	0	0	0	114	R270 A310 M311 K314 D835 D839	R270-D837 IonicContact CZ-OD1 2.7Å; R270-D837 IonicContact CZ-OD2 3.09Å; R270-D837 IonicContact NH1-OD1 2.67Å; R270-D837 PolarHBondContact NH1-OD1 2.9Å; R270-D837 IonicContact NH1-OD2 3.19Å; R270-D837 PolarHBondContact NH1-OD2 3.05Å; R270-D837 IonicContact NH2-OD1 3.16Å; R270-D837 PolarHBondContact NH2-OD1 2.93Å; R270-D837 IonicContact NH2-OD2 3.17Å; A310-D837 HydrophobicContact CB-CB 4.11Å; A310-D837 WeakPolarHBondContact CB-O 3.42Å; M311-D837 HydrophobicContact CG-CB 4.41Å; M311-D837 WeakPolarHBondContact CG-OD2 3.24Å; K314-D837 IonicContact NZ-OD1 3.49Å; K314-D837 PolarHBondContact NZ-OD1 3.16Å; D835-D837 PolarHBondContact O-N 3.45Å; D835-D837 PolarHBondContact OD1-N 2.9Å; D837-D839 PolarHBondContact O-N 3.01Å
838	Y	83.8	Confident	85.1	Confident	97 Å²	97	73.8 Å²	73.8	38%	0.38	36%	0.362	S	S	.	.			trans	-60.5	127.1	176.7	176.9	-102.1	0	0	0	111.8	R833 D835 V842 E843 L846	R833-Y838 HydrophobicContact CB-CD2 4.3Å; R833-Y838 HydrophobicContact CB-CE2 4.18Å; R833-Y838 HydrophobicContact CG-CD2 4.23Å; R833-Y838 HydrophobicContact CG-CE2 3.74Å; D835-Y838 WeakPolarHBondContact O-CB 3.41Å; D835-Y838 PolarHBondContact O-N 3.48Å; D835-Y838 VanDerWaalsContact O-N 3.15Å; Y838-V842 HydrophobicContact CD2-CB 4.42Å; Y838-V842 HydrophobicContact CD2-CG1 4.13Å; Y838-E843 HydrophobicContact CE2-CB 3.89Å; Y838-E843 VanDerWaalsContact CE2-OE2 3.3Å; Y838-E843 WeakPolarHBondContact CE2-OE2 3.44Å; Y838-E843 WeakPolarHBondContact OH-CB 3.35Å; Y838-E843 WeakPolarHBondContact OH-CG 3.49Å; Y838-E843 PolarHBondContact OH-OE2 2.99Å; Y838-L846 HydrophobicContact CE2-CD1 4.41Å
839	D	80.3	Confident	85.2	Confident	40 Å²	40	73.2 Å²	73.2	21%	0.214	36%	0.357	C	S	.	.			trans	-143.4	-178.8	174.1	69.9	23.5	0	0	0	111.9	A310 R313 D837 Q841 V842 E843	A310-D839 WeakPolarHBondContact CA-OD2 3.5Å; A310-D839 VanDerWaalsContact CB-OD2 3.26Å; A310-D839 WeakPolarHBondContact CB-OD2 3.49Å; R313-D839 IonicContact CZ-OD1 2.82Å; R313-D839 IonicContact CZ-OD2 2.76Å; R313-D839 IonicContact NE-OD2 2.68Å; R313-D839 PolarHBondContact NE-OD2 3.41Å; R313-D839 VanDerWaalsContact NH2-CG 3.27Å; R313-D839 IonicContact NH2-OD1 2.77Å; R313-D839 PolarHBondContact NH2-OD1 3.08Å; R313-D839 IonicContact NH2-OD2 3.04Å; R313-D839 PolarHBondContact NH2-OD2 3.22Å; D837-D839 PolarHBondContact O-N 3.01Å; D839-Q841 VanDerWaalsContact C-N 3.27Å; D839-Q841 PolarHBondContact O-N 3.39Å; D839-Q841 PolarHBondContact OD1-N 2.96Å; D839-Q841 VanDerWaalsContact OD1-N 3.09Å; D839-V842 PolarHBondContact O-N 3.05Å; D839-V842 PolarHBondContact OD1-N 2.96Å; D839-E843 PolarHBondContact O-N 3.37Å; D839-E843 VanDerWaalsContact O-N 3.1Å
840	E	80.4	Confident	85.4	Confident	120 Å²	120	74.3 Å²	74.3	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-57.9	-37	-176.4	-171.2	-176.1	-179.4	0	0	112.6	K371 E843 E844	K371-E840 IonicContact NZ-OE1 3.8Å; K371-E840 PolarHBondContact NZ-OE1 3.15Å; K371-E840 IonicContact NZ-OE2 3.73Å; K371-E840 PolarHBondContact NZ-OE2 3.4Å; E840-E843 WeakPolarHBondContact O-CB 3.41Å; E840-E843 PolarHBondContact O-N 3.03Å; E840-E844 PolarHBondContact O-N 2.88Å; E840-E844 VanDerWaalsContact O-N 3.14Å
841	Q	75.9	Confident	85.6	Confident	53 Å²	53	72.5 Å²	72.5	25%	0.248	36%	0.357	C	S	.	.	H	α-helix	trans	-81.2	-32.6	-175.8	-61.2	-84.8	-74.8	0	0	111.3	D839 E843 E844 S845	D839-Q841 VanDerWaalsContact C-N 3.27Å; D839-Q841 PolarHBondContact O-N 3.39Å; D839-Q841 PolarHBondContact OD1-N 2.96Å; D839-Q841 VanDerWaalsContact OD1-N 3.09Å; Q841-E843 VanDerWaalsContact C-N 3.26Å; Q841-E843 PolarHBondContact O-N 3.02Å; Q841-E844 PolarHBondContact NE2-OE1 2.88Å; Q841-E844 PolarHBondContact NE2-OE2 3.02Å; Q841-E844 WeakPolarHBondContact O-CB 3.04Å; Q841-E844 PolarHBondContact O-N 3.12Å; Q841-S845 PolarHBondContact O-N 3.43Å; Q841-S845 VanDerWaalsContact O-N 3.13Å; Q841-S845 PolarHBondContact O-OG 3.41Å
842	V	83.1	Confident	85.8	Confident	40 Å²	40	70.9 Å²	70.9	24%	0.242	35%	0.345	C	S	.	.	H	α-helix	trans	-61.6	-39.2	167.8	175.5	0	0	0	0	110.2	A310 Y838 D839 E844 S845 L846	A310-V842 HydrophobicContact CB-CG2 3.82Å; Y838-V842 HydrophobicContact CD2-CB 4.42Å; Y838-V842 HydrophobicContact CD2-CG1 4.13Å; D839-V842 PolarHBondContact O-N 3.05Å; D839-V842 PolarHBondContact OD1-N 2.96Å; V842-E844 VanDerWaalsContact C-N 3.32Å; V842-E844 PolarHBondContact O-N 3.24Å; V842-S845 PolarHBondContact O-N 3.04Å; V842-L846 HydrophobicContact CG1-CD1 4.13Å; V842-L846 HydrophobicContact CG1-CG 4.29Å; V842-L846 VanDerWaalsContact O-CG 3.22Å; V842-L846 WeakPolarHBondContact O-CG 3.44Å; V842-L846 PolarHBondContact O-N 3.35Å
843	E	87.7	Confident	86.3	Confident	48 Å²	48	67.8 Å²	67.8	22%	0.224	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-36.2	175.4	-174	58.9	-168.4	0	0	112.7	R833 Y838 D839 E840 Q841 L846 Q847	R833-E843 IonicContact CZ-OE1 2.94Å; R833-E843 IonicContact CZ-OE2 2.61Å; R833-E843 IonicContact NE-OE1 2.81Å; R833-E843 PolarHBondContact NE-OE1 2.87Å; R833-E843 IonicContact NE-OE2 2.8Å; R833-E843 PolarHBondContact NE-OE2 3.31Å; R833-E843 IonicContact NH2-OE1 3.42Å; R833-E843 PolarHBondContact NH2-OE1 3.39Å; R833-E843 IonicContact NH2-OE2 3.18Å; Y838-E843 HydrophobicContact CE2-CB 3.89Å; Y838-E843 VanDerWaalsContact CE2-OE2 3.3Å; Y838-E843 WeakPolarHBondContact CE2-OE2 3.44Å; Y838-E843 WeakPolarHBondContact OH-CB 3.35Å; Y838-E843 WeakPolarHBondContact OH-CG 3.49Å; Y838-E843 PolarHBondContact OH-OE2 2.99Å; D839-E843 PolarHBondContact O-N 3.37Å; D839-E843 VanDerWaalsContact O-N 3.1Å; E840-E843 WeakPolarHBondContact O-CB 3.41Å; E840-E843 PolarHBondContact O-N 3.03Å; Q841-E843 VanDerWaalsContact C-N 3.26Å; Q841-E843 PolarHBondContact O-N 3.02Å; E843-L846 PolarHBondContact O-N 3.11Å; E843-Q847 WeakPolarHBondContact O-CB 3.34Å; E843-Q847 PolarHBondContact O-N 3.16Å
844	E	83.6	Confident	86.7	Confident	86 Å²	86	65.3 Å²	65.3	40%	0.402	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-51.9	172.5	-70.1	164.2	-152.3	0	0	110.6	E840 Q841 V842 L846 Q847 D848	E840-E844 PolarHBondContact O-N 2.88Å; E840-E844 VanDerWaalsContact O-N 3.14Å; Q841-E844 PolarHBondContact NE2-OE1 2.88Å; Q841-E844 PolarHBondContact NE2-OE2 3.02Å; Q841-E844 WeakPolarHBondContact O-CB 3.04Å; Q841-E844 PolarHBondContact O-N 3.12Å; V842-E844 VanDerWaalsContact C-N 3.32Å; V842-E844 PolarHBondContact O-N 3.24Å; E844-L846 VanDerWaalsContact C-N 3.31Å; E844-L846 PolarHBondContact O-N 3.33Å; E844-Q847 WeakPolarHBondContact O-CA 3.47Å; E844-Q847 WeakPolarHBondContact O-CB 3.35Å; E844-Q847 PolarHBondContact O-N 3.35Å; E844-D848 PolarHBondContact O-N 2.94Å
845	S	82.6	Confident	87.1	Confident	66 Å²	66	62.1 Å²	62.1	46%	0.462	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-36.3	177.2	-50	0	0	0	0	113.4	Q841 V842 Q847 D848 E849	Q841-S845 PolarHBondContact O-N 3.43Å; Q841-S845 VanDerWaalsContact O-N 3.13Å; Q841-S845 PolarHBondContact O-OG 3.41Å; V842-S845 PolarHBondContact O-N 3.04Å; S845-Q847 VanDerWaalsContact C-N 3.27Å; S845-Q847 PolarHBondContact O-N 2.93Å; S845-D848 PolarHBondContact O-N 3.14Å; S845-E849 WeakPolarHBondContact O-CG 3.49Å; S845-E849 PolarHBondContact O-N 3.36Å
846	L	87.8	Confident	87.7	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-27.8	175.4	-66.6	177.5	0	0	0	112.5	R829 K832 R833 Y838 V842 E843 E844 D850	R829-L846 HydrophobicContact CB-CD2 4.29Å; R829-L846 WeakPolarHBondContact CD-O 3.42Å; R829-L846 HydrophobicContact CG-CD2 3.94Å; K832-L846 HydrophobicContact CB-CD1 4.17Å; K832-L846 HydrophobicContact CB-CD2 4.05Å; K832-L846 HydrophobicContact CD-CD2 3.42Å; K832-L846 VanDerWaalsContact CD-CD2 3.42Å; K832-L846 HydrophobicContact CG-CD2 4.39Å; R833-L846 HydrophobicContact CG-CD1 3.66Å; Y838-L846 HydrophobicContact CE2-CD1 4.41Å; V842-L846 HydrophobicContact CG1-CD1 4.13Å; V842-L846 HydrophobicContact CG1-CG 4.29Å; V842-L846 VanDerWaalsContact O-CG 3.22Å; V842-L846 WeakPolarHBondContact O-CG 3.44Å; V842-L846 PolarHBondContact O-N 3.35Å; E843-L846 PolarHBondContact O-N 3.11Å; E844-L846 VanDerWaalsContact C-N 3.31Å; E844-L846 PolarHBondContact O-N 3.33Å; L846-D850 WeakPolarHBondContact O-CB 3.48Å; L846-D850 PolarHBondContact O-N 2.87Å; L846-D850 VanDerWaalsContact O-N 3.16Å
847	Q	89.6	Confident	88.4	Confident	74 Å²	74	54.3 Å²	54.3	35%	0.346	27%	0.27	S	S	.	.	H	α-helix	trans	-74.9	-40.3	173.4	-169.8	58.6	48.8	0	0	110.5	E843 E844 S845 E849 D850 D851	E843-Q847 WeakPolarHBondContact O-CB 3.34Å; E843-Q847 PolarHBondContact O-N 3.16Å; E844-Q847 WeakPolarHBondContact O-CA 3.47Å; E844-Q847 WeakPolarHBondContact O-CB 3.35Å; E844-Q847 PolarHBondContact O-N 3.35Å; S845-Q847 VanDerWaalsContact C-N 3.27Å; S845-Q847 PolarHBondContact O-N 2.93Å; Q847-E849 PolarHBondContact O-N 2.96Å; Q847-D850 CarbonylContact O-C 3.53Å; Q847-D850 WeakPolarHBondContact O-CA 3.48Å; Q847-D850 WeakPolarHBondContact O-CB 3.41Å; Q847-D850 PolarHBondContact O-N 3.32Å; Q847-D851 PolarHBondContact NE2-OD1 3.01Å; Q847-D851 WeakPolarHBondContact O-CB 3.41Å; Q847-D851 VanDerWaalsContact O-CG 3.3Å; Q847-D851 PolarHBondContact O-N 3.12Å
848	D	87.7	Confident	89.3	Confident	94 Å²	94	54.7 Å²	54.7	50%	0.503	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-43.1	173.3	-60.6	-27.6	0	0	0	111.3	E844 S845 D850 D851 N852	E844-D848 PolarHBondContact O-N 2.94Å; S845-D848 PolarHBondContact O-N 3.14Å; D848-D850 VanDerWaalsContact C-N 3.27Å; D848-D850 PolarHBondContact O-N 3.12Å; D848-D851 PolarHBondContact O-N 3.33Å; D848-N852 WeakPolarHBondContact O-CB 3.33Å; D848-N852 PolarHBondContact O-N 2.93Å
849	E	90.3	Very high	90	Very high	73 Å²	73	51.3 Å²	51.3	34%	0.341	26%	0.26	S	S	.	.	H	α-helix	trans	-57.7	-39	171.3	-76.6	179.2	-155.6	0	0	111.8	K832 S845 Q847 D853	K832-E849 VanDerWaalsContact NZ-CD 3.3Å; K832-E849 IonicContact NZ-OE1 3.3Å; K832-E849 PolarHBondContact NZ-OE1 3.48Å; K832-E849 IonicContact NZ-OE2 2.74Å; K832-E849 PolarHBondContact NZ-OE2 2.95Å; S845-E849 WeakPolarHBondContact O-CG 3.49Å; S845-E849 PolarHBondContact O-N 3.36Å; Q847-E849 PolarHBondContact O-N 2.96Å; E849-D853 PolarHBondContact O-N 3.17Å; E849-D853 VanDerWaalsContact O-N 3.12Å
850	D	93.8	Very high	90.9	Very high	26 Å²	26	49.5 Å²	49.5	14%	0.139	25%	0.251	C	S	.	.	H	α-helix	trans	-71	-41.5	178.4	-163	62.5	0	0	0	111.8	R829 L846 Q847 D848 N852 D853 V854	R829-D850 IonicContact CZ-OD1 3.82Å; R829-D850 IonicContact NE-OD1 2.64Å; R829-D850 PolarHBondContact NE-OD1 3.11Å; R829-D850 IonicContact NH2-OD1 2.63Å; R829-D850 PolarHBondContact NH2-OD1 3.35Å; L846-D850 WeakPolarHBondContact O-CB 3.48Å; L846-D850 PolarHBondContact O-N 2.87Å; L846-D850 VanDerWaalsContact O-N 3.16Å; Q847-D850 CarbonylContact O-C 3.53Å; Q847-D850 WeakPolarHBondContact O-CA 3.48Å; Q847-D850 WeakPolarHBondContact O-CB 3.41Å; Q847-D850 PolarHBondContact O-N 3.32Å; D848-D850 VanDerWaalsContact C-N 3.27Å; D848-D850 PolarHBondContact O-N 3.12Å; D850-N852 VanDerWaalsContact C-N 3.34Å; D850-N852 PolarHBondContact O-N 3.13Å; D850-D853 PolarHBondContact O-N 3.12Å; D850-V854 WeakPolarHBondContact O-CB 3.43Å; D850-V854 VanDerWaalsContact O-CG2 3.23Å; D850-V854 WeakPolarHBondContact O-CG2 3.42Å; D850-V854 PolarHBondContact O-N 3.31Å
851	D	93.6	Very high	91.7	Very high	83 Å²	83	44.1 Å²	44.1	44%	0.444	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-40.2	178.9	-71.1	-2.6	0	0	0	110.5	Q847 D848 V854 Y855	Q847-D851 PolarHBondContact NE2-OD1 3.01Å; Q847-D851 WeakPolarHBondContact O-CB 3.41Å; Q847-D851 VanDerWaalsContact O-CG 3.3Å; Q847-D851 PolarHBondContact O-N 3.12Å; D848-D851 PolarHBondContact O-N 3.33Å; D851-V854 PolarHBondContact O-N 3.1Å; D851-Y855 WeakPolarHBondContact O-CB 3.27Å; D851-Y855 PolarHBondContact O-N 3.25Å
852	N	92.8	Very high	92.8	Very high	63 Å²	63	43.3 Å²	43.3	34%	0.337	22%	0.224	S	C	.	.	H	α-helix	trans	-64.3	-48.1	173.3	-72.8	-12.3	0	0	0	112.4	D848 D850 V854 Y855 I856	D848-N852 WeakPolarHBondContact O-CB 3.33Å; D848-N852 PolarHBondContact O-N 2.93Å; D850-N852 VanDerWaalsContact C-N 3.34Å; D850-N852 PolarHBondContact O-N 3.13Å; N852-V854 VanDerWaalsContact C-N 3.29Å; N852-V854 PolarHBondContact O-N 3.21Å; N852-Y855 WeakPolarHBondContact O-CB 3.11Å; N852-Y855 PolarHBondContact O-N 3.03Å; N852-Y855 VanDerWaalsContact O-N 3.09Å; N852-I856 WeakPolarHBondContact O-CG1 3.46Å; N852-I856 PolarHBondContact O-N 2.82Å
853	D	95.6	Very high	93.5	Very high	25 Å²	25	41.4 Å²	41.4	13%	0.134	21%	0.212	C	C	.	.	H	α-helix	trans	-56.9	-44.3	175.2	-87.2	-13.5	0	0	0	111.1	N825 R829 E849 D850 Y855 I856 L857	N825-D853 WeakPolarHBondContact CB-OD2 3.44Å; N825-D853 PolarHBondContact ND2-OD1 2.87Å; N825-D853 VanDerWaalsContact ND2-OD1 3.15Å; R829-D853 IonicContact CZ-OD2 2.88Å; R829-D853 VanDerWaalsContact CZ-OD2 3.25Å; R829-D853 IonicContact NH1-OD2 3.53Å; R829-D853 PolarHBondContact NH1-OD2 2.84Å; R829-D853 IonicContact NH2-OD2 2.79Å; R829-D853 PolarHBondContact NH2-OD2 3.02Å; E849-D853 PolarHBondContact O-N 3.17Å; E849-D853 VanDerWaalsContact O-N 3.12Å; D850-D853 PolarHBondContact O-N 3.12Å; D853-Y855 VanDerWaalsContact C-N 3.34Å; D853-I856 PolarHBondContact O-N 3.1Å; D853-L857 PolarHBondContact O-N 3Å
854	V	97.1	Very high	94.1	Very high	23 Å²	23	39.1 Å²	39.1	14%	0.139	20%	0.201	C	C	.	.	H	α-helix	trans	-64.6	-39.6	176.6	170.5	0	0	0	0	110.7	D850 D851 N852 L857 T858 P897	D850-V854 WeakPolarHBondContact O-CB 3.43Å; D850-V854 VanDerWaalsContact O-CG2 3.23Å; D850-V854 WeakPolarHBondContact O-CG2 3.42Å; D850-V854 PolarHBondContact O-N 3.31Å; D851-V854 PolarHBondContact O-N 3.1Å; N852-V854 VanDerWaalsContact C-N 3.29Å; N852-V854 PolarHBondContact O-N 3.21Å; V854-L857 WeakPolarHBondContact O-CB 3.41Å; V854-L857 PolarHBondContact O-N 3.41Å; V854-T858 WeakPolarHBondContact O-CG2 3.47Å; V854-T858 PolarHBondContact O-N 3.21Å; V854-P897 HydrophobicContact CB-CB 4.48Å; V854-P897 HydrophobicContact CG1-CB 3.74Å; V854-P897 HydrophobicContact CG1-CG 4.49Å; V854-P897 HydrophobicContact CG2-CB 3.8Å; V854-P897 HydrophobicContact CG2-CG 4.19Å
855	Y	96.8	Very high	94.8	Very high	89 Å²	89	37.9 Å²	37.9	35%	0.349	20%	0.196	S	C	.	.	H	α-helix	trans	-62.4	-44.3	177	-167.5	-124.6	0	0	0	111.6	S785 D851 N852 D853 L857 T858 K859	S785-Y855 VanDerWaalsContact CB-CE1 3.47Å; S785-Y855 VanDerWaalsContact OG-CE1 3.26Å; S785-Y855 WeakPolarHBondContact OG-CE1 3.38Å; D851-Y855 WeakPolarHBondContact O-CB 3.27Å; D851-Y855 PolarHBondContact O-N 3.25Å; N852-Y855 WeakPolarHBondContact O-CB 3.11Å; N852-Y855 PolarHBondContact O-N 3.03Å; N852-Y855 VanDerWaalsContact O-N 3.09Å; D853-Y855 VanDerWaalsContact C-N 3.34Å; Y855-L857 VanDerWaalsContact C-N 3.32Å; Y855-L857 PolarHBondContact O-N 3.4Å; Y855-T858 WeakPolarHBondContact O-CB 3.35Å; Y855-T858 PolarHBondContact O-N 2.81Å; Y855-T858 VanDerWaalsContact O-N 3.11Å; Y855-T858 PolarHBondContact O-OG1 3.38Å; Y855-K859 PolarHBondContact O-N 2.63Å; Y855-K859 VanDerWaalsContact OH-CE 3.3Å; Y855-K859 WeakPolarHBondContact OH-CE 3.47Å; Y855-K859 PolarHBondContact OH-NZ 2.98Å
856	I	97.8	Very high	95.5	Very high	20 Å²	20	34.9 Å²	34.9	10%	0.103	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-40.7	172.5	-64.3	-57.3	0	0	0	111.5	S781 L784 M788 N852 D853 T858 K859 V860	S781-I856 WeakPolarHBondContact O-CD1 3.47Å; L784-I856 HydrophobicContact CB-CD1 4.23Å; L784-I856 HydrophobicContact CD2-CD1 3.86Å; L784-I856 HydrophobicContact CG-CD1 3.93Å; M788-I856 HydrophobicContact SD-CG2 4.16Å; N852-I856 WeakPolarHBondContact O-CG1 3.46Å; N852-I856 PolarHBondContact O-N 2.82Å; D853-I856 PolarHBondContact O-N 3.1Å; I856-T858 PolarHBondContact O-N 3.1Å; I856-K859 CarbonylContact O-C 3.45Å; I856-K859 WeakPolarHBondContact O-CA 3.34Å; I856-K859 PolarHBondContact O-N 3.44Å; I856-V860 PolarHBondContact O-N 3.49Å
857	L	98.2	Very high	96	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-59.6	-36	175.7	-178.1	62.3	0	0	0	112	L819 D853 V854 Y855 K859 V860 S861 L889 W901	L819-L857 HydrophobicContact CD2-CD1 3.85Å; D853-L857 PolarHBondContact O-N 3Å; V854-L857 WeakPolarHBondContact O-CB 3.41Å; V854-L857 PolarHBondContact O-N 3.41Å; Y855-L857 VanDerWaalsContact C-N 3.32Å; Y855-L857 PolarHBondContact O-N 3.4Å; L857-K859 VanDerWaalsContact C-N 3.28Å; L857-K859 PolarHBondContact O-N 2.79Å; L857-V860 WeakPolarHBondContact O-CB 3.48Å; L857-V860 PolarHBondContact O-N 3.25Å; L857-S861 PolarHBondContact O-N 3.15Å; L857-L889 HydrophobicContact CD1-CD1 3.95Å; L857-L889 HydrophobicContact CD1-CD2 4.36Å; L857-L889 HydrophobicContact CD2-CD2 4.03Å; L857-W901 HydrophobicContact CD2-CB 3.76Å; L857-W901 HydrophobicContact CD2-CG 4.21Å; L857-W901 HydrophobicContact CG-CB 3.84Å; L857-W901 HydrophobicContact CG-CG 4.21Å
858	T	97.8	Very high	96.5	Very high	21 Å²	21	31.2 Å²	31.2	13%	0.129	16%	0.158	C	C	.	.	H	α-helix	trans	-61.7	-37.8	173.2	81.9	0	0	0	0	111.6	V854 Y855 I856 S861 D862 W901	V854-T858 WeakPolarHBondContact O-CG2 3.47Å; V854-T858 PolarHBondContact O-N 3.21Å; Y855-T858 WeakPolarHBondContact O-CB 3.35Å; Y855-T858 PolarHBondContact O-N 2.81Å; Y855-T858 VanDerWaalsContact O-N 3.11Å; Y855-T858 PolarHBondContact O-OG1 3.38Å; I856-T858 PolarHBondContact O-N 3.1Å; T858-S861 VanDerWaalsContact O-CB 3.27Å; T858-S861 WeakPolarHBondContact O-CB 3.46Å; T858-S861 PolarHBondContact O-N 3.48Å; T858-D862 PolarHBondContact O-N 3.17Å; T858-W901 HydrophobicContact CG2-CD2 4.07Å; T858-W901 HydrophobicContact CG2-CH2 3.81Å; T858-W901 HydrophobicContact CG2-CZ2 3.17Å; T858-W901 HydrophobicContact CG2-CZ3 4.47Å
859	K	98.3	Very high	96.9	Very high	26 Å²	26	28.4 Å²	28.4	11%	0.113	15%	0.145	C	C	.	.	H	α-helix	trans	-76.3	-30.2	179.2	-52.6	-54.5	172.3	174	0	112.5	M788 H789 Y855 I856 L857 S861 D862 I863	M788-K859 HydrophobicContact CB-CB 3.7Å; M788-K859 HydrophobicContact CB-CG 4.46Å; M788-K859 HydrophobicContact CE-CB 3.9Å; M788-K859 HydrophobicContact CG-CB 4.49Å; M788-K859 HydrophobicContact SD-CB 4.04Å; H789-K859 HydrophobicContact CB-CD 4.32Å; Y855-K859 PolarHBondContact O-N 2.63Å; Y855-K859 VanDerWaalsContact OH-CE 3.3Å; Y855-K859 WeakPolarHBondContact OH-CE 3.47Å; Y855-K859 PolarHBondContact OH-NZ 2.98Å; I856-K859 CarbonylContact O-C 3.45Å; I856-K859 WeakPolarHBondContact O-CA 3.34Å; I856-K859 PolarHBondContact O-N 3.44Å; L857-K859 VanDerWaalsContact C-N 3.28Å; L857-K859 PolarHBondContact O-N 2.79Å; K859-S861 VanDerWaalsContact C-N 3.28Å; K859-D862 PolarHBondContact O-N 3.31Å; K859-I863 WeakPolarHBondContact O-CG1 3.34Å; K859-I863 PolarHBondContact O-N 3.03Å
860	V	98.6	Very high	97.2	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-58.1	-46	165.6	174.4	0	0	0	0	109.6	M788 L815 I856 L857 D862 L864	M788-V860 HydrophobicContact CE-CB 4.41Å; M788-V860 HydrophobicContact CE-CG2 3.68Å; L815-V860 HydrophobicContact CD2-CG1 4.4Å; L815-V860 HydrophobicContact CD2-CG2 4.37Å; I856-V860 PolarHBondContact O-N 3.49Å; L857-V860 WeakPolarHBondContact O-CB 3.48Å; L857-V860 PolarHBondContact O-N 3.25Å; V860-D862 PolarHBondContact O-N 3Å; V860-L864 HydrophobicContact CG1-CD1 3.99Å; V860-L864 WeakPolarHBondContact O-CB 3.08Å; V860-L864 VanDerWaalsContact O-CG 3.31Å; V860-L864 WeakPolarHBondContact O-CG 3.48Å; V860-L864 PolarHBondContact O-N 3.1Å
861	S	98.3	Very high	97.4	Very high	7 Å²	7	25.3 Å²	25.3	5%	0.049	13%	0.131	C	C	.	.	H	α-helix	trans	-60.9	-42	175.4	-163.6	0	0	0	0	112.1	L857 T858 K859 L864 H865 I905	L857-S861 PolarHBondContact O-N 3.15Å; T858-S861 VanDerWaalsContact O-CB 3.27Å; T858-S861 WeakPolarHBondContact O-CB 3.46Å; T858-S861 PolarHBondContact O-N 3.48Å; K859-S861 VanDerWaalsContact C-N 3.28Å; S861-L864 PolarHBondContact O-N 2.83Å; S861-H865 VanDerWaalsContact O-CB 3.31Å; S861-H865 WeakPolarHBondContact O-CB 3.34Å; S861-H865 PolarHBondContact O-N 3.23Å; S861-I905 WeakPolarHBondContact OG-CG1 3.46Å
862	D	98.1	Very high	97.6	Very high	36 Å²	36	27.1 Å²	27.1	19%	0.193	14%	0.135	C	C	.	.	H	α-helix	trans	-62.8	-46.6	179.2	-168.7	13.9	0	0	0	112.6	H789 A792 T858 K859 V860 L864 H865 S866	H789-D862 IonicContact CE1-OD2 2.89Å; H789-D862 IonicContact CG-OD2 2.75Å; H789-D862 IonicContact ND1-OD2 3.99Å; H789-D862 PolarHBondContact ND1-OD2 3.45Å; A792-D862 HydrophobicContact CB-CB 4.26Å; T858-D862 PolarHBondContact O-N 3.17Å; K859-D862 PolarHBondContact O-N 3.31Å; V860-D862 PolarHBondContact O-N 3Å; D862-L864 VanDerWaalsContact C-N 3.34Å; D862-L864 PolarHBondContact O-N 3.41Å; D862-H865 WeakPolarHBondContact O-CB 3.14Å; D862-H865 PolarHBondContact O-N 3.14Å; D862-S866 PolarHBondContact O-N 2.97Å
863	I	98.7	Very high	97.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.3	-47.7	174.4	-66.1	173.7	0	0	0	110	I775 M788 F791 A792 L811 L815 K859 H865 S866 I867	I775-I863 HydrophobicContact CD1-CD1 4.04Å; M788-I863 HydrophobicContact CB-CD1 3.82Å; M788-I863 HydrophobicContact CB-CG1 4.49Å; M788-I863 HydrophobicContact CE-CD1 3.75Å; M788-I863 HydrophobicContact CG-CD1 3.97Å; M788-I863 WeakPolarHBondContact O-CG1 3.35Å; F791-I863 HydrophobicContact CD1-CD1 4.07Å; F791-I863 HydrophobicContact CD1-CG1 4.15Å; F791-I863 HydrophobicContact CD1-CG2 4.07Å; F791-I863 HydrophobicContact CE1-CG2 4.08Å; A792-I863 HydrophobicContact CB-CG1 4.05Å; L811-I863 HydrophobicContact CD2-CG2 4.32Å; L815-I863 HydrophobicContact CD1-CG2 4.31Å; L815-I863 HydrophobicContact CD2-CD1 4.33Å; K859-I863 WeakPolarHBondContact O-CG1 3.34Å; K859-I863 PolarHBondContact O-N 3.03Å; I863-H865 PolarHBondContact O-N 3.17Å; I863-S866 PolarHBondContact O-N 3.14Å; I863-S866 PolarHBondContact O-OG 3.02Å; I863-I867 HydrophobicContact CG2-CD1 3.85Å; I863-I867 VanDerWaalsContact O-CG1 3.31Å; I863-I867 WeakPolarHBondContact O-CG1 3.44Å; I863-I867 PolarHBondContact O-N 3.04Å; I863-I867 VanDerWaalsContact O-N 3.15Å
864	L	98.6	Very high	98	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-43.1	179.1	-71.9	174.2	0	0	0	112.1	L815 V860 S861 D862 S866 I867 F868 W878 F879 L882 I905	L815-L864 HydrophobicContact CD1-CD2 4.15Å; V860-L864 HydrophobicContact CG1-CD1 3.99Å; V860-L864 WeakPolarHBondContact O-CB 3.08Å; V860-L864 VanDerWaalsContact O-CG 3.31Å; V860-L864 WeakPolarHBondContact O-CG 3.48Å; V860-L864 PolarHBondContact O-N 3.1Å; S861-L864 PolarHBondContact O-N 2.83Å; D862-L864 VanDerWaalsContact C-N 3.34Å; D862-L864 PolarHBondContact O-N 3.41Å; L864-S866 PolarHBondContact O-N 3.29Å; L864-I867 PolarHBondContact O-N 3.38Å; L864-F868 HydrophobicContact CB-CD2 4.24Å; L864-F868 HydrophobicContact CB-CE2 3.8Å; L864-F868 HydrophobicContact CB-CZ 4.44Å; L864-F868 HydrophobicContact CD2-CZ 4.38Å; L864-F868 WeakPolarHBondContact O-CD2 3.34Å; L864-F868 VanDerWaalsContact O-CG 3.26Å; L864-F868 WeakPolarHBondContact O-CG 3.11Å; L864-F868 PolarHBondContact O-N 3.07Å; L864-W878 HydrophobicContact CD2-CH2 4.06Å; L864-W878 HydrophobicContact CD2-CZ3 3.97Å; L864-F879 HydrophobicContact CD1-CE2 4.35Å; L864-F879 HydrophobicContact CD2-CD2 4.36Å; L864-F879 HydrophobicContact CD2-CE2 4.49Å; L864-L882 HydrophobicContact CD2-CD1 4.01Å; L864-I905 HydrophobicContact CD1-CD1 3.93Å; L864-I905 HydrophobicContact CD1-CG1 4.18Å; L864-I905 HydrophobicContact CD1-CG2 3.92Å
865	H	98.5	Very high	98	Very high	61 Å²	61	33.3 Å²	33.3	28%	0.282	16%	0.158	S	C	.	.	H	α-helix	trans	-54.2	-52.7	175.3	174	78.6	0	0	0	110.9	S861 D862 I863 I867 F868 S869 D908 H912	S861-H865 VanDerWaalsContact O-CB 3.31Å; S861-H865 WeakPolarHBondContact O-CB 3.34Å; S861-H865 PolarHBondContact O-N 3.23Å; D862-H865 WeakPolarHBondContact O-CB 3.14Å; D862-H865 PolarHBondContact O-N 3.14Å; I863-H865 PolarHBondContact O-N 3.17Å; H865-I867 VanDerWaalsContact C-N 3.27Å; H865-I867 PolarHBondContact O-N 2.83Å; H865-F868 PolarHBondContact O-N 3.05Å; H865-S869 PolarHBondContact CE1-OG 3.14Å; H865-S869 PolarHBondContact NE2-OG 3.04Å; H865-S869 WeakPolarHBondContact O-CB 3.48Å; H865-S869 PolarHBondContact O-N 3.48Å; H865-S869 PolarHBondContact O-OG 2.97Å; H865-D908 WeakPolarHBondContact CB-OD2 3.48Å; H865-D908 IonicContact CE1-OD1 2.73Å; H865-D908 IonicContact CG-OD1 2.86Å; H865-D908 IonicContact CG-OD2 2.65Å; H865-D908 VanDerWaalsContact ND1-CG 3.34Å; H865-D908 IonicContact ND1-OD1 3.85Å; H865-D908 PolarHBondContact ND1-OD1 3.09Å; H865-D908 IonicContact ND1-OD2 3.88Å; H865-H912 AromaticContact CE1-NE2 3.42Å; H865-H912 PolarHBondContact CE1-NE2 3.24Å; H865-H912 AromaticContact ND1-NE2 3.83Å
866	S	98.2	Very high	98.1	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-60.4	-36.7	-179.4	73.3	0	0	0	0	112.7	A792 D862 I863 L864 S870	A792-S866 VanDerWaalsContact O-CB 3.3Å; A792-S866 WeakPolarHBondContact O-CB 3.26Å; A792-S866 PolarHBondContact O-OG 3.34Å; D862-S866 PolarHBondContact O-N 2.97Å; I863-S866 PolarHBondContact O-N 3.14Å; I863-S866 PolarHBondContact O-OG 3.02Å; L864-S866 PolarHBondContact O-N 3.29Å; S866-S870 VanDerWaalsContact O-CB 3.28Å; S866-S870 WeakPolarHBondContact O-CB 3.43Å; S866-S870 PolarHBondContact O-N 3.02Å; S866-S870 VanDerWaalsContact O-N 3.13Å; S866-S870 PolarHBondContact O-OG 3.15Å
867	I	98.6	Very high	98.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.5	-47.3	176	-68.8	170.7	0	0	0	110.6	I795 F808 L811 I863 L864 H865 S870 Y871 V875 W878	I795-I867 HydrophobicContact CD1-CD1 4.33Å; I795-I867 HydrophobicContact CD1-CG1 3.86Å; I795-I867 HydrophobicContact CG2-CG1 4.43Å; F808-I867 HydrophobicContact CE1-CG2 4.22Å; L811-I867 HydrophobicContact CD2-CD1 3.68Å; I863-I867 HydrophobicContact CG2-CD1 3.85Å; I863-I867 VanDerWaalsContact O-CG1 3.31Å; I863-I867 WeakPolarHBondContact O-CG1 3.44Å; I863-I867 PolarHBondContact O-N 3.04Å; I863-I867 VanDerWaalsContact O-N 3.15Å; L864-I867 PolarHBondContact O-N 3.38Å; H865-I867 VanDerWaalsContact C-N 3.27Å; H865-I867 PolarHBondContact O-N 2.83Å; I867-S870 PolarHBondContact O-N 3.24Å; I867-Y871 HydrophobicContact CG2-CD2 4.19Å; I867-Y871 WeakPolarHBondContact O-CB 3.5Å; I867-Y871 WeakPolarHBondContact O-CD2 3.37Å; I867-Y871 PolarHBondContact O-N 3.2Å; I867-V875 HydrophobicContact CG2-CB 4.32Å; I867-V875 HydrophobicContact CG2-CG1 4.12Å; I867-V875 HydrophobicContact CG2-CG2 3.62Å; I867-W878 HydrophobicContact CD1-CH2 4.11Å; I867-W878 HydrophobicContact CD1-CZ3 4.48Å; I867-W878 HydrophobicContact CG2-CZ3 4.45Å
868	F	98.6	Very high	98.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-46.4	178.7	-65.4	-43.9	0	0	0	111.6	L864 H865 S870 K872 V875 F879 I905 D908 V909 H912	L864-F868 HydrophobicContact CB-CD2 4.24Å; L864-F868 HydrophobicContact CB-CE2 3.8Å; L864-F868 HydrophobicContact CB-CZ 4.44Å; L864-F868 HydrophobicContact CD2-CZ 4.38Å; L864-F868 WeakPolarHBondContact O-CD2 3.34Å; L864-F868 VanDerWaalsContact O-CG 3.26Å; L864-F868 WeakPolarHBondContact O-CG 3.11Å; L864-F868 PolarHBondContact O-N 3.07Å; H865-F868 PolarHBondContact O-N 3.05Å; F868-S870 VanDerWaalsContact C-N 3.26Å; F868-S870 PolarHBondContact O-N 2.79Å; F868-K872 WeakPolarHBondContact O-CA 3.39Å; F868-K872 PolarHBondContact O-N 3.26Å; F868-V875 HydrophobicContact CD1-CG1 3.61Å; F868-V875 HydrophobicContact CE1-CG1 3.96Å; F868-F879 HydrophobicContact CE1-CB 4.29Å; F868-F879 HydrophobicContact CE1-CD2 4.22Å; F868-F879 HydrophobicContact CE1-CG 4.12Å; F868-F879 HydrophobicContact CZ-CD1 4.32Å; F868-F879 AromaticContact CZ-CD2 3.67Å; F868-F879 HydrophobicContact CZ-CD2 3.67Å; F868-F879 HydrophobicContact CZ-CE1 4.44Å; F868-F879 AromaticContact CZ-CE2 3.83Å; F868-F879 HydrophobicContact CZ-CE2 3.83Å; F868-F879 AromaticContact CZ-CG 3.93Å; F868-F879 HydrophobicContact CZ-CG 3.93Å; F868-F879 HydrophobicContact CZ-CZ 4.21Å; F868-I905 HydrophobicContact CE2-CG2 4.25Å; F868-D908 HydrophobicContact CB-CB 4.44Å; F868-D908 HydrophobicContact CD2-CB 3.61Å; F868-D908 HydrophobicContact CE2-CB 4.32Å; F868-D908 HydrophobicContact CG-CB 4.43Å; F868-V909 HydrophobicContact CD2-CG2 4.37Å; F868-V909 HydrophobicContact CE1-CG2 4.04Å; F868-V909 HydrophobicContact CE2-CG2 3.77Å; F868-V909 HydrophobicContact CZ-CG2 3.6Å; F868-H912 HydrophobicContact CB-CB 4.09Å; F868-H912 WeakPolarHBondContact O-CB 3.4Å
869	S	97.7	Very high	98.1	Very high	35 Å²	35	33 Å²	33	25%	0.245	16%	0.164	C	C	.	.	H	α-helix	trans	-55.9	-40.1	176	-74.4	0	0	0	0	112.6	H865 H912	H865-S869 PolarHBondContact CE1-OG 3.14Å; H865-S869 PolarHBondContact NE2-OG 3.04Å; H865-S869 WeakPolarHBondContact O-CB 3.48Å; H865-S869 PolarHBondContact O-N 3.48Å; H865-S869 PolarHBondContact O-OG 2.97Å; S869-H912 PolarHBondContact OG-CD2 3.01Å; S869-H912 PolarHBondContact OG-CE1 2.95Å; S869-H912 VanDerWaalsContact OG-CE1 3.23Å; S869-H912 PolarHBondContact OG-NE2 3.16Å; S869-H912 VanDerWaalsContact OG-NE2 3.13Å
870	S	96.8	Very high	98.1	Very high	18 Å²	18	36.4 Å²	36.4	13%	0.126	18%	0.18	C	C	.	.	H	α-helix	trans	-81.1	-51.9	-177.4	-61.3	0	0	0	0	113.3	S866 I867 F868	S866-S870 VanDerWaalsContact O-CB 3.28Å; S866-S870 WeakPolarHBondContact O-CB 3.43Å; S866-S870 PolarHBondContact O-N 3.02Å; S866-S870 VanDerWaalsContact O-N 3.13Å; S866-S870 PolarHBondContact O-OG 3.15Å; I867-S870 PolarHBondContact O-N 3.24Å; F868-S870 VanDerWaalsContact C-N 3.26Å; F868-S870 PolarHBondContact O-N 2.79Å
871	Y	97.6	Very high	98.1	Very high	16 Å²	16	40 Å²	40	6%	0.063	20%	0.197	C	C	.	.	H	α-helix	trans	-93.9	-19.3	-171	-70.9	-93.9	0	0	0	114	G801 C802 L803 F808 I867 K874	G801-Y871 PolarHBondContact N-OH 3.17Å; C802-Y871 PolarHBondContact N-OH 3.06Å; C802-Y871 PolarHBondContact SG-OH 2.7Å; C802-Y871 VanDerWaalsContact SG-OH 3.32Å; L803-Y871 PolarHBondContact N-OH 2.95Å; F808-Y871 AromaticContact CE2-CE1 3.94Å; F808-Y871 HydrophobicContact CE2-CE1 3.94Å; F808-Y871 AromaticContact CE2-CZ 3.98Å; F808-Y871 HydrophobicContact CZ-CD1 4.18Å; F808-Y871 HydrophobicContact CZ-CD2 4.19Å; F808-Y871 AromaticContact CZ-CE1 3.86Å; F808-Y871 HydrophobicContact CZ-CE1 3.86Å; F808-Y871 AromaticContact CZ-CE2 3.89Å; F808-Y871 HydrophobicContact CZ-CE2 3.89Å; F808-Y871 HydrophobicContact CZ-CG 4.33Å; F808-Y871 AromaticContact CZ-CZ 3.71Å; I867-Y871 HydrophobicContact CG2-CD2 4.19Å; I867-Y871 WeakPolarHBondContact O-CB 3.5Å; I867-Y871 WeakPolarHBondContact O-CD2 3.37Å; I867-Y871 PolarHBondContact O-N 3.2Å; Y871-K874 WeakPolarHBondContact O-CB 3.47Å; Y871-K874 WeakPolarHBondContact O-CG 3.49Å; Y871-K874 PolarHBondContact O-N 2.83Å
872	K	98.3	Very high	98.1	Very high	121 Å²	121	39.7 Å²	39.7	53%	0.526	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	55	-142.7	177.2	-55.7	-175.6	179.1	-176.1	0	111.2	F868 K874 V875 H912 C913	F868-K872 WeakPolarHBondContact O-CA 3.39Å; F868-K872 PolarHBondContact O-N 3.26Å; K872-K874 PolarHBondContact O-N 3.49Å; K872-V875 WeakPolarHBondContact O-CG1 3.36Å; K872-V875 PolarHBondContact O-N 2.97Å; K872-H912 WeakPolarHBondContact CA-O 3.21Å; K872-H912 VanDerWaalsContact CB-O 3.24Å; K872-H912 WeakPolarHBondContact CB-O 3.31Å; K872-C913 VanDerWaalsContact C-SG 3.53Å; K872-C913 PolarHBondContact O-SG 2.97Å
873	E	97.8	Very high	98.1	Very high	93 Å²	93	38.3 Å²	38.3	44%	0.435	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-50.4	-24.2	-178.9	-59.5	178.6	-124.3	0	0	115.3	V875 C913 A916	E873-V875 VanDerWaalsContact C-N 3.27Å; E873-V875 PolarHBondContact O-N 2.77Å; E873-C913 WeakPolarHBondContact CG-O 3.48Å; E873-A916 HydrophobicContact CB-CB 4.16Å; E873-A916 HydrophobicContact CG-CB 3.97Å; E873-A916 WeakPolarHBondContact OE2-CB 3.4Å
874	K	97.6	Very high	98.1	Very high	141 Å²	141	42.6 Å²	42.6	61%	0.613	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-66.4	-27.5	-175.3	-58.8	173.7	-172.9	168.6	0	113.3	D800 Y871 K872 P877	D800-K874 IonicContact OD1-NZ 3.31Å; D800-K874 IonicContact OD2-NZ 3.04Å; D800-K874 PolarHBondContact OD2-NZ 3.01Å; Y871-K874 WeakPolarHBondContact O-CB 3.47Å; Y871-K874 WeakPolarHBondContact O-CG 3.49Å; Y871-K874 PolarHBondContact O-N 2.83Å; K872-K874 PolarHBondContact O-N 3.49Å; K874-P877 WeakPolarHBondContact O-CD 3.37Å
875	V	98.1	Very high	98.1	Very high	6 Å²	6	43.8 Å²	43.8	4%	0.036	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-91.6	-10.3	-171.2	78.7	0	0	0	0	113.4	F808 I867 F868 K872 E873 P877 W878 F879	F808-V875 HydrophobicContact CE1-CG2 3.92Å; F808-V875 HydrophobicContact CZ-CG2 4.27Å; I867-V875 HydrophobicContact CG2-CB 4.32Å; I867-V875 HydrophobicContact CG2-CG1 4.12Å; I867-V875 HydrophobicContact CG2-CG2 3.62Å; F868-V875 HydrophobicContact CD1-CG1 3.61Å; F868-V875 HydrophobicContact CE1-CG1 3.96Å; K872-V875 WeakPolarHBondContact O-CG1 3.36Å; K872-V875 PolarHBondContact O-N 2.97Å; E873-V875 VanDerWaalsContact C-N 3.27Å; E873-V875 PolarHBondContact O-N 2.77Å; V875-P877 VanDerWaalsContact C-CD 3.45Å; V875-W878 HydrophobicContact CG2-CB 4.26Å; V875-W878 HydrophobicContact CG2-CD2 4.24Å; V875-W878 HydrophobicContact CG2-CE3 3.69Å; V875-W878 HydrophobicContact CG2-CZ3 4.38Å; V875-W878 WeakPolarHBondContact O-CB 3.47Å; V875-W878 PolarHBondContact O-N 3.42Å; V875-F879 PolarHBondContact O-N 2.61Å
876	L	98.2	Very high	98.1	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-53.6	-41.4	-179.7	-65.3	175.6	0	0	0	114	W878 F879 E880 V909 C913 A916 Y920	L876-W878 VanDerWaalsContact C-N 3.27Å; L876-W878 PolarHBondContact O-N 2.8Å; L876-F879 WeakPolarHBondContact O-CB 3.35Å; L876-F879 PolarHBondContact O-N 2.74Å; L876-F879 VanDerWaalsContact O-N 3.11Å; L876-E880 PolarHBondContact O-N 3.27Å; L876-V909 HydrophobicContact CD2-CG1 4Å; L876-C913 HydrophobicContact CD1-CB 3.89Å; L876-C913 HydrophobicContact CD2-CB 3.73Å; L876-C913 HydrophobicContact CG-CB 3.93Å; L876-A916 HydrophobicContact CD1-CB 3.65Å; L876-Y920 HydrophobicContact CB-CE2 3.88Å; L876-Y920 HydrophobicContact CD1-CD2 4.38Å; L876-Y920 HydrophobicContact CD1-CE2 3.91Å; L876-Y920 HydrophobicContact CD2-CE2 4.4Å; L876-Y920 HydrophobicContact CG-CE2 4.29Å
877	P	98.1	Very high	98.1	Very high	85 Å²	85	42.4 Å²	42.4	55%	0.552	22%	0.217	S	C	*	.	H	α-helix	trans	-61.8	-33.1	176.1	-23.4	35.2	0	0	0	113.8	K874 V875	K874-P877 WeakPolarHBondContact O-CD 3.37Å; V875-P877 VanDerWaalsContact C-CD 3.45Å
878	W	98.3	Very high	98.1	Very high	35 Å²	35	44.5 Å²	44.5	13%	0.133	23%	0.228	C	C	.	.	H	α-helix	trans	-71.7	-38.1	174.5	166.7	90.7	0	0	0	111.1	F808 L811 L815 L864 I867 V875 L876 E880 Q881 L882	F808-W878 AromaticContact CD1-CD1 3.93Å; F808-W878 AromaticContact CD1-CD2 3.95Å; F808-W878 HydrophobicContact CD1-CD2 3.95Å; F808-W878 AromaticContact CD1-CE2 3.71Å; F808-W878 HydrophobicContact CD1-CG 4.09Å; F808-W878 HydrophobicContact CD1-CZ2 4.18Å; F808-W878 AromaticContact CD1-NE1 3.7Å; F808-W878 HydrophobicContact CE1-CD2 4.42Å; F808-W878 PolarHBondContact O-NE1 3.19Å; L811-W878 HydrophobicContact CD2-CZ2 4.38Å; L811-W878 HydrophobicContact CG-CZ2 4.42Å; L815-W878 HydrophobicContact CD1-CH2 4.21Å; L864-W878 HydrophobicContact CD2-CH2 4.06Å; L864-W878 HydrophobicContact CD2-CZ3 3.97Å; I867-W878 HydrophobicContact CD1-CH2 4.11Å; I867-W878 HydrophobicContact CD1-CZ3 4.48Å; I867-W878 HydrophobicContact CG2-CZ3 4.45Å; V875-W878 HydrophobicContact CG2-CB 4.26Å; V875-W878 HydrophobicContact CG2-CD2 4.24Å; V875-W878 HydrophobicContact CG2-CE3 3.69Å; V875-W878 HydrophobicContact CG2-CZ3 4.38Å; V875-W878 WeakPolarHBondContact O-CB 3.47Å; V875-W878 PolarHBondContact O-N 3.42Å; L876-W878 VanDerWaalsContact C-N 3.27Å; L876-W878 PolarHBondContact O-N 2.8Å; W878-E880 PolarHBondContact O-N 2.93Å; W878-Q881 VanDerWaalsContact O-CG 3.29Å; W878-Q881 WeakPolarHBondContact O-CG 3.43Å; W878-Q881 PolarHBondContact O-N 3.26Å; W878-Q881 PolarHBondContact O-NE2 2.9Å; W878-L882 HydrophobicContact CH2-CD1 4.11Å; W878-L882 HydrophobicContact CZ3-CD1 4.39Å
879	F	98.4	Very high	98.1	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.013	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-22.9	179.3	178.6	-114.8	0	0	0	113.4	L864 F868 V875 L876 Q881 L882 L883 I886 I905 F906 V909	L864-F879 HydrophobicContact CD1-CE2 4.35Å; L864-F879 HydrophobicContact CD2-CD2 4.36Å; L864-F879 HydrophobicContact CD2-CE2 4.49Å; F868-F879 HydrophobicContact CE1-CB 4.29Å; F868-F879 HydrophobicContact CE1-CD2 4.22Å; F868-F879 HydrophobicContact CE1-CG 4.12Å; F868-F879 HydrophobicContact CZ-CD1 4.32Å; F868-F879 AromaticContact CZ-CD2 3.67Å; F868-F879 HydrophobicContact CZ-CD2 3.67Å; F868-F879 HydrophobicContact CZ-CE1 4.44Å; F868-F879 AromaticContact CZ-CE2 3.83Å; F868-F879 HydrophobicContact CZ-CE2 3.83Å; F868-F879 AromaticContact CZ-CG 3.93Å; F868-F879 HydrophobicContact CZ-CG 3.93Å; F868-F879 HydrophobicContact CZ-CZ 4.21Å; V875-F879 PolarHBondContact O-N 2.61Å; L876-F879 WeakPolarHBondContact O-CB 3.35Å; L876-F879 PolarHBondContact O-N 2.74Å; L876-F879 VanDerWaalsContact O-N 3.11Å; F879-Q881 PolarHBondContact O-N 3.48Å; F879-L882 HydrophobicContact CD2-CB 4.21Å; F879-L882 HydrophobicContact CD2-CD1 4.31Å; F879-L882 HydrophobicContact CE2-CB 4.22Å; F879-L882 PolarHBondContact O-N 3.32Å; F879-L883 HydrophobicContact CD1-CD1 4.25Å; F879-L883 HydrophobicContact CE1-CD1 3.63Å; F879-L883 HydrophobicContact CZ-CD1 4.34Å; F879-L883 PolarHBondContact O-N 3.05Å; F879-I886 HydrophobicContact CE2-CG1 3.95Å; F879-I886 HydrophobicContact CZ-CB 4.33Å; F879-I886 HydrophobicContact CZ-CG1 3.92Å; F879-I886 HydrophobicContact CZ-CG2 4.32Å; F879-I905 HydrophobicContact CE2-CG2 4.15Å; F879-I905 HydrophobicContact CZ-CG2 3.94Å; F879-F906 HydrophobicContact CE1-CE1 4.45Å; F879-V909 HydrophobicContact CD1-CG2 4.46Å; F879-V909 HydrophobicContact CE1-CG2 4.05Å; F879-V909 HydrophobicContact CZ-CG2 4.45Å
880	E	98.2	Very high	98.1	Very high	98 Å²	98	43.1 Å²	43.1	46%	0.458	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-28.7	177.9	-71	179.5	-174.5	0	0	113.9	L876 W878 L882 L883 Y920	L876-E880 PolarHBondContact O-N 3.27Å; W878-E880 PolarHBondContact O-N 2.93Å; E880-L882 VanDerWaalsContact C-N 3.31Å; E880-L882 PolarHBondContact O-N 3.5Å; E880-L883 WeakPolarHBondContact O-CB 3.46Å; E880-L883 PolarHBondContact O-N 3.36Å; E880-Y920 HydrophobicContact CG-CE1 3.82Å; E880-Y920 PolarHBondContact OE1-OH 3.01Å
881	Q	97.8	Very high	98.2	Very high	77 Å²	77	44.5 Å²	44.5	36%	0.36	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-27.8	177.8	77.2	-169	-67.4	0	0	113.5	W878 F879	W878-Q881 VanDerWaalsContact O-CG 3.29Å; W878-Q881 WeakPolarHBondContact O-CG 3.43Å; W878-Q881 PolarHBondContact O-N 3.26Å; W878-Q881 PolarHBondContact O-NE2 2.9Å; F879-Q881 PolarHBondContact O-N 3.48Å
882	L	98.3	Very high	98.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-21.5	179.1	-57.8	-179.7	0	0	0	111.7	L815 K816 L864 W878 F879 E880 P884 L885 I886	L815-L882 HydrophobicContact CB-CD1 4.19Å; L815-L882 HydrophobicContact CB-CD2 4.23Å; L815-L882 HydrophobicContact CD1-CD1 4.24Å; K816-L882 HydrophobicContact CB-CD2 3.72Å; K816-L882 HydrophobicContact CG-CD2 4.45Å; L864-L882 HydrophobicContact CD2-CD1 4.01Å; W878-L882 HydrophobicContact CH2-CD1 4.11Å; W878-L882 HydrophobicContact CZ3-CD1 4.39Å; F879-L882 HydrophobicContact CD2-CB 4.21Å; F879-L882 HydrophobicContact CD2-CD1 4.31Å; F879-L882 HydrophobicContact CE2-CB 4.22Å; F879-L882 PolarHBondContact O-N 3.32Å; E880-L882 VanDerWaalsContact C-N 3.31Å; E880-L882 PolarHBondContact O-N 3.5Å; L882-P884 VanDerWaalsContact C-CD 3.42Å; L882-P884 VanDerWaalsContact O-N 3.17Å; L882-L885 WeakPolarHBondContact O-CB 3.33Å; L882-L885 PolarHBondContact O-N 3.37Å; L882-I886 HydrophobicContact CB-CG1 4.37Å; L882-I886 PolarHBondContact O-N 3.08Å; L882-I886 VanDerWaalsContact O-N 3.08Å
883	L	97.9	Very high	98	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-49.9	-43.1	-172.4	-167	66.8	0	0	0	114.3	F879 E880 L885 I886 V887 F906 Y920 Y923	F879-L883 HydrophobicContact CD1-CD1 4.25Å; F879-L883 HydrophobicContact CE1-CD1 3.63Å; F879-L883 HydrophobicContact CZ-CD1 4.34Å; F879-L883 PolarHBondContact O-N 3.05Å; E880-L883 WeakPolarHBondContact O-CB 3.46Å; E880-L883 PolarHBondContact O-N 3.36Å; L883-L885 VanDerWaalsContact C-N 3.29Å; L883-L885 PolarHBondContact O-N 2.98Å; L883-I886 PolarHBondContact O-N 3.02Å; L883-V887 HydrophobicContact CD1-CG2 4.4Å; L883-V887 HydrophobicContact CG-CG2 4.36Å; L883-V887 WeakPolarHBondContact O-CB 3.42Å; L883-V887 WeakPolarHBondContact O-CG2 3.15Å; L883-V887 PolarHBondContact O-N 3.08Å; L883-F906 HydrophobicContact CD1-CE1 3.85Å; L883-F906 HydrophobicContact CD1-CZ 4.04Å; L883-Y920 HydrophobicContact CD2-CD1 3.84Å; L883-Y920 HydrophobicContact CD2-CE1 4.31Å; L883-Y923 HydrophobicContact CD1-CG 4.5Å; L883-Y923 HydrophobicContact CD2-CD1 4.39Å; L883-Y923 HydrophobicContact CD2-CD2 3.82Å; L883-Y923 HydrophobicContact CD2-CE1 4.12Å; L883-Y923 HydrophobicContact CD2-CE2 3.56Å; L883-Y923 HydrophobicContact CD2-CG 4.23Å; L883-Y923 HydrophobicContact CG-CD1 4.47Å; L883-Y923 HydrophobicContact CG-CD2 4.47Å; L883-Y923 HydrophobicContact CG-CE1 4.5Å; L883-Y923 HydrophobicContact CG-CG 4.42Å
884	P	98.3	Very high	98	Very high	91 Å²	91	49.7 Å²	49.7	59%	0.591	26%	0.259	S	S	*	.	H	α-helix	trans	-60.3	-36.6	177.5	-23.6	35.2	0	0	0	113.7	L882 N888	L882-P884 VanDerWaalsContact C-CD 3.42Å; L882-P884 VanDerWaalsContact O-N 3.17Å; P884-N888 PolarHBondContact O-N 2.88Å; P884-N888 VanDerWaalsContact O-N 3.12Å
885	L	98.5	Very high	97.9	Very high	24 Å²	24	45.3 Å²	45.3	13%	0.126	25%	0.245	C	C	.	.	H	α-helix	trans	-76.4	-41.3	-179.5	-64.9	169	0	0	0	110.9	K816 L819 E820 F823 L882 L883 V887 N888 L889	K816-L885 HydrophobicContact CB-CD1 4.36Å; K816-L885 HydrophobicContact CG-CD1 3.52Å; L819-L885 HydrophobicContact CB-CB 4.07Å; L819-L885 HydrophobicContact CB-CD1 3.8Å; L819-L885 HydrophobicContact CB-CG 4.42Å; L819-L885 HydrophobicContact CD1-CB 4.02Å; L819-L885 HydrophobicContact CD1-CD1 4.35Å; E820-L885 HydrophobicContact CG-CD1 3.96Å; E820-L885 HydrophobicContact CG-CD2 4.03Å; F823-L885 HydrophobicContact CD2-CD2 4.15Å; F823-L885 HydrophobicContact CE2-CB 4.33Å; F823-L885 HydrophobicContact CE2-CD2 3.99Å; L882-L885 WeakPolarHBondContact O-CB 3.33Å; L882-L885 PolarHBondContact O-N 3.37Å; L883-L885 VanDerWaalsContact C-N 3.29Å; L883-L885 PolarHBondContact O-N 2.98Å; L885-V887 VanDerWaalsContact C-N 3.31Å; L885-V887 PolarHBondContact O-N 3.13Å; L885-N888 VanDerWaalsContact O-CB 3.32Å; L885-N888 WeakPolarHBondContact O-CB 3.46Å; L885-N888 PolarHBondContact O-N 3.1Å; L885-N888 VanDerWaalsContact O-N 3.11Å; L885-L889 PolarHBondContact O-N 3.13Å
886	I	98.5	Very high	97.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-38.7	174.8	-57.1	-52.3	0	0	0	111.3	L819 F879 L882 L883 N888 L889 I905 F906	L819-I886 HydrophobicContact CD1-CD1 3.67Å; L819-I886 HydrophobicContact CD2-CD1 4.17Å; F879-I886 HydrophobicContact CE2-CG1 3.95Å; F879-I886 HydrophobicContact CZ-CB 4.33Å; F879-I886 HydrophobicContact CZ-CG1 3.92Å; F879-I886 HydrophobicContact CZ-CG2 4.32Å; L882-I886 HydrophobicContact CB-CG1 4.37Å; L882-I886 PolarHBondContact O-N 3.08Å; L882-I886 VanDerWaalsContact O-N 3.08Å; L883-I886 PolarHBondContact O-N 3.02Å; I886-N888 VanDerWaalsContact C-N 3.29Å; I886-N888 PolarHBondContact O-N 3.46Å; I886-L889 HydrophobicContact CD1-CD1 4.07Å; I886-L889 WeakPolarHBondContact O-CB 3.48Å; I886-L889 PolarHBondContact O-N 3.07Å; I886-I905 HydrophobicContact CD1-CD1 3.74Å; I886-I905 HydrophobicContact CD1-CG2 4.5Å; I886-I905 HydrophobicContact CG1-CG2 4.45Å; I886-I905 HydrophobicContact CG2-CB 4.27Å; I886-I905 HydrophobicContact CG2-CG2 3.88Å; I886-F906 HydrophobicContact CB-CZ 4.5Å; I886-F906 HydrophobicContact CG2-CD2 4.23Å; I886-F906 HydrophobicContact CG2-CE1 4.44Å; I886-F906 HydrophobicContact CG2-CE2 3.68Å; I886-F906 HydrophobicContact CG2-CZ 3.8Å
887	V	98.5	Very high	97.9	Very high	35 Å²	35	50.7 Å²	50.7	21%	0.212	27%	0.265	C	S	.	.	H	α-helix	trans	-66.5	-32.9	174.5	173.9	0	0	0	0	111.9	L883 L885 L889 I890 C891 F906 Y923	L883-V887 HydrophobicContact CD1-CG2 4.4Å; L883-V887 HydrophobicContact CG-CG2 4.36Å; L883-V887 WeakPolarHBondContact O-CB 3.42Å; L883-V887 WeakPolarHBondContact O-CG2 3.15Å; L883-V887 PolarHBondContact O-N 3.08Å; L885-V887 VanDerWaalsContact C-N 3.31Å; L885-V887 PolarHBondContact O-N 3.13Å; V887-L889 VanDerWaalsContact C-N 3.26Å; V887-L889 PolarHBondContact O-N 2.79Å; V887-I890 WeakPolarHBondContact O-CG1 3.49Å; V887-I890 PolarHBondContact O-N 3.1Å; V887-C891 PolarHBondContact O-SG 2.9Å; V887-F906 HydrophobicContact CG2-CE2 4.41Å; V887-F906 HydrophobicContact CG2-CZ 3.85Å; V887-Y923 HydrophobicContact CG2-CD1 3.61Å; V887-Y923 HydrophobicContact CG2-CG 4.02Å
888	N	98.4	Very high	97.9	Very high	44 Å²	44	46.6 Å²	46.6	24%	0.235	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-33.1	175.7	-171.5	33.4	0	0	0	111.7	F823 P884 L885 I886 C891 R894	F823-N888 WeakPolarHBondContact CD2-ND2 3.39Å; F823-N888 HydrophobicContact CE1-CB 4.45Å; F823-N888 VanDerWaalsContact CE1-ND2 3.33Å; F823-N888 WeakPolarHBondContact CE1-ND2 3.49Å; F823-N888 HydrophobicContact CE2-CB 4.11Å; F823-N888 VanDerWaalsContact CE2-ND2 3.29Å; F823-N888 WeakPolarHBondContact CE2-ND2 3.4Å; F823-N888 HydrophobicContact CZ-CB 3.79Å; F823-N888 WeakPolarHBondContact CZ-ND2 3.34Å; P884-N888 PolarHBondContact O-N 2.88Å; P884-N888 VanDerWaalsContact O-N 3.12Å; L885-N888 VanDerWaalsContact O-CB 3.32Å; L885-N888 WeakPolarHBondContact O-CB 3.46Å; L885-N888 PolarHBondContact O-N 3.1Å; L885-N888 VanDerWaalsContact O-N 3.11Å; I886-N888 VanDerWaalsContact C-N 3.29Å; I886-N888 PolarHBondContact O-N 3.46Å; N888-C891 VanDerWaalsContact O-CB 3.3Å; N888-C891 WeakPolarHBondContact O-CB 3.41Å; N888-C891 PolarHBondContact O-N 3.46Å; N888-R894 PolarHBondContact ND2-NH2 3.16Å; N888-R894 WeakPolarHBondContact O-CG 3.39Å; N888-R894 PolarHBondContact OD1-NE 3.38Å; N888-R894 PolarHBondContact OD1-NH2 3.25Å
889	L	98.6	Very high	97.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-42.3	176.1	-64.7	171.2	0	0	0	112.5	L819 F823 L857 L885 I886 V887 C891 R894 D898 R899	L819-L889 HydrophobicContact CD2-CD1 4.27Å; F823-L889 HydrophobicContact CE1-CD2 3.76Å; F823-L889 HydrophobicContact CE1-CG 4.5Å; F823-L889 HydrophobicContact CZ-CD2 3.52Å; F823-L889 HydrophobicContact CZ-CG 3.88Å; L857-L889 HydrophobicContact CD1-CD1 3.95Å; L857-L889 HydrophobicContact CD1-CD2 4.36Å; L857-L889 HydrophobicContact CD2-CD2 4.03Å; L885-L889 PolarHBondContact O-N 3.13Å; I886-L889 HydrophobicContact CD1-CD1 4.07Å; I886-L889 WeakPolarHBondContact O-CB 3.48Å; I886-L889 PolarHBondContact O-N 3.07Å; V887-L889 VanDerWaalsContact C-N 3.26Å; V887-L889 PolarHBondContact O-N 2.79Å; L889-C891 PolarHBondContact O-N 3.27Å; L889-R894 WeakPolarHBondContact O-CB 3.4Å; L889-D898 HydrophobicContact CB-CB 4.35Å; L889-D898 WeakPolarHBondContact CB-O 3.5Å; L889-D898 HydrophobicContact CD2-CB 3.92Å; L889-D898 CarbonylContact O-C 3.37Å; L889-R899 PolarHBondContact O-N 3.29Å
890	I	98.4	Very high	98	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.031	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	12.3	-178.6	64	165.4	0	0	0	113.5	V887 G902 L903 F906 Y923 F924 P927 Y931	V887-I890 WeakPolarHBondContact O-CG1 3.49Å; V887-I890 PolarHBondContact O-N 3.1Å; I890-G902 VanDerWaalsContact CG2-C 3.46Å; I890-L903 HydrophobicContact CG2-CD2 4.45Å; I890-L903 HydrophobicContact CG2-CG 4.23Å; I890-F906 HydrophobicContact CD1-CD2 4.11Å; I890-F906 HydrophobicContact CD1-CE2 3.64Å; I890-F906 HydrophobicContact CG1-CE2 4.28Å; I890-F906 HydrophobicContact CG2-CD2 4.32Å; I890-F906 HydrophobicContact CG2-CE2 4.39Å; I890-Y923 VanDerWaalsContact CD1-O 3.3Å; I890-Y923 WeakPolarHBondContact CD1-O 3.42Å; I890-F924 HydrophobicContact CD1-CB 4.42Å; I890-P927 HydrophobicContact CD1-CB 4.18Å; I890-P927 HydrophobicContact CD1-CG 4.17Å; I890-Y931 HydrophobicContact CB-CE2 4.28Å; I890-Y931 WeakPolarHBondContact O-CE2 3.48Å; I890-Y931 PolarHBondContact O-OH 2.87Å
891	C	98.2	Very high	98	Very high	47 Å²	47	45.8 Å²	45.8	32%	0.318	23%	0.233	S	C	.	.	S	Bend	trans	-71.5	141.9	174.7	-76.3	0	0	0	0	110.9	V887 N888 L889 H893 R894	V887-C891 PolarHBondContact O-SG 2.9Å; N888-C891 VanDerWaalsContact O-CB 3.3Å; N888-C891 WeakPolarHBondContact O-CB 3.41Å; N888-C891 PolarHBondContact O-N 3.46Å; L889-C891 PolarHBondContact O-N 3.27Å; C891-H893 PolarHBondContact O-N 3.34Å; C891-R894 HydrophobicContact CB-CG 4.04Å; C891-R894 WeakPolarHBondContact O-CB 3.21Å; C891-R894 PolarHBondContact O-N 3.47Å
892	P	96.5	Very high	98	Very high	93 Å²	93	42.1 Å²	42.1	60%	0.604	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-15	-169.5	26.8	-36.4	0	0	0	114.9	Y931	P892-Y931 WeakPolarHBondContact CA-OH 3.28Å
893	H	94.9	Very high	98	Very high	184 Å²	184	42.1 Å²	42.1	85%	0.852	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-5	178.2	-61.8	-47.3	0	0	0	113.7	C891	C891-H893 PolarHBondContact O-N 3.34Å
894	R	97.4	Very high	98.1	Very high	62 Å²	62	43.1 Å²	43.1	23%	0.234	22%	0.223	C	C	.	.	S	Bend	trans	-73.3	156.2	176.4	-69.1	-66.5	165.5	-167.3	-5.3	111.1	N888 L889 C891 D898 R899	N888-R894 PolarHBondContact ND2-NH2 3.16Å; N888-R894 WeakPolarHBondContact O-CG 3.39Å; N888-R894 PolarHBondContact OD1-NE 3.38Å; N888-R894 PolarHBondContact OD1-NH2 3.25Å; L889-R894 WeakPolarHBondContact O-CB 3.4Å; C891-R894 HydrophobicContact CB-CG 4.04Å; C891-R894 WeakPolarHBondContact O-CB 3.21Å; C891-R894 PolarHBondContact O-N 3.47Å; R894-D898 HydrophobicContact CB-CB 3.84Å; R894-D898 WeakPolarHBondContact CD-OD2 3.45Å; R894-D898 HydrophobicContact CG-CB 4.49Å; R894-R899 HydrophobicContact CB-CG 4.32Å; R894-R899 PolarHBondContact O-NH1 3.36Å
895	P	97.1	Very high	98.1	Very high	49 Å²	49	38.8 Å²	38.8	32%	0.318	20%	0.195	S	C	.	.			trans	-59.5	158.7	172.8	30.2	-37.7	0	0	0	110.6	D898 R899	P895-D898 HydrophobicContact CG-CB 4.17Å; P895-D898 WeakPolarHBondContact O-CB 3.37Å; P895-D898 PolarHBondContact O-N 2.96Å; P895-R899 PolarHBondContact O-N 3.39Å; P895-R899 PolarHBondContact O-NH1 2.93Å
896	W	97.9	Very high	98.1	Very high	114 Å²	114	37.7 Å²	37.7	43%	0.432	19%	0.189	S	C	.	.	H	α-helix	trans	-63.2	-32.9	-175.1	69	-91.7	0	0	0	114.2	D898 R899 Q900 E938 V939	W896-D898 PolarHBondContact O-N 3.38Å; W896-R899 PolarHBondContact O-N 3.15Å; W896-Q900 VanDerWaalsContact CZ3-OE1 3.28Å; W896-Q900 PolarHBondContact O-N 2.78Å; W896-E938 HydrophobicContact CE3-CB 4.04Å; W896-E938 HydrophobicContact CE3-CG 4.27Å; W896-E938 HydrophobicContact CH2-CG 4.24Å; W896-E938 HydrophobicContact CZ3-CB 3.72Å; W896-E938 HydrophobicContact CZ3-CG 3.58Å; W896-V939 HydrophobicContact CB-CG2 4.13Å; W896-V939 WeakPolarHBondContact O-CG2 3.36Å
897	P	98.1	Very high	98.1	Very high	10 Å²	10	37.9 Å²	37.9	7%	0.065	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-39.6	176.7	-20.6	34.9	0	0	0	112	V854 R899 Q900 W901	V854-P897 HydrophobicContact CB-CB 4.48Å; V854-P897 HydrophobicContact CG1-CB 3.74Å; V854-P897 HydrophobicContact CG1-CG 4.49Å; V854-P897 HydrophobicContact CG2-CB 3.8Å; V854-P897 HydrophobicContact CG2-CG 4.19Å; P897-R899 VanDerWaalsContact C-N 3.33Å; P897-R899 PolarHBondContact O-N 2.87Å; P897-Q900 WeakPolarHBondContact O-CB 3.27Å; P897-Q900 PolarHBondContact O-N 3.28Å; P897-W901 PolarHBondContact O-N 3.18Å
898	D	98.4	Very high	98.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-56.7	-49.1	173.2	-74.7	16.5	0	0	0	110.8	H822 Q826 L889 R894 P895 W896 Q900 W901 G902	H822-D898 IonicContact CD2-OD1 2.78Å; H822-D898 IonicContact CE1-OD1 2.73Å; H822-D898 PolarHBondContact CE1-OD1 3.49Å; H822-D898 IonicContact NE2-OD1 2.7Å; H822-D898 PolarHBondContact NE2-OD1 2.75Å; H822-D898 IonicContact NE2-OD2 3.51Å; Q826-D898 PolarHBondContact NE2-OD1 2.88Å; Q826-D898 PolarHBondContact NE2-OD2 2.98Å; L889-D898 HydrophobicContact CB-CB 4.35Å; L889-D898 WeakPolarHBondContact CB-O 3.5Å; L889-D898 HydrophobicContact CD2-CB 3.92Å; L889-D898 CarbonylContact O-C 3.37Å; R894-D898 HydrophobicContact CB-CB 3.84Å; R894-D898 WeakPolarHBondContact CD-OD2 3.45Å; R894-D898 HydrophobicContact CG-CB 4.49Å; P895-D898 HydrophobicContact CG-CB 4.17Å; P895-D898 WeakPolarHBondContact O-CB 3.37Å; P895-D898 PolarHBondContact O-N 2.96Å; W896-D898 PolarHBondContact O-N 3.38Å; D898-Q900 VanDerWaalsContact C-N 3.31Å; D898-Q900 PolarHBondContact O-N 2.89Å; D898-W901 PolarHBondContact O-N 3.02Å; D898-G902 PolarHBondContact O-N 3.28Å
899	R	98.6	Very high	98.1	Very high	28 Å²	28	34.8 Å²	34.8	11%	0.106	17%	0.172	C	C	.	.	H	α-helix	trans	-63.3	-40.2	-179.4	-59.5	-164.6	-52.3	-77.3	-0.1	111.3	L889 R894 P895 W896 P897 L903 D934 V939	L889-R899 PolarHBondContact O-N 3.29Å; R894-R899 HydrophobicContact CB-CG 4.32Å; R894-R899 PolarHBondContact O-NH1 3.36Å; P895-R899 PolarHBondContact O-N 3.39Å; P895-R899 PolarHBondContact O-NH1 2.93Å; W896-R899 PolarHBondContact O-N 3.15Å; P897-R899 VanDerWaalsContact C-N 3.33Å; P897-R899 PolarHBondContact O-N 2.87Å; R899-L903 WeakPolarHBondContact O-CB 3.37Å; R899-L903 WeakPolarHBondContact O-CD1 3.27Å; R899-L903 WeakPolarHBondContact O-CG 3.4Å; R899-L903 PolarHBondContact O-N 3.28Å; R899-L903 VanDerWaalsContact O-N 3.1Å; R899-D934 IonicContact CZ-OD2 2.72Å; R899-D934 IonicContact NE-OD2 2.83Å; R899-D934 PolarHBondContact NE-OD2 3.05Å; R899-D934 IonicContact NH2-OD1 3.36Å; R899-D934 PolarHBondContact NH2-OD1 3.45Å; R899-D934 IonicContact NH2-OD2 3.9Å; R899-D934 PolarHBondContact NH2-OD2 3.42Å; R899-D934 VanDerWaalsContact NH2-OD2 3.13Å; R899-V939 HydrophobicContact CB-CG1 4.39Å; R899-V939 HydrophobicContact CB-CG2 3.96Å
900	Q	98.6	Very high	98.1	Very high	33 Å²	33	34.8 Å²	34.8	15%	0.154	17%	0.172	C	C	.	.	H	α-helix	trans	-59.6	-58.5	175.7	176.6	-166.5	2.2	0	0	110.7	W896 P897 D898 G902 L903 C904 E938 V939	W896-Q900 VanDerWaalsContact CZ3-OE1 3.28Å; W896-Q900 PolarHBondContact O-N 2.78Å; P897-Q900 WeakPolarHBondContact O-CB 3.27Å; P897-Q900 PolarHBondContact O-N 3.28Å; D898-Q900 VanDerWaalsContact C-N 3.31Å; D898-Q900 PolarHBondContact O-N 2.89Å; Q900-G902 PolarHBondContact O-N 3.46Å; Q900-L903 WeakPolarHBondContact O-CA 3.43Å; Q900-L903 WeakPolarHBondContact O-CB 3.34Å; Q900-L903 PolarHBondContact O-N 3.26Å; Q900-C904 PolarHBondContact O-N 3.32Å; Q900-C904 PolarHBondContact O-SG 2.86Å; Q900-E938 HydrophobicContact CG-CB 4.08Å; Q900-V939 HydrophobicContact CB-CG2 4.22Å
901	W	98.4	Very high	98.1	Very high	57 Å²	57	36.1 Å²	36.1	22%	0.216	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-33.5	-173.9	-70	112.7	0	0	0	113	L857 T858 P897 D898 L903 C904 I905	L857-W901 HydrophobicContact CD2-CB 3.76Å; L857-W901 HydrophobicContact CD2-CG 4.21Å; L857-W901 HydrophobicContact CG-CB 3.84Å; L857-W901 HydrophobicContact CG-CG 4.21Å; T858-W901 HydrophobicContact CG2-CD2 4.07Å; T858-W901 HydrophobicContact CG2-CH2 3.81Å; T858-W901 HydrophobicContact CG2-CZ2 3.17Å; T858-W901 HydrophobicContact CG2-CZ3 4.47Å; P897-W901 PolarHBondContact O-N 3.18Å; D898-W901 PolarHBondContact O-N 3.02Å; W901-L903 VanDerWaalsContact C-N 3.27Å; W901-L903 PolarHBondContact O-N 3.08Å; W901-C904 HydrophobicContact CE3-CB 4.07Å; W901-C904 HydrophobicContact CZ3-CB 4.5Å; W901-C904 PolarHBondContact O-N 2.87Å; W901-I905 VanDerWaalsContact O-CG1 3.31Å; W901-I905 WeakPolarHBondContact O-CG1 3.43Å; W901-I905 PolarHBondContact O-N 3.42Å
902	G	98.6	Very high	98.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.3	-37.8	169.3	0	0	0	0	0	112.4	I890 D898 Q900 F906	I890-G902 VanDerWaalsContact CG2-C 3.46Å; D898-G902 PolarHBondContact O-N 3.28Å; Q900-G902 PolarHBondContact O-N 3.46Å; G902-F906 WeakPolarHBondContact O-CD2 3.46Å; G902-F906 PolarHBondContact O-N 2.94Å
903	L	98.7	Very high	98.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69.3	-46.3	173.3	-74.1	169	0	0	0	111.8	I890 R899 Q900 W901 I905 F906 D907 M928 Y931 V939 A942 A943	I890-L903 HydrophobicContact CG2-CD2 4.45Å; I890-L903 HydrophobicContact CG2-CG 4.23Å; R899-L903 WeakPolarHBondContact O-CB 3.37Å; R899-L903 WeakPolarHBondContact O-CD1 3.27Å; R899-L903 WeakPolarHBondContact O-CG 3.4Å; R899-L903 PolarHBondContact O-N 3.28Å; R899-L903 VanDerWaalsContact O-N 3.1Å; Q900-L903 WeakPolarHBondContact O-CA 3.43Å; Q900-L903 WeakPolarHBondContact O-CB 3.34Å; Q900-L903 PolarHBondContact O-N 3.26Å; W901-L903 VanDerWaalsContact C-N 3.27Å; W901-L903 PolarHBondContact O-N 3.08Å; L903-I905 VanDerWaalsContact C-N 3.27Å; L903-I905 PolarHBondContact O-N 2.9Å; L903-F906 CarbonylContact O-C 3.57Å; L903-F906 WeakPolarHBondContact O-CA 3.37Å; L903-F906 PolarHBondContact O-N 2.95Å; L903-D907 PolarHBondContact O-N 3.3Å; L903-M928 HydrophobicContact CD2-CB 4Å; L903-M928 HydrophobicContact CD2-CE 4.12Å; L903-M928 HydrophobicContact CD2-CG 4.23Å; L903-Y931 HydrophobicContact CD1-CD2 3.88Å; L903-Y931 HydrophobicContact CD1-CG 4.16Å; L903-Y931 HydrophobicContact CD2-CD2 4.13Å; L903-Y931 HydrophobicContact CG-CD2 4.32Å; L903-V939 HydrophobicContact CD1-CG1 3.93Å; L903-A942 HydrophobicContact CB-CB 3.72Å; L903-A942 HydrophobicContact CD1-CB 4.31Å; L903-A943 HydrophobicContact CD1-CB 4.1Å
904	C	98.6	Very high	98.4	Very high	28 Å²	28	23.4 Å²	23.4	19%	0.189	11%	0.108	C	C	.	.	H	α-helix	trans	-53.2	-44.9	176.9	-62.5	0	0	0	0	111.9	Q900 W901 F906 D907 D908	Q900-C904 PolarHBondContact O-N 3.32Å; Q900-C904 PolarHBondContact O-SG 2.86Å; W901-C904 HydrophobicContact CE3-CB 4.07Å; W901-C904 HydrophobicContact CZ3-CB 4.5Å; W901-C904 PolarHBondContact O-N 2.87Å; C904-F906 VanDerWaalsContact C-N 3.31Å; C904-F906 PolarHBondContact O-N 3.2Å; C904-D907 WeakPolarHBondContact O-CB 3.21Å; C904-D907 PolarHBondContact O-N 3.49Å; C904-D907 VanDerWaalsContact O-N 3.09Å; C904-D908 PolarHBondContact O-N 3.25Å; C904-D908 VanDerWaalsContact O-N 3.07Å
905	I	98.8	Very high	98.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.2	-38.7	177.2	-67.3	167.3	0	0	0	111.4	S861 L864 F868 F879 I886 W901 L903 V909	S861-I905 WeakPolarHBondContact OG-CG1 3.46Å; L864-I905 HydrophobicContact CD1-CD1 3.93Å; L864-I905 HydrophobicContact CD1-CG1 4.18Å; L864-I905 HydrophobicContact CD1-CG2 3.92Å; F868-I905 HydrophobicContact CE2-CG2 4.25Å; F879-I905 HydrophobicContact CE2-CG2 4.15Å; F879-I905 HydrophobicContact CZ-CG2 3.94Å; I886-I905 HydrophobicContact CD1-CD1 3.74Å; I886-I905 HydrophobicContact CD1-CG2 4.5Å; I886-I905 HydrophobicContact CG1-CG2 4.45Å; I886-I905 HydrophobicContact CG2-CB 4.27Å; I886-I905 HydrophobicContact CG2-CG2 3.88Å; W901-I905 VanDerWaalsContact O-CG1 3.31Å; W901-I905 WeakPolarHBondContact O-CG1 3.43Å; W901-I905 PolarHBondContact O-N 3.42Å; L903-I905 VanDerWaalsContact C-N 3.27Å; L903-I905 PolarHBondContact O-N 2.9Å; I905-V909 WeakPolarHBondContact O-CG2 3.37Å; I905-V909 PolarHBondContact O-N 3.01Å
906	F	98.8	Very high	98.4	Very high	1 Å²	1	22 Å²	22	0%	0.004	11%	0.109	C	C	.	.	H	α-helix	trans	-73.4	-28.4	174.8	-77.5	-56.7	0	0	0	113.1	F879 L883 I886 V887 I890 G902 L903 C904 D908 V909 I910 F924 M928	F879-F906 HydrophobicContact CE1-CE1 4.45Å; L883-F906 HydrophobicContact CD1-CE1 3.85Å; L883-F906 HydrophobicContact CD1-CZ 4.04Å; I886-F906 HydrophobicContact CB-CZ 4.5Å; I886-F906 HydrophobicContact CG2-CD2 4.23Å; I886-F906 HydrophobicContact CG2-CE1 4.44Å; I886-F906 HydrophobicContact CG2-CE2 3.68Å; I886-F906 HydrophobicContact CG2-CZ 3.8Å; V887-F906 HydrophobicContact CG2-CE2 4.41Å; V887-F906 HydrophobicContact CG2-CZ 3.85Å; I890-F906 HydrophobicContact CD1-CD2 4.11Å; I890-F906 HydrophobicContact CD1-CE2 3.64Å; I890-F906 HydrophobicContact CG1-CE2 4.28Å; I890-F906 HydrophobicContact CG2-CD2 4.32Å; I890-F906 HydrophobicContact CG2-CE2 4.39Å; G902-F906 WeakPolarHBondContact O-CD2 3.46Å; G902-F906 PolarHBondContact O-N 2.94Å; L903-F906 CarbonylContact O-C 3.57Å; L903-F906 WeakPolarHBondContact O-CA 3.37Å; L903-F906 PolarHBondContact O-N 2.95Å; C904-F906 VanDerWaalsContact C-N 3.31Å; C904-F906 PolarHBondContact O-N 3.2Å; F906-D908 VanDerWaalsContact C-N 3.35Å; F906-V909 WeakPolarHBondContact O-CB 3.22Å; F906-V909 PolarHBondContact O-N 2.84Å; F906-I910 VanDerWaalsContact O-CG1 3.29Å; F906-I910 WeakPolarHBondContact O-CG1 3.03Å; F906-I910 PolarHBondContact O-N 3.08Å; F906-F924 HydrophobicContact CB-CB 3.9Å; F906-F924 HydrophobicContact CB-CD1 4.43Å; F906-F924 HydrophobicContact CB-CD2 4.45Å; F906-F924 HydrophobicContact CB-CG 4.03Å; F906-F924 HydrophobicContact CD1-CB 3.73Å; F906-F924 AromaticContact CD1-CD1 3.35Å; F906-F924 HydrophobicContact CD1-CD1 3.35Å; F906-F924 HydrophobicContact CD1-CE1 4.11Å; F906-F924 AromaticContact CD1-CG 3.73Å; F906-F924 HydrophobicContact CD1-CG 3.73Å; F906-F924 HydrophobicContact CD2-CB 3.51Å; F906-F924 HydrophobicContact CD2-CG 4.37Å; F906-F924 HydrophobicContact CE1-CB 4.1Å; F906-F924 AromaticContact CE1-CD1 3.66Å; F906-F924 HydrophobicContact CE1-CD1 3.66Å; F906-F924 HydrophobicContact CE1-CG 4.27Å; F906-F924 HydrophobicContact CE2-CB 3.89Å; F906-F924 HydrophobicContact CG-CB 3.43Å; F906-F924 VanDerWaalsContact CG-CB 3.43Å; F906-F924 AromaticContact CG-CD1 3.94Å; F906-F924 HydrophobicContact CG-CD1 3.94Å; F906-F924 AromaticContact CG-CG 3.8Å; F906-F924 HydrophobicContact CG-CG 3.8Å; F906-F924 HydrophobicContact CZ-CB 4.17Å; F906-F924 HydrophobicContact CZ-CD1 4.45Å; F906-M928 HydrophobicContact CB-CE 4.25Å
907	D	98.7	Very high	98.5	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-62.8	-44.3	173.4	-62.6	-20.7	0	0	0	110.3	L903 C904 V909 I910 E911 M928 Y945 G946	L903-D907 PolarHBondContact O-N 3.3Å; C904-D907 WeakPolarHBondContact O-CB 3.21Å; C904-D907 PolarHBondContact O-N 3.49Å; C904-D907 VanDerWaalsContact O-N 3.09Å; D907-V909 VanDerWaalsContact C-N 3.32Å; D907-V909 PolarHBondContact O-N 3.34Å; D907-I910 CarbonylContact O-C 3.54Å; D907-I910 WeakPolarHBondContact O-CA 3.15Å; D907-I910 WeakPolarHBondContact O-CB 3.48Å; D907-I910 PolarHBondContact O-N 2.76Å; D907-E911 PolarHBondContact O-N 2.58Å; D907-M928 WeakPolarHBondContact OD1-CE 3.5Å; D907-Y945 HydrophobicContact CB-CD1 3.76Å; D907-Y945 HydrophobicContact CB-CE1 4.1Å; D907-G946 WeakPolarHBondContact OD1-CA 3.16Å; D907-G946 PolarHBondContact OD1-N 2.92Å
908	D	98.6	Very high	98.5	Very high	13 Å²	13	19.1 Å²	19.1	7%	0.07	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-38.2	174.9	-68.7	-38.6	0	0	0	112.6	H865 F868 C904 F906 I910 E911 H912	H865-D908 WeakPolarHBondContact CB-OD2 3.48Å; H865-D908 IonicContact CE1-OD1 2.73Å; H865-D908 IonicContact CG-OD1 2.86Å; H865-D908 IonicContact CG-OD2 2.65Å; H865-D908 VanDerWaalsContact ND1-CG 3.34Å; H865-D908 IonicContact ND1-OD1 3.85Å; H865-D908 PolarHBondContact ND1-OD1 3.09Å; H865-D908 IonicContact ND1-OD2 3.88Å; F868-D908 HydrophobicContact CB-CB 4.44Å; F868-D908 HydrophobicContact CD2-CB 3.61Å; F868-D908 HydrophobicContact CE2-CB 4.32Å; F868-D908 HydrophobicContact CG-CB 4.43Å; C904-D908 PolarHBondContact O-N 3.25Å; C904-D908 VanDerWaalsContact O-N 3.07Å; F906-D908 VanDerWaalsContact C-N 3.35Å; D908-I910 VanDerWaalsContact C-N 3.29Å; D908-I910 PolarHBondContact O-N 3.05Å; D908-E911 PolarHBondContact O-N 3.11Å; D908-H912 WeakPolarHBondContact O-CB 3.47Å; D908-H912 PolarHBondContact O-CD2 2.96Å; D908-H912 PolarHBondContact O-N 3.4Å; D908-H912 IonicContact OD1-NE2 3.1Å
909	V	98.7	Very high	98.5	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-61.6	-40	173.2	169.7	0	0	0	0	110.6	F868 L876 F879 I905 F906 D907 C913 S917	F868-V909 HydrophobicContact CD2-CG2 4.37Å; F868-V909 HydrophobicContact CE1-CG2 4.04Å; F868-V909 HydrophobicContact CE2-CG2 3.77Å; F868-V909 HydrophobicContact CZ-CG2 3.6Å; L876-V909 HydrophobicContact CD2-CG1 4Å; F879-V909 HydrophobicContact CD1-CG2 4.46Å; F879-V909 HydrophobicContact CE1-CG2 4.05Å; F879-V909 HydrophobicContact CZ-CG2 4.45Å; I905-V909 WeakPolarHBondContact O-CG2 3.37Å; I905-V909 PolarHBondContact O-N 3.01Å; F906-V909 WeakPolarHBondContact O-CB 3.22Å; F906-V909 PolarHBondContact O-N 2.84Å; D907-V909 VanDerWaalsContact C-N 3.32Å; D907-V909 PolarHBondContact O-N 3.34Å; V909-C913 CarbonylContact O-C 3.58Å; V909-C913 WeakPolarHBondContact O-CA 3.22Å; V909-C913 WeakPolarHBondContact O-CB 3.46Å; V909-C913 PolarHBondContact O-N 3.25Å; V909-C913 VanDerWaalsContact O-N 3.12Å; V909-S917 WeakPolarHBondContact O-CB 3.42Å
910	I	98.7	Very high	98.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-71.3	-46.6	176.9	-62.9	163.1	0	0	0	110.6	F906 D907 D908 S914 F924 M928 V949 M950	F906-I910 VanDerWaalsContact O-CG1 3.29Å; F906-I910 WeakPolarHBondContact O-CG1 3.03Å; F906-I910 PolarHBondContact O-N 3.08Å; D907-I910 CarbonylContact O-C 3.54Å; D907-I910 WeakPolarHBondContact O-CA 3.15Å; D907-I910 WeakPolarHBondContact O-CB 3.48Å; D907-I910 PolarHBondContact O-N 2.76Å; D908-I910 VanDerWaalsContact C-N 3.29Å; D908-I910 PolarHBondContact O-N 3.05Å; I910-S914 WeakPolarHBondContact O-CB 3.36Å; I910-S914 PolarHBondContact O-OG 3.09Å; I910-F924 HydrophobicContact CD1-CD2 4.03Å; I910-F924 HydrophobicContact CD1-CE2 3.54Å; I910-F924 HydrophobicContact CD1-CZ 4.33Å; I910-F924 HydrophobicContact CG1-CD2 4.48Å; I910-F924 HydrophobicContact CG1-CE2 3.63Å; I910-F924 HydrophobicContact CG1-CZ 3.91Å; I910-M928 HydrophobicContact CD1-CE 3.68Å; I910-M928 HydrophobicContact CD1-SD 3.81Å; I910-V949 HydrophobicContact CB-CG2 4.17Å; I910-V949 HydrophobicContact CG2-CG2 3.95Å; I910-M950 HydrophobicContact CD1-CE 4.35Å; I910-M950 HydrophobicContact CG2-CB 4.06Å
911	E	98.5	Very high	98.4	Very high	34 Å²	34	25.3 Å²	25.3	16%	0.159	13%	0.127	C	C	.	.	H	α-helix	trans	-67.4	-48.8	-174.7	179	157.2	-160.6	0	0	112.4	D907 D908 Y945 V949 Y953	D907-E911 PolarHBondContact O-N 2.58Å; D908-E911 PolarHBondContact O-N 3.11Å; E911-Y945 PolarHBondContact OE2-OH 3.26Å; E911-V949 HydrophobicContact CB-CB 4.16Å; E911-V949 HydrophobicContact CB-CG1 4.31Å; E911-V949 HydrophobicContact CB-CG2 4.38Å; E911-V949 HydrophobicContact CG-CG1 4.5Å; E911-Y953 HydrophobicContact CB-CD2 4.27Å; E911-Y953 HydrophobicContact CB-CE2 4.5Å; E911-Y953 HydrophobicContact CG-CD2 3.75Å; E911-Y953 HydrophobicContact CG-CE2 3.58Å; E911-Y953 VanDerWaalsContact OE1-CE2 3.23Å; E911-Y953 WeakPolarHBondContact OE1-CE2 3.32Å; E911-Y953 PolarHBondContact OE1-OH 3.36Å
912	H	98.4	Very high	98.3	Very high	40 Å²	40	30.1 Å²	30.1	19%	0.185	15%	0.151	C	C	.	.	H	α-helix	trans	-98.5	-21.1	-169.8	-55	-61.2	0	0	0	113.7	H865 F868 S869 K872 D908	H865-H912 AromaticContact CE1-NE2 3.42Å; H865-H912 PolarHBondContact CE1-NE2 3.24Å; H865-H912 AromaticContact ND1-NE2 3.83Å; F868-H912 HydrophobicContact CB-CB 4.09Å; F868-H912 WeakPolarHBondContact O-CB 3.4Å; S869-H912 PolarHBondContact OG-CD2 3.01Å; S869-H912 PolarHBondContact OG-CE1 2.95Å; S869-H912 VanDerWaalsContact OG-CE1 3.23Å; S869-H912 PolarHBondContact OG-NE2 3.16Å; S869-H912 VanDerWaalsContact OG-NE2 3.13Å; K872-H912 WeakPolarHBondContact CA-O 3.21Å; K872-H912 VanDerWaalsContact CB-O 3.24Å; K872-H912 WeakPolarHBondContact CB-O 3.31Å; D908-H912 WeakPolarHBondContact O-CB 3.47Å; D908-H912 PolarHBondContact O-CD2 2.96Å; D908-H912 PolarHBondContact O-N 3.4Å; D908-H912 IonicContact OD1-NE2 3.1Å
913	C	98.4	Very high	98.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-116	17.1	-174.3	-47.5	0	0	0	0	113.9	K872 E873 L876 V909 A916 S917	K872-C913 VanDerWaalsContact C-SG 3.53Å; K872-C913 PolarHBondContact O-SG 2.97Å; E873-C913 WeakPolarHBondContact CG-O 3.48Å; L876-C913 HydrophobicContact CD1-CB 3.89Å; L876-C913 HydrophobicContact CD2-CB 3.73Å; L876-C913 HydrophobicContact CG-CB 3.93Å; V909-C913 CarbonylContact O-C 3.58Å; V909-C913 WeakPolarHBondContact O-CA 3.22Å; V909-C913 WeakPolarHBondContact O-CB 3.46Å; V909-C913 PolarHBondContact O-N 3.25Å; V909-C913 VanDerWaalsContact O-N 3.12Å; C913-A916 PolarHBondContact O-N 3.37Å; C913-S917 PolarHBondContact O-N 3.05Å
914	S	97.7	Very high	98.3	Very high	17 Å²	17	34.3 Å²	34.3	12%	0.119	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	146.6	170.9	-72.6	0	0	0	0	112.5	I910 S917 Y953 G954	I910-S914 WeakPolarHBondContact O-CB 3.36Å; I910-S914 PolarHBondContact O-OG 3.09Å; S914-S917 PolarHBondContact OG-OG 3.26Å; S914-Y953 WeakPolarHBondContact CB-O 3.38Å; S914-G954 WeakPolarHBondContact OG-CA 3.27Å
915	P	97.9	Very high	98.3	Very high	71 Å²	71	33.3 Å²	33.3	46%	0.461	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.3	-2.2	10.8	35	-36.5	0	0	0	115	S917 F918	P915-S917 PolarHBondContact O-N 3Å; P915-F918 PolarHBondContact O-N 2.7Å
916	A	98.4	Very high	98.2	Very high	12 Å²	12	38.5 Å²	38.5	10%	0.099	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-64.1	-27.1	-178.7	0	0	0	0	0	113.5	E873 L876 C913 F918 K919	E873-A916 HydrophobicContact CB-CB 4.16Å; E873-A916 HydrophobicContact CG-CB 3.97Å; E873-A916 WeakPolarHBondContact OE2-CB 3.4Å; L876-A916 HydrophobicContact CD1-CB 3.65Å; C913-A916 PolarHBondContact O-N 3.37Å; A916-F918 PolarHBondContact O-N 3.47Å; A916-K919 WeakPolarHBondContact O-CB 3.48Å; A916-K919 WeakPolarHBondContact O-CG 3.16Å; A916-K919 PolarHBondContact O-N 3.02Å
917	S	98.3	Very high	98.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-44.2	-35.4	171.4	63	0	0	0	0	113.8	V909 C913 S914 P915 K919 Y920 A921 Y958	V909-S917 WeakPolarHBondContact O-CB 3.42Å; C913-S917 PolarHBondContact O-N 3.05Å; S914-S917 PolarHBondContact OG-OG 3.26Å; P915-S917 PolarHBondContact O-N 3Å; S917-K919 PolarHBondContact O-N 3.37Å; S917-K919 VanDerWaalsContact O-N 3.13Å; S917-Y920 PolarHBondContact O-N 3.47Å; S917-A921 PolarHBondContact O-N 2.98Å; S917-Y958 PolarHBondContact OG-OH 2.76Å
918	F	98.3	Very high	98.2	Very high	63 Å²	63	39.5 Å²	39.5	28%	0.276	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-62.7	-23.5	-178.5	-168.2	-95.8	0	0	0	113.4	P915 A916 Y920 A921 L925 N957 Y958 F961	P915-F918 PolarHBondContact O-N 2.7Å; A916-F918 PolarHBondContact O-N 3.47Å; F918-Y920 PolarHBondContact O-N 2.81Å; F918-A921 HydrophobicContact CD2-CB 4.03Å; F918-A921 HydrophobicContact CE2-CB 4.24Å; F918-A921 HydrophobicContact CG-CB 4.38Å; F918-A921 VanDerWaalsContact O-CB 3.24Å; F918-A921 WeakPolarHBondContact O-CB 3.23Å; F918-A921 PolarHBondContact O-N 3.36Å; F918-A921 VanDerWaalsContact O-N 3.13Å; F918-L925 HydrophobicContact CE2-CD2 4.38Å; F918-N957 HydrophobicContact CB-CB 4.26Å; F918-N957 HydrophobicContact CD1-CB 3.71Å; F918-N957 HydrophobicContact CD2-CB 3.51Å; F918-N957 HydrophobicContact CE1-CB 3.86Å; F918-N957 HydrophobicContact CE2-CB 3.68Å; F918-N957 WeakPolarHBondContact CE2-O 3.19Å; F918-N957 HydrophobicContact CG-CB 3.54Å; F918-N957 HydrophobicContact CZ-CB 3.85Å; F918-Y958 WeakPolarHBondContact CA-OH 3.42Å; F918-Y958 HydrophobicContact CB-CE2 3.91Å; F918-Y958 AromaticContact CD2-CD1 3.95Å; F918-Y958 HydrophobicContact CD2-CD1 3.95Å; F918-Y958 AromaticContact CD2-CD2 3.92Å; F918-Y958 HydrophobicContact CD2-CD2 3.92Å; F918-Y958 AromaticContact CD2-CE1 3.72Å; F918-Y958 HydrophobicContact CD2-CE1 3.72Å; F918-Y958 AromaticContact CD2-CE2 3.68Å; F918-Y958 HydrophobicContact CD2-CE2 3.68Å; F918-Y958 HydrophobicContact CD2-CG 4.08Å; F918-Y958 AromaticContact CD2-CZ 3.59Å; F918-Y958 HydrophobicContact CE2-CD1 4.19Å; F918-Y958 HydrophobicContact CE2-CE1 4.25Å; F918-Y958 HydrophobicContact CE2-CG 4.45Å; F918-Y958 HydrophobicContact CG-CE2 4.29Å; F918-Y958 PolarHBondContact N-OH 3.24Å; F918-F961 HydrophobicContact CE2-CE2 4.1Å; F918-F961 HydrophobicContact CZ-CE2 4.35Å
919	K	98.1	Very high	98.2	Very high	157 Å²	157	39.1 Å²	39.1	68%	0.683	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-58.6	-30.9	172.3	-66	176.1	-175.3	172.7	0	112.1	A916 S917	A916-K919 WeakPolarHBondContact O-CB 3.48Å; A916-K919 WeakPolarHBondContact O-CG 3.16Å; A916-K919 PolarHBondContact O-N 3.02Å; S917-K919 PolarHBondContact O-N 3.37Å; S917-K919 VanDerWaalsContact O-N 3.13Å
920	Y	98.2	Very high	98.2	Very high	25 Å²	25	45 Å²	45	10%	0.098	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-101.6	7.6	-178.6	-53.5	-82.3	0	0	0	112.1	L876 E880 L883 S917 F918 E922 Y923 F924	L876-Y920 HydrophobicContact CB-CE2 3.88Å; L876-Y920 HydrophobicContact CD1-CD2 4.38Å; L876-Y920 HydrophobicContact CD1-CE2 3.91Å; L876-Y920 HydrophobicContact CD2-CE2 4.4Å; L876-Y920 HydrophobicContact CG-CE2 4.29Å; E880-Y920 HydrophobicContact CG-CE1 3.82Å; E880-Y920 PolarHBondContact OE1-OH 3.01Å; L883-Y920 HydrophobicContact CD2-CD1 3.84Å; L883-Y920 HydrophobicContact CD2-CE1 4.31Å; S917-Y920 PolarHBondContact O-N 3.47Å; F918-Y920 PolarHBondContact O-N 2.81Å; Y920-E922 PolarHBondContact O-N 3.44Å; Y920-Y923 HydrophobicContact CD1-CD2 4.32Å; Y920-Y923 HydrophobicContact CD1-CE2 4.15Å; Y920-Y923 WeakPolarHBondContact O-CB 3.49Å; Y920-Y923 WeakPolarHBondContact O-CD2 3.44Å; Y920-Y923 PolarHBondContact O-N 3.06Å; Y920-F924 VanDerWaalsContact C-CE1 3.44Å; Y920-F924 WeakPolarHBondContact O-CD1 3.47Å; Y920-F924 WeakPolarHBondContact O-CE1 3.38Å
921	A	97.4	Very high	98.2	Very high	9 Å²	9	45.9 Å²	45.9	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-59.1	-24.1	-179.4	0	0	0	0	0	113.3	S917 F918 Y923 F924 L925 Y958	S917-A921 PolarHBondContact O-N 2.98Å; F918-A921 HydrophobicContact CD2-CB 4.03Å; F918-A921 HydrophobicContact CE2-CB 4.24Å; F918-A921 HydrophobicContact CG-CB 4.38Å; F918-A921 VanDerWaalsContact O-CB 3.24Å; F918-A921 WeakPolarHBondContact O-CB 3.23Å; F918-A921 PolarHBondContact O-N 3.36Å; F918-A921 VanDerWaalsContact O-N 3.13Å; A921-Y923 PolarHBondContact O-N 3.24Å; A921-F924 HydrophobicContact CB-CZ 4.4Å; A921-F924 PolarHBondContact O-N 3.25Å; A921-L925 HydrophobicContact CB-CB 3.97Å; A921-L925 HydrophobicContact CB-CD2 3.94Å; A921-L925 WeakPolarHBondContact O-CB 3.46Å; A921-L925 PolarHBondContact O-N 2.68Å; A921-Y958 HydrophobicContact CB-CE1 4.47Å
922	E	97.4	Very high	98.2	Very high	157 Å²	157	44.3 Å²	44.3	73%	0.734	21%	0.209	S	C	*	.	H	α-helix	trans	-60.1	-24.8	175	68.5	-178.3	150.2	0	0	113.5	Y920	Y920-E922 PolarHBondContact O-N 3.44Å
923	Y	98.1	Very high	98.2	Very high	88 Å²	88	44.9 Å²	44.9	35%	0.345	22%	0.217	S	C	.	.	H	α-helix	trans	-83.3	-39.4	-178.5	-64.7	-75.2	0	0	0	112.8	L883 V887 I890 Y920 A921	L883-Y923 HydrophobicContact CD1-CG 4.5Å; L883-Y923 HydrophobicContact CD2-CD1 4.39Å; L883-Y923 HydrophobicContact CD2-CD2 3.82Å; L883-Y923 HydrophobicContact CD2-CE1 4.12Å; L883-Y923 HydrophobicContact CD2-CE2 3.56Å; L883-Y923 HydrophobicContact CD2-CG 4.23Å; L883-Y923 HydrophobicContact CG-CD1 4.47Å; L883-Y923 HydrophobicContact CG-CD2 4.47Å; L883-Y923 HydrophobicContact CG-CE1 4.5Å; L883-Y923 HydrophobicContact CG-CG 4.42Å; V887-Y923 HydrophobicContact CG2-CD1 3.61Å; V887-Y923 HydrophobicContact CG2-CG 4.02Å; I890-Y923 VanDerWaalsContact CD1-O 3.3Å; I890-Y923 WeakPolarHBondContact CD1-O 3.42Å; Y920-Y923 HydrophobicContact CD1-CD2 4.32Å; Y920-Y923 HydrophobicContact CD1-CE2 4.15Å; Y920-Y923 WeakPolarHBondContact O-CB 3.49Å; Y920-Y923 WeakPolarHBondContact O-CD2 3.44Å; Y920-Y923 PolarHBondContact O-N 3.06Å; A921-Y923 PolarHBondContact O-N 3.24Å
924	F	98.3	Very high	98.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-123.7	-28.2	-167.5	62.3	-98.6	0	0	0	115.6	I890 F906 I910 Y920 A921 R926 P927 M928 Y958	I890-F924 HydrophobicContact CD1-CB 4.42Å; F906-F924 HydrophobicContact CB-CB 3.9Å; F906-F924 HydrophobicContact CB-CD1 4.43Å; F906-F924 HydrophobicContact CB-CD2 4.45Å; F906-F924 HydrophobicContact CB-CG 4.03Å; F906-F924 HydrophobicContact CD1-CB 3.73Å; F906-F924 AromaticContact CD1-CD1 3.35Å; F906-F924 HydrophobicContact CD1-CD1 3.35Å; F906-F924 HydrophobicContact CD1-CE1 4.11Å; F906-F924 AromaticContact CD1-CG 3.73Å; F906-F924 HydrophobicContact CD1-CG 3.73Å; F906-F924 HydrophobicContact CD2-CB 3.51Å; F906-F924 HydrophobicContact CD2-CG 4.37Å; F906-F924 HydrophobicContact CE1-CB 4.1Å; F906-F924 AromaticContact CE1-CD1 3.66Å; F906-F924 HydrophobicContact CE1-CD1 3.66Å; F906-F924 HydrophobicContact CE1-CG 4.27Å; F906-F924 HydrophobicContact CE2-CB 3.89Å; F906-F924 HydrophobicContact CG-CB 3.43Å; F906-F924 VanDerWaalsContact CG-CB 3.43Å; F906-F924 AromaticContact CG-CD1 3.94Å; F906-F924 HydrophobicContact CG-CD1 3.94Å; F906-F924 AromaticContact CG-CG 3.8Å; F906-F924 HydrophobicContact CG-CG 3.8Å; F906-F924 HydrophobicContact CZ-CB 4.17Å; F906-F924 HydrophobicContact CZ-CD1 4.45Å; I910-F924 HydrophobicContact CD1-CD2 4.03Å; I910-F924 HydrophobicContact CD1-CE2 3.54Å; I910-F924 HydrophobicContact CD1-CZ 4.33Å; I910-F924 HydrophobicContact CG1-CD2 4.48Å; I910-F924 HydrophobicContact CG1-CE2 3.63Å; I910-F924 HydrophobicContact CG1-CZ 3.91Å; Y920-F924 VanDerWaalsContact C-CE1 3.44Å; Y920-F924 WeakPolarHBondContact O-CD1 3.47Å; Y920-F924 WeakPolarHBondContact O-CE1 3.38Å; A921-F924 HydrophobicContact CB-CZ 4.4Å; A921-F924 PolarHBondContact O-N 3.25Å; F924-R926 PolarHBondContact O-N 3.18Å; F924-P927 WeakPolarHBondContact O-CD 3.29Å; F924-M928 HydrophobicContact CD2-CE 4.23Å; F924-M928 VanDerWaalsContact O-CB 3.23Å; F924-M928 WeakPolarHBondContact O-CB 3.44Å; F924-M928 PolarHBondContact O-N 3.08Å; F924-Y958 HydrophobicContact CE2-CE1 4.48Å; F924-Y958 WeakPolarHBondContact CZ-OH 3.49Å
925	L	98	Very high	98.1	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-45	-166.5	175.7	57.6	0	0	0	112.7	F918 A921 L929 M950 Y958 F961	F918-L925 HydrophobicContact CE2-CD2 4.38Å; A921-L925 HydrophobicContact CB-CB 3.97Å; A921-L925 HydrophobicContact CB-CD2 3.94Å; A921-L925 WeakPolarHBondContact O-CB 3.46Å; A921-L925 PolarHBondContact O-N 2.68Å; L925-L929 HydrophobicContact CD1-CD1 4.29Å; L925-L929 HydrophobicContact CG-CD1 4.44Å; L925-L929 WeakPolarHBondContact O-CG 3.38Å; L925-L929 PolarHBondContact O-N 2.77Å; L925-L929 VanDerWaalsContact O-N 3.14Å; L925-M950 HydrophobicContact CD1-CE 3.26Å; L925-M950 HydrophobicContact CD1-SD 3.78Å; L925-Y958 HydrophobicContact CD1-CD1 4.01Å; L925-Y958 HydrophobicContact CD1-CE1 3.97Å; L925-Y958 HydrophobicContact CD2-CD1 4.15Å; L925-Y958 HydrophobicContact CD2-CE1 4.06Å; L925-F961 HydrophobicContact CD1-CB 4.22Å; L925-F961 HydrophobicContact CD1-CG 4.24Å; L925-F961 HydrophobicContact CD2-CD1 3.95Å; L925-F961 HydrophobicContact CD2-CD2 3.63Å; L925-F961 HydrophobicContact CD2-CE1 3.91Å; L925-F961 HydrophobicContact CD2-CE2 3.59Å; L925-F961 HydrophobicContact CD2-CG 3.78Å; L925-F961 HydrophobicContact CD2-CZ 3.72Å; L925-F961 HydrophobicContact CG-CD1 4.29Å; L925-F961 HydrophobicContact CG-CG 4.3Å
926	R	98.3	Very high	98.2	Very high	108 Å²	108	50.1 Å²	50.1	41%	0.408	24%	0.241	S	C	.	.	H	α-helix	trans	-70.7	-46.4	-179.7	-177.9	58.9	58.8	-175.4	-4.2	111.9	F924 L929 Q930 E964	F924-R926 PolarHBondContact O-N 3.18Å; R926-L929 PolarHBondContact O-N 2.9Å; R926-Q930 WeakPolarHBondContact O-CG 3.3Å; R926-Q930 PolarHBondContact O-N 3.39Å; R926-E964 IonicContact CZ-OE1 3.27Å; R926-E964 IonicContact CZ-OE2 3.8Å; R926-E964 IonicContact NH1-OE1 2.87Å; R926-E964 PolarHBondContact NH1-OE1 3.07Å; R926-E964 IonicContact NH1-OE2 2.92Å; R926-E964 PolarHBondContact NH1-OE2 3.05Å; R926-E964 IonicContact NH2-OE1 2.72Å; R926-E964 IonicContact NH2-OE2 2.96Å; R926-E964 PolarHBondContact NH2-OE2 3.47Å
927	P	98.3	Very high	98.1	Very high	27 Å²	27	50.7 Å²	50.7	18%	0.175	24%	0.243	C	C	.	.	H	α-helix	trans	-54.3	-47.3	170	-28.6	34.9	0	0	0	113.5	I890 F924 L929 Q930 Y931	I890-P927 HydrophobicContact CD1-CB 4.18Å; I890-P927 HydrophobicContact CD1-CG 4.17Å; F924-P927 WeakPolarHBondContact O-CD 3.29Å; P927-L929 PolarHBondContact O-N 2.91Å; P927-Q930 CarbonylContact O-C 3.46Å; P927-Q930 WeakPolarHBondContact O-CA 3.14Å; P927-Q930 WeakPolarHBondContact O-CB 3.21Å; P927-Q930 PolarHBondContact O-N 3.47Å; P927-Y931 HydrophobicContact CB-CD2 4.01Å; P927-Y931 HydrophobicContact CB-CE2 3.72Å; P927-Y931 WeakPolarHBondContact O-CD2 3.34Å; P927-Y931 PolarHBondContact O-N 3.1Å
928	M	98.6	Very high	98.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-43.9	179.8	-176	-179.8	-75.2	0	0	112.7	L903 F906 D907 I910 F924 Q930 Y931 V932 A943 L947 M950	L903-M928 HydrophobicContact CD2-CB 4Å; L903-M928 HydrophobicContact CD2-CE 4.12Å; L903-M928 HydrophobicContact CD2-CG 4.23Å; F906-M928 HydrophobicContact CB-CE 4.25Å; D907-M928 WeakPolarHBondContact OD1-CE 3.5Å; I910-M928 HydrophobicContact CD1-CE 3.68Å; I910-M928 HydrophobicContact CD1-SD 3.81Å; F924-M928 HydrophobicContact CD2-CE 4.23Å; F924-M928 VanDerWaalsContact O-CB 3.23Å; F924-M928 WeakPolarHBondContact O-CB 3.44Å; F924-M928 PolarHBondContact O-N 3.08Å; M928-Q930 PolarHBondContact O-N 2.81Å; M928-Y931 PolarHBondContact O-N 3.23Å; M928-V932 PolarHBondContact O-N 2.82Å; M928-A943 HydrophobicContact CG-CB 4.44Å; M928-L947 HydrophobicContact CG-CD2 4.39Å; M928-L947 HydrophobicContact CG-CG 4.32Å; M928-M950 HydrophobicContact SD-CE 3.98Å
929	L	98.6	Very high	98.2	Very high	5 Å²	5	50.7 Å²	50.7	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-30.6	172.8	-77.3	164.2	0	0	0	113.3	L925 R926 P927 V932 L947 F961 A965 L968	L925-L929 HydrophobicContact CD1-CD1 4.29Å; L925-L929 HydrophobicContact CG-CD1 4.44Å; L925-L929 WeakPolarHBondContact O-CG 3.38Å; L925-L929 PolarHBondContact O-N 2.77Å; L925-L929 VanDerWaalsContact O-N 3.14Å; R926-L929 PolarHBondContact O-N 2.9Å; P927-L929 PolarHBondContact O-N 2.91Å; L929-V932 WeakPolarHBondContact O-CG1 3.41Å; L929-L947 HydrophobicContact CD2-CD1 4.43Å; L929-L947 HydrophobicContact CD2-CD2 3.63Å; L929-L947 HydrophobicContact CG-CD2 4.07Å; L929-F961 HydrophobicContact CD1-CB 4.28Å; L929-F961 HydrophobicContact CD1-CD1 3.85Å; L929-F961 HydrophobicContact CD1-CG 4.48Å; L929-A965 HydrophobicContact CD2-CB 3.8Å; L929-L968 HydrophobicContact CD2-CD1 4.49Å; L929-L968 WeakPolarHBondContact O-CD1 3.38Å
930	Q	98.3	Very high	98.2	Very high	124 Å²	124	44.6 Å²	44.6	58%	0.579	22%	0.217	S	C	*	.	H	α-helix	trans	-78.5	-41.1	177	-67.9	168.2	-8	0	0	111.3	R926 P927 M928 V932 C933	R926-Q930 WeakPolarHBondContact O-CG 3.3Å; R926-Q930 PolarHBondContact O-N 3.39Å; P927-Q930 CarbonylContact O-C 3.46Å; P927-Q930 WeakPolarHBondContact O-CA 3.14Å; P927-Q930 WeakPolarHBondContact O-CB 3.21Å; P927-Q930 PolarHBondContact O-N 3.47Å; M928-Q930 PolarHBondContact O-N 2.81Å; Q930-V932 VanDerWaalsContact C-N 3.29Å; Q930-V932 PolarHBondContact O-N 3.19Å; Q930-C933 PolarHBondContact O-N 3.45Å
931	Y	98.6	Very high	98.2	Very high	19 Å²	19	46.1 Å²	46.1	8%	0.075	23%	0.225	C	C	.	.	H	α-helix	trans	-72.3	-14.9	-174.3	-72.6	-43.6	0	0	0	114.9	I890 P892 L903 P927 M928 C933 D934 V939	I890-Y931 HydrophobicContact CB-CE2 4.28Å; I890-Y931 WeakPolarHBondContact O-CE2 3.48Å; I890-Y931 PolarHBondContact O-OH 2.87Å; P892-Y931 WeakPolarHBondContact CA-OH 3.28Å; L903-Y931 HydrophobicContact CD1-CD2 3.88Å; L903-Y931 HydrophobicContact CD1-CG 4.16Å; L903-Y931 HydrophobicContact CD2-CD2 4.13Å; L903-Y931 HydrophobicContact CG-CD2 4.32Å; P927-Y931 HydrophobicContact CB-CD2 4.01Å; P927-Y931 HydrophobicContact CB-CE2 3.72Å; P927-Y931 WeakPolarHBondContact O-CD2 3.34Å; P927-Y931 PolarHBondContact O-N 3.1Å; M928-Y931 PolarHBondContact O-N 3.23Å; Y931-C933 PolarHBondContact O-N 3.26Å; Y931-D934 HydrophobicContact CD1-CB 4.37Å; Y931-D934 VanDerWaalsContact O-CB 3.24Å; Y931-D934 WeakPolarHBondContact O-CB 3.49Å; Y931-D934 PolarHBondContact O-N 3.34Å; Y931-V939 HydrophobicContact CD1-CG1 4.08Å; Y931-V939 HydrophobicContact CG-CG1 4.04Å
932	V	98.5	Very high	98.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.1	169.1	77	0	0	0	0	112.6	M928 L929 Q930 R940 A943 A944 L947 L968 L969 V972	M928-V932 PolarHBondContact O-N 2.82Å; L929-V932 WeakPolarHBondContact O-CG1 3.41Å; Q930-V932 VanDerWaalsContact C-N 3.29Å; Q930-V932 PolarHBondContact O-N 3.19Å; V932-R940 WeakPolarHBondContact O-CG 3.48Å; V932-A943 HydrophobicContact CB-CB 4.26Å; V932-A944 HydrophobicContact CG2-CB 4.38Å; V932-L947 HydrophobicContact CB-CD1 4.03Å; V932-L947 HydrophobicContact CG1-CD1 4.44Å; V932-L947 HydrophobicContact CG2-CD1 4.06Å; V932-L968 HydrophobicContact CG1-CB 3.61Å; V932-L968 HydrophobicContact CG1-CD1 4.14Å; V932-L968 HydrophobicContact CG1-CG 4.48Å; V932-L969 HydrophobicContact CG2-CD2 3.55Å; V932-L969 HydrophobicContact CG2-CG 4.23Å; V932-V972 WeakPolarHBondContact O-CG2 3.43Å
933	C	97.9	Very high	98.3	Very high	53 Å²	53	38.5 Å²	38.5	36%	0.358	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	20.9	174.4	-66.3	0	0	0	0	113.2	Q930 Y931	Q930-C933 PolarHBondContact O-N 3.45Å; Y931-C933 PolarHBondContact O-N 3.26Å
934	D	98.5	Very high	98.4	Very high	29 Å²	29	34.3 Å²	34.3	16%	0.155	17%	0.172	C	C	.	.			trans	-63.9	162	176.5	-162.6	-79	0	0	0	111.7	R899 Y931 S936 V939 R940	R899-D934 IonicContact CZ-OD2 2.72Å; R899-D934 IonicContact NE-OD2 2.83Å; R899-D934 PolarHBondContact NE-OD2 3.05Å; R899-D934 IonicContact NH2-OD1 3.36Å; R899-D934 PolarHBondContact NH2-OD1 3.45Å; R899-D934 IonicContact NH2-OD2 3.9Å; R899-D934 PolarHBondContact NH2-OD2 3.42Å; R899-D934 VanDerWaalsContact NH2-OD2 3.13Å; Y931-D934 HydrophobicContact CD1-CB 4.37Å; Y931-D934 VanDerWaalsContact O-CB 3.24Å; Y931-D934 WeakPolarHBondContact O-CB 3.49Å; Y931-D934 PolarHBondContact O-N 3.34Å; D934-S936 PolarHBondContact OD1-N 2.86Å; D934-V939 HydrophobicContact CB-CB 3.99Å; D934-V939 HydrophobicContact CB-CG1 3.56Å; D934-R940 HydrophobicContact CB-CG 4.23Å; D934-R940 WeakPolarHBondContact O-CD 3.48Å; D934-R940 VanDerWaalsContact O-CG 3.29Å; D934-R940 WeakPolarHBondContact O-CG 3.49Å; D934-R940 PolarHBondContact O-NE 2.97Å; D934-R940 VanDerWaalsContact O-NE 3.16Å
935	N	97.3	Very high	98.4	Very high	155 Å²	155	37.4 Å²	37.4	83%	0.829	19%	0.185	S	C	*	.	S	Bend	trans	-75.3	-34.4	177.8	-64.2	-35.1	0	0	0	111.6
936	S	98.1	Very high	98.4	Very high	14 Å²	14	37 Å²	37	10%	0.098	18%	0.183	C	C	.	.	S	Bend	trans	-73.5	129.2	177.3	153.1	0	0	0	0	110	D934 E938 V939 R940	D934-S936 PolarHBondContact OD1-N 2.86Å; S936-E938 VanDerWaalsContact C-N 3.29Å; S936-E938 PolarHBondContact OG-N 2.91Å; S936-E938 PolarHBondContact OG-OE2 3.47Å; S936-V939 PolarHBondContact OG-N 2.88Å; S936-V939 VanDerWaalsContact OG-N 3.16Å; S936-R940 WeakPolarHBondContact O-CG 3.31Å; S936-R940 PolarHBondContact O-N 3.14Å; S936-R940 VanDerWaalsContact O-N 3.16Å; S936-R940 PolarHBondContact O-NE 3.38Å
937	P	98.1	Very high	98.4	Very high	23 Å²	23	32 Å²	32	15%	0.149	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-37.4	173	22.7	-28.9	0	0	0	112.2	R940 Q941 E982 A986	P937-R940 WeakPolarHBondContact O-CB 3.19Å; P937-R940 PolarHBondContact O-N 2.83Å; P937-Q941 WeakPolarHBondContact O-CB 3.35Å; P937-Q941 PolarHBondContact O-N 2.87Å; P937-E982 VanDerWaalsContact CB-O 3.29Å; P937-E982 WeakPolarHBondContact CB-O 3.42Å; P937-E982 WeakPolarHBondContact CG-O 3.36Å; P937-A986 HydrophobicContact CB-CB 4.22Å; P937-A986 VanDerWaalsContact O-CB 3.22Å; P937-A986 WeakPolarHBondContact O-CB 3.4Å
938	E	98.3	Very high	98.4	Very high	63 Å²	63	30.7 Å²	30.7	29%	0.294	16%	0.155	S	C	.	.	H	α-helix	trans	-65	-42.9	-179.2	-56	80.4	-171.7	0	0	111.8	W896 Q900 S936 R940 Q941 A942	W896-E938 HydrophobicContact CE3-CB 4.04Å; W896-E938 HydrophobicContact CE3-CG 4.27Å; W896-E938 HydrophobicContact CH2-CG 4.24Å; W896-E938 HydrophobicContact CZ3-CB 3.72Å; W896-E938 HydrophobicContact CZ3-CG 3.58Å; Q900-E938 HydrophobicContact CG-CB 4.08Å; S936-E938 VanDerWaalsContact C-N 3.29Å; S936-E938 PolarHBondContact OG-N 2.91Å; S936-E938 PolarHBondContact OG-OE2 3.47Å; E938-R940 VanDerWaalsContact C-N 3.35Å; E938-Q941 WeakPolarHBondContact O-CB 3.26Å; E938-Q941 PolarHBondContact O-N 3.24Å; E938-A942 PolarHBondContact O-N 2.77Å; E938-A942 VanDerWaalsContact O-N 3.09Å
939	V	98.7	Very high	98.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.5	-40.4	174	176.1	0	0	0	0	111.1	W896 R899 Q900 L903 Y931 D934 S936 Q941 A943	W896-V939 HydrophobicContact CB-CG2 4.13Å; W896-V939 WeakPolarHBondContact O-CG2 3.36Å; R899-V939 HydrophobicContact CB-CG1 4.39Å; R899-V939 HydrophobicContact CB-CG2 3.96Å; Q900-V939 HydrophobicContact CB-CG2 4.22Å; L903-V939 HydrophobicContact CD1-CG1 3.93Å; Y931-V939 HydrophobicContact CD1-CG1 4.08Å; Y931-V939 HydrophobicContact CG-CG1 4.04Å; D934-V939 HydrophobicContact CB-CB 3.99Å; D934-V939 HydrophobicContact CB-CG1 3.56Å; S936-V939 PolarHBondContact OG-N 2.88Å; S936-V939 VanDerWaalsContact OG-N 3.16Å; V939-Q941 VanDerWaalsContact C-N 3.34Å; V939-A943 WeakPolarHBondContact O-CB 3.2Å; V939-A943 PolarHBondContact O-N 2.88Å
940	R	98.7	Very high	98.4	Very high	30 Å²	30	30.5 Å²	30.5	11%	0.113	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-39.7	175.1	-75.2	-174.8	-77.5	156.9	-1.7	112	V932 D934 S936 P937 E938 A944 N983 A986	V932-R940 WeakPolarHBondContact O-CG 3.48Å; D934-R940 HydrophobicContact CB-CG 4.23Å; D934-R940 WeakPolarHBondContact O-CD 3.48Å; D934-R940 VanDerWaalsContact O-CG 3.29Å; D934-R940 WeakPolarHBondContact O-CG 3.49Å; D934-R940 PolarHBondContact O-NE 2.97Å; D934-R940 VanDerWaalsContact O-NE 3.16Å; S936-R940 WeakPolarHBondContact O-CG 3.31Å; S936-R940 PolarHBondContact O-N 3.14Å; S936-R940 VanDerWaalsContact O-N 3.16Å; S936-R940 PolarHBondContact O-NE 3.38Å; P937-R940 WeakPolarHBondContact O-CB 3.19Å; P937-R940 PolarHBondContact O-N 2.83Å; E938-R940 VanDerWaalsContact C-N 3.35Å; R940-A944 WeakPolarHBondContact O-CB 3.37Å; R940-A944 PolarHBondContact O-N 3.24Å; R940-N983 PolarHBondContact NH2-OD1 3.46Å; R940-A986 HydrophobicContact CB-CB 4.13Å
941	Q	98.7	Very high	98.4	Very high	56 Å²	56	24.6 Å²	24.6	26%	0.262	13%	0.127	S	C	.	.	H	α-helix	trans	-61.2	-53.3	178.5	-175.2	175.7	-12	0	0	110.8	P937 E938 V939 A943 A944 Y945 A986 N989	P937-Q941 WeakPolarHBondContact O-CB 3.35Å; P937-Q941 PolarHBondContact O-N 2.87Å; E938-Q941 WeakPolarHBondContact O-CB 3.26Å; E938-Q941 PolarHBondContact O-N 3.24Å; V939-Q941 VanDerWaalsContact C-N 3.34Å; Q941-A943 PolarHBondContact O-N 2.84Å; Q941-A944 PolarHBondContact O-N 2.8Å; Q941-Y945 WeakPolarHBondContact O-CB 3.49Å; Q941-Y945 PolarHBondContact O-N 3.22Å; Q941-A986 HydrophobicContact CB-CB 4.01Å; Q941-N989 HydrophobicContact CG-CB 4.11Å; Q941-N989 PolarHBondContact NE2-ND2 3.4Å
942	A	98.5	Very high	98.4	Very high	7 Å²	7	25.4 Å²	25.4	6%	0.058	13%	0.131	C	C	.	.	H	α-helix	trans	-58.1	-50.4	176.9	0	0	0	0	0	111.2	L903 E938 A944 Y945 G946	L903-A942 HydrophobicContact CB-CB 3.72Å; L903-A942 HydrophobicContact CD1-CB 4.31Å; E938-A942 PolarHBondContact O-N 2.77Å; E938-A942 VanDerWaalsContact O-N 3.09Å; A942-A944 VanDerWaalsContact C-N 3.31Å; A942-A944 PolarHBondContact O-N 3.34Å; A942-Y945 WeakPolarHBondContact O-CB 3.43Å; A942-Y945 PolarHBondContact O-N 2.67Å; A942-Y945 VanDerWaalsContact O-N 3.15Å; A942-G946 PolarHBondContact O-N 3.48Å
943	A	98.8	Very high	98.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.4	-40.8	177.9	0	0	0	0	0	113.4	L903 M928 V932 V939 Q941 L947	L903-A943 HydrophobicContact CD1-CB 4.1Å; M928-A943 HydrophobicContact CG-CB 4.44Å; V932-A943 HydrophobicContact CB-CB 4.26Å; V939-A943 WeakPolarHBondContact O-CB 3.2Å; V939-A943 PolarHBondContact O-N 2.88Å; Q941-A943 PolarHBondContact O-N 2.84Å; A943-L947 VanDerWaalsContact O-CG 3.23Å; A943-L947 WeakPolarHBondContact O-CG 3.41Å; A943-L947 PolarHBondContact O-N 3.03Å; A943-L947 VanDerWaalsContact O-N 3.16Å
944	A	98.8	Very high	98.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.8	-42.6	177.5	0	0	0	0	0	111.9	V932 R940 Q941 A942 L947 G948 L969 N989 C990 A993	V932-A944 HydrophobicContact CG2-CB 4.38Å; R940-A944 WeakPolarHBondContact O-CB 3.37Å; R940-A944 PolarHBondContact O-N 3.24Å; Q941-A944 PolarHBondContact O-N 2.8Å; A942-A944 VanDerWaalsContact C-N 3.31Å; A942-A944 PolarHBondContact O-N 3.34Å; A944-L947 PolarHBondContact O-N 3.1Å; A944-G948 PolarHBondContact O-N 3.48Å; A944-L969 HydrophobicContact CB-CD2 3.94Å; A944-N989 HydrophobicContact CB-CB 4.19Å; A944-C990 HydrophobicContact CB-CB 4.39Å; A944-C990 WeakPolarHBondContact CB-SG 3.41Å; A944-A993 VanDerWaalsContact O-CB 3.26Å; A944-A993 WeakPolarHBondContact O-CB 3.4Å
945	Y	98.8	Very high	98.1	Very high	65 Å²	65	27.2 Å²	27.2	26%	0.255	14%	0.136	S	C	.	.	H	α-helix	trans	-57.7	-52.1	175.7	-176.2	-94.8	0	0	0	111	D907 E911 Q941 A942 L947 G948 V949 E1026	D907-Y945 HydrophobicContact CB-CD1 3.76Å; D907-Y945 HydrophobicContact CB-CE1 4.1Å; E911-Y945 PolarHBondContact OE2-OH 3.26Å; Q941-Y945 WeakPolarHBondContact O-CB 3.49Å; Q941-Y945 PolarHBondContact O-N 3.22Å; A942-Y945 WeakPolarHBondContact O-CB 3.43Å; A942-Y945 PolarHBondContact O-N 2.67Å; A942-Y945 VanDerWaalsContact O-N 3.15Å; Y945-L947 VanDerWaalsContact C-N 3.32Å; Y945-L947 PolarHBondContact O-N 3.09Å; Y945-G948 CarbonylContact O-C 3.49Å; Y945-G948 VanDerWaalsContact O-CA 3.32Å; Y945-G948 WeakPolarHBondContact O-CA 3.39Å; Y945-G948 PolarHBondContact O-N 3.14Å; Y945-V949 HydrophobicContact CD1-CG1 4.19Å; Y945-V949 HydrophobicContact CD1-CG2 4.44Å; Y945-V949 HydrophobicContact CE1-CG1 3.7Å; Y945-V949 HydrophobicContact CE1-CG2 4.4Å; Y945-V949 HydrophobicContact CE2-CG1 4.36Å; Y945-V949 PolarHBondContact O-N 3.33Å; Y945-E1026 WeakPolarHBondContact CE2-OE1 3.5Å
946	G	98.4	Very high	98.1	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-50.4	-45.8	173.9	0	0	0	0	0	114.3	D907 A942 G948 V949 M950	D907-G946 WeakPolarHBondContact OD1-CA 3.16Å; D907-G946 PolarHBondContact OD1-N 2.92Å; A942-G946 PolarHBondContact O-N 3.48Å; G946-G948 VanDerWaalsContact C-N 3.31Å; G946-G948 PolarHBondContact O-N 3.14Å; G946-V949 VanDerWaalsContact O-CG2 3.31Å; G946-V949 WeakPolarHBondContact O-CG2 3.49Å; G946-M950 WeakPolarHBondContact O-CB 3.34Å; G946-M950 PolarHBondContact O-N 3.41Å
947	L	98.7	Very high	98.1	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-67.3	-31.7	176.1	-65.8	171.9	0	0	0	112.7	M928 L929 V932 A943 A944 Y945 M950 A951 A965 L969	M928-L947 HydrophobicContact CG-CD2 4.39Å; M928-L947 HydrophobicContact CG-CG 4.32Å; L929-L947 HydrophobicContact CD2-CD1 4.43Å; L929-L947 HydrophobicContact CD2-CD2 3.63Å; L929-L947 HydrophobicContact CG-CD2 4.07Å; V932-L947 HydrophobicContact CB-CD1 4.03Å; V932-L947 HydrophobicContact CG1-CD1 4.44Å; V932-L947 HydrophobicContact CG2-CD1 4.06Å; A943-L947 VanDerWaalsContact O-CG 3.23Å; A943-L947 WeakPolarHBondContact O-CG 3.41Å; A943-L947 PolarHBondContact O-N 3.03Å; A943-L947 VanDerWaalsContact O-N 3.16Å; A944-L947 PolarHBondContact O-N 3.1Å; Y945-L947 VanDerWaalsContact C-N 3.32Å; Y945-L947 PolarHBondContact O-N 3.09Å; L947-M950 HydrophobicContact CD2-CE 3.75Å; L947-M950 HydrophobicContact CD2-SD 4.21Å; L947-A951 PolarHBondContact O-N 3.35Å; L947-A965 HydrophobicContact CD1-CB 4.08Å; L947-A965 HydrophobicContact CD2-CB 4.04Å; L947-A965 HydrophobicContact CG-CB 4.46Å; L947-L969 HydrophobicContact CD1-CD2 4.36Å; L947-L969 HydrophobicContact CD1-CG 4.48Å
948	G	98.4	Very high	98.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.9	-53.6	172.9	0	0	0	0	0	112.5	A944 Y945 G946 M950 A951 Q952	A944-G948 PolarHBondContact O-N 3.48Å; Y945-G948 CarbonylContact O-C 3.49Å; Y945-G948 VanDerWaalsContact O-CA 3.32Å; Y945-G948 WeakPolarHBondContact O-CA 3.39Å; Y945-G948 PolarHBondContact O-N 3.14Å; G946-G948 VanDerWaalsContact C-N 3.31Å; G946-G948 PolarHBondContact O-N 3.14Å; G948-M950 VanDerWaalsContact C-N 3.26Å; G948-M950 PolarHBondContact O-N 2.88Å; G948-A951 WeakPolarHBondContact O-CB 3.3Å; G948-A951 PolarHBondContact O-N 3.09Å; G948-A951 VanDerWaalsContact O-N 3.12Å; G948-Q952 PolarHBondContact O-N 2.83Å; G948-Q952 VanDerWaalsContact O-N 3.16Å
949	V	98.4	Very high	98	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67	-28.6	179.4	-63.4	0	0	0	0	112.1	I910 E911 Y945 G946 A951 Q952 Y953	I910-V949 HydrophobicContact CB-CG2 4.17Å; I910-V949 HydrophobicContact CG2-CG2 3.95Å; E911-V949 HydrophobicContact CB-CB 4.16Å; E911-V949 HydrophobicContact CB-CG1 4.31Å; E911-V949 HydrophobicContact CB-CG2 4.38Å; E911-V949 HydrophobicContact CG-CG1 4.5Å; Y945-V949 HydrophobicContact CD1-CG1 4.19Å; Y945-V949 HydrophobicContact CD1-CG2 4.44Å; Y945-V949 HydrophobicContact CE1-CG1 3.7Å; Y945-V949 HydrophobicContact CE1-CG2 4.4Å; Y945-V949 HydrophobicContact CE2-CG1 4.36Å; Y945-V949 PolarHBondContact O-N 3.33Å; G946-V949 VanDerWaalsContact O-CG2 3.31Å; G946-V949 WeakPolarHBondContact O-CG2 3.49Å; V949-A951 VanDerWaalsContact C-N 3.34Å; V949-A951 PolarHBondContact O-N 3.17Å; V949-Q952 PolarHBondContact O-N 3.48Å; V949-Y953 HydrophobicContact CB-CD2 3.95Å; V949-Y953 HydrophobicContact CB-CE2 4.36Å; V949-Y953 HydrophobicContact CG1-CD2 4.32Å; V949-Y953 HydrophobicContact CG1-CE2 4.22Å; V949-Y953 PolarHBondContact O-N 2.94Å
950	M	98.3	Very high	98	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-59.2	-42.2	169.8	179.6	-171.5	-53.5	0	0	112.7	I910 L925 M928 G946 L947 G948 G954 Y958 F961	I910-M950 HydrophobicContact CD1-CE 4.35Å; I910-M950 HydrophobicContact CG2-CB 4.06Å; L925-M950 HydrophobicContact CD1-CE 3.26Å; L925-M950 HydrophobicContact CD1-SD 3.78Å; M928-M950 HydrophobicContact SD-CE 3.98Å; G946-M950 WeakPolarHBondContact O-CB 3.34Å; G946-M950 PolarHBondContact O-N 3.41Å; L947-M950 HydrophobicContact CD2-CE 3.75Å; L947-M950 HydrophobicContact CD2-SD 4.21Å; G948-M950 VanDerWaalsContact C-N 3.26Å; G948-M950 PolarHBondContact O-N 2.88Å; M950-G954 VanDerWaalsContact O-CA 3.32Å; M950-G954 WeakPolarHBondContact O-CA 3.37Å; M950-G954 PolarHBondContact O-N 3.5Å; M950-G954 VanDerWaalsContact O-N 3.09Å; M950-Y958 HydrophobicContact CE-CD1 3.99Å; M950-Y958 HydrophobicContact CE-CE1 4.1Å; M950-Y958 VanDerWaalsContact CG-CB 3.47Å; M950-Y958 HydrophobicContact CG-CD1 3.35Å; M950-Y958 HydrophobicContact CG-CD2 4.09Å; M950-Y958 HydrophobicContact CG-CE1 3.99Å; M950-Y958 HydrophobicContact CG-CG 3.38Å; M950-Y958 HydrophobicContact SD-CD1 3.37Å; M950-Y958 WeakPolarHBondContact SD-CD1 3.33Å; M950-Y958 HydrophobicContact SD-CE1 4.09Å; M950-Y958 HydrophobicContact SD-CG 3.94Å; M950-F961 HydrophobicContact SD-CB 4.32Å
951	A	98.1	Very high	98	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-70	-37.6	176	0	0	0	0	0	111.9	L947 G948 V949 I997 F1000 K1001	L947-A951 PolarHBondContact O-N 3.35Å; G948-A951 WeakPolarHBondContact O-CB 3.3Å; G948-A951 PolarHBondContact O-N 3.09Å; G948-A951 VanDerWaalsContact O-N 3.12Å; V949-A951 VanDerWaalsContact C-N 3.34Å; V949-A951 PolarHBondContact O-N 3.17Å; A951-I997 HydrophobicContact CB-CB 4.39Å; A951-I997 HydrophobicContact CB-CG1 3.72Å; A951-F1000 WeakPolarHBondContact O-CB 3.44Å; A951-K1001 HydrophobicContact CB-CG 4.14Å; A951-K1001 WeakPolarHBondContact O-CE 3.41Å; A951-K1001 PolarHBondContact O-NZ 3.15Å
952	Q	98.1	Very high	97.9	Very high	36 Å²	36	30.3 Å²	30.3	17%	0.168	15%	0.153	C	C	.	.	H	α-helix	trans	-75.7	-49.6	-176.2	-176.5	164.8	-16.4	0	0	113	G948 V949 F1000	G948-Q952 PolarHBondContact O-N 2.83Å; G948-Q952 VanDerWaalsContact O-N 3.16Å; V949-Q952 PolarHBondContact O-N 3.48Å; Q952-F1000 HydrophobicContact CB-CD2 3.77Å; Q952-F1000 HydrophobicContact CB-CE2 3.92Å; Q952-F1000 HydrophobicContact CB-CG 4.27Å; Q952-F1000 HydrophobicContact CG-CD1 4.44Å; Q952-F1000 HydrophobicContact CG-CD2 3.85Å; Q952-F1000 HydrophobicContact CG-CE1 4.15Å; Q952-F1000 HydrophobicContact CG-CE2 3.53Å; Q952-F1000 HydrophobicContact CG-CG 4.3Å; Q952-F1000 HydrophobicContact CG-CZ 3.69Å
953	Y	97.9	Very high	97.9	Very high	95 Å²	95	33.4 Å²	33.4	37%	0.373	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-23.9	-169.5	-53.3	-72.5	0	0	0	114.2	E911 S914 V949 G955	E911-Y953 HydrophobicContact CB-CD2 4.27Å; E911-Y953 HydrophobicContact CB-CE2 4.5Å; E911-Y953 HydrophobicContact CG-CD2 3.75Å; E911-Y953 HydrophobicContact CG-CE2 3.58Å; E911-Y953 VanDerWaalsContact OE1-CE2 3.23Å; E911-Y953 WeakPolarHBondContact OE1-CE2 3.32Å; E911-Y953 PolarHBondContact OE1-OH 3.36Å; S914-Y953 WeakPolarHBondContact CB-O 3.38Å; V949-Y953 HydrophobicContact CB-CD2 3.95Å; V949-Y953 HydrophobicContact CB-CE2 4.36Å; V949-Y953 HydrophobicContact CG1-CD2 4.32Å; V949-Y953 HydrophobicContact CG1-CE2 4.22Å; V949-Y953 PolarHBondContact O-N 2.94Å; Y953-G955 VanDerWaalsContact C-N 3.26Å; Y953-G955 PolarHBondContact O-N 3.47Å; Y953-G955 VanDerWaalsContact O-N 3.09Å
954	G	96.1	Very high	97.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-59.4	-25	-170.7	0	0	0	0	0	116.9	S914 M950 Y958	S914-G954 WeakPolarHBondContact OG-CA 3.27Å; M950-G954 VanDerWaalsContact O-CA 3.32Å; M950-G954 WeakPolarHBondContact O-CA 3.37Å; M950-G954 PolarHBondContact O-N 3.5Å; M950-G954 VanDerWaalsContact O-N 3.09Å; G954-Y958 VanDerWaalsContact O-CD2 3.3Å; G954-Y958 WeakPolarHBondContact O-CD2 3.36Å
955	G	95.1	Very high	97.8	Very high	24 Å²	24	37 Å²	37	25%	0.247	19%	0.189	C	C	.	.			trans	82.7	-171.4	-176	0	0	0	0	0	114.3	Y953 N957 Y958	Y953-G955 VanDerWaalsContact C-N 3.26Å; Y953-G955 PolarHBondContact O-N 3.47Å; Y953-G955 VanDerWaalsContact O-N 3.09Å; G955-N957 VanDerWaalsContact C-N 3.33Å; G955-N957 PolarHBondContact O-N 3.24Å; G955-Y958 PolarHBondContact O-N 3.44Å
956	D	97.2	Very high	97.8	Very high	109 Å²	109	35.1 Å²	35.1	58%	0.583	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-70.3	-24.4	-168.1	-76.2	-42	0	0	0	114.6	Y958 R959	D956-Y958 PolarHBondContact O-N 2.85Å; D956-R959 WeakPolarHBondContact O-CB 3.41Å; D956-R959 WeakPolarHBondContact O-CD 3.19Å; D956-R959 WeakPolarHBondContact O-CG 3.32Å; D956-R959 PolarHBondContact O-N 3.19Å; D956-R959 WeakPolarHBondContact OD1-CD 3.34Å; D956-R959 IonicContact OD1-CZ 2.75Å; D956-R959 IonicContact OD1-NH1 2.64Å; D956-R959 PolarHBondContact OD1-NH1 3.27Å
957	N	97.6	Very high	97.7	Very high	90 Å²	90	38.6 Å²	38.6	48%	0.481	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-63.1	-26	-178.3	-67.7	-35.9	0	0	0	112.7	F918 G955	F918-N957 HydrophobicContact CB-CB 4.26Å; F918-N957 HydrophobicContact CD1-CB 3.71Å; F918-N957 HydrophobicContact CD2-CB 3.51Å; F918-N957 HydrophobicContact CE1-CB 3.86Å; F918-N957 HydrophobicContact CE2-CB 3.68Å; F918-N957 WeakPolarHBondContact CE2-O 3.19Å; F918-N957 HydrophobicContact CG-CB 3.54Å; F918-N957 HydrophobicContact CZ-CB 3.85Å; G955-N957 VanDerWaalsContact C-N 3.33Å; G955-N957 PolarHBondContact O-N 3.24Å
958	Y	98.1	Very high	97.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-85.6	-6.9	-179.9	-70.5	-80.8	0	0	0	114.5	S917 F918 A921 F924 L925 M950 G954 G955 D956 P960 F961 C962	S917-Y958 PolarHBondContact OG-OH 2.76Å; F918-Y958 WeakPolarHBondContact CA-OH 3.42Å; F918-Y958 HydrophobicContact CB-CE2 3.91Å; F918-Y958 AromaticContact CD2-CD1 3.95Å; F918-Y958 HydrophobicContact CD2-CD1 3.95Å; F918-Y958 AromaticContact CD2-CD2 3.92Å; F918-Y958 HydrophobicContact CD2-CD2 3.92Å; F918-Y958 AromaticContact CD2-CE1 3.72Å; F918-Y958 HydrophobicContact CD2-CE1 3.72Å; F918-Y958 AromaticContact CD2-CE2 3.68Å; F918-Y958 HydrophobicContact CD2-CE2 3.68Å; F918-Y958 HydrophobicContact CD2-CG 4.08Å; F918-Y958 AromaticContact CD2-CZ 3.59Å; F918-Y958 HydrophobicContact CE2-CD1 4.19Å; F918-Y958 HydrophobicContact CE2-CE1 4.25Å; F918-Y958 HydrophobicContact CE2-CG 4.45Å; F918-Y958 HydrophobicContact CG-CE2 4.29Å; F918-Y958 PolarHBondContact N-OH 3.24Å; A921-Y958 HydrophobicContact CB-CE1 4.47Å; F924-Y958 HydrophobicContact CE2-CE1 4.48Å; F924-Y958 WeakPolarHBondContact CZ-OH 3.49Å; L925-Y958 HydrophobicContact CD1-CD1 4.01Å; L925-Y958 HydrophobicContact CD1-CE1 3.97Å; L925-Y958 HydrophobicContact CD2-CD1 4.15Å; L925-Y958 HydrophobicContact CD2-CE1 4.06Å; M950-Y958 HydrophobicContact CE-CD1 3.99Å; M950-Y958 HydrophobicContact CE-CE1 4.1Å; M950-Y958 VanDerWaalsContact CG-CB 3.47Å; M950-Y958 HydrophobicContact CG-CD1 3.35Å; M950-Y958 HydrophobicContact CG-CD2 4.09Å; M950-Y958 HydrophobicContact CG-CE1 3.99Å; M950-Y958 HydrophobicContact CG-CG 3.38Å; M950-Y958 HydrophobicContact SD-CD1 3.37Å; M950-Y958 WeakPolarHBondContact SD-CD1 3.33Å; M950-Y958 HydrophobicContact SD-CE1 4.09Å; M950-Y958 HydrophobicContact SD-CG 3.94Å; G954-Y958 VanDerWaalsContact O-CD2 3.3Å; G954-Y958 WeakPolarHBondContact O-CD2 3.36Å; G955-Y958 PolarHBondContact O-N 3.44Å; D956-Y958 PolarHBondContact O-N 2.85Å; Y958-P960 VanDerWaalsContact C-CD 3.41Å; Y958-F961 WeakPolarHBondContact O-CA 3.44Å; Y958-F961 WeakPolarHBondContact O-CB 3.41Å; Y958-F961 PolarHBondContact O-N 3.42Å; Y958-C962 PolarHBondContact O-N 3.48Å
959	R	97.1	Very high	97.7	Very high	82 Å²	82	39.9 Å²	39.9	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-49.5	-45.1	-176.8	-71.8	170.5	85.8	138.1	1.9	115	D956 F961 C962 T963 K1001 D1003	D956-R959 WeakPolarHBondContact O-CB 3.41Å; D956-R959 WeakPolarHBondContact O-CD 3.19Å; D956-R959 WeakPolarHBondContact O-CG 3.32Å; D956-R959 PolarHBondContact O-N 3.19Å; D956-R959 WeakPolarHBondContact OD1-CD 3.34Å; D956-R959 IonicContact OD1-CZ 2.75Å; D956-R959 IonicContact OD1-NH1 2.64Å; D956-R959 PolarHBondContact OD1-NH1 3.27Å; R959-F961 PolarHBondContact O-N 3.04Å; R959-C962 PolarHBondContact O-N 2.68Å; R959-T963 PolarHBondContact O-N 2.89Å; R959-T963 PolarHBondContact O-OG1 2.94Å; R959-T963 VanDerWaalsContact O-OG1 3.07Å; R959-K1001 HydrophobicContact CG-CD 4.09Å; R959-D1003 IonicContact CZ-OD2 2.77Å; R959-D1003 IonicContact NH2-OD2 3.45Å; R959-D1003 PolarHBondContact NH2-OD2 3.32Å
960	P	97.9	Very high	97.7	Very high	82 Å²	82	41.2 Å²	41.2	53%	0.532	22%	0.22	S	C	.	.	H	α-helix	trans	-60.9	-35.2	178.5	-21.8	34.6	0	0	0	112.2	Y958 T963 E964	Y958-P960 VanDerWaalsContact C-CD 3.41Å; P960-T963 WeakPolarHBondContact O-CB 3.44Å; P960-T963 PolarHBondContact O-N 3.42Å; P960-E964 PolarHBondContact O-N 3.14Å; P960-E964 VanDerWaalsContact O-N 3.15Å
961	F	98.1	Very high	97.7	Very high	42 Å²	42	48.2 Å²	48.2	18%	0.184	25%	0.246	C	C	.	.	H	α-helix	trans	-81.3	-31.6	-176.8	-53.2	-77	0	0	0	112	F918 L925 L929 M950 Y958 R959 T963 E964 A965	F918-F961 HydrophobicContact CE2-CE2 4.1Å; F918-F961 HydrophobicContact CZ-CE2 4.35Å; L925-F961 HydrophobicContact CD1-CB 4.22Å; L925-F961 HydrophobicContact CD1-CG 4.24Å; L925-F961 HydrophobicContact CD2-CD1 3.95Å; L925-F961 HydrophobicContact CD2-CD2 3.63Å; L925-F961 HydrophobicContact CD2-CE1 3.91Å; L925-F961 HydrophobicContact CD2-CE2 3.59Å; L925-F961 HydrophobicContact CD2-CG 3.78Å; L925-F961 HydrophobicContact CD2-CZ 3.72Å; L925-F961 HydrophobicContact CG-CD1 4.29Å; L925-F961 HydrophobicContact CG-CG 4.3Å; L929-F961 HydrophobicContact CD1-CB 4.28Å; L929-F961 HydrophobicContact CD1-CD1 3.85Å; L929-F961 HydrophobicContact CD1-CG 4.48Å; M950-F961 HydrophobicContact SD-CB 4.32Å; Y958-F961 WeakPolarHBondContact O-CA 3.44Å; Y958-F961 WeakPolarHBondContact O-CB 3.41Å; Y958-F961 PolarHBondContact O-N 3.42Å; R959-F961 PolarHBondContact O-N 3.04Å; F961-T963 PolarHBondContact O-N 3.06Å; F961-E964 PolarHBondContact O-N 3.21Å; F961-E964 VanDerWaalsContact O-N 3.17Å; F961-A965 VanDerWaalsContact O-CB 3.23Å; F961-A965 WeakPolarHBondContact O-CB 3.47Å; F961-A965 PolarHBondContact O-N 3.18Å
962	C	97.8	Very high	97.7	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-36.1	168	-61	0	0	0	0	111.6	Y958 R959 L966 I997 C1004	Y958-C962 PolarHBondContact O-N 3.48Å; R959-C962 PolarHBondContact O-N 2.68Å; C962-L966 PolarHBondContact O-N 3.06Å; C962-I997 HydrophobicContact CB-CG1 4.48Å; C962-C1004 HydrophobicContact CB-CB 4.42Å
963	T	97.6	Very high	97.7	Very high	72 Å²	72	47.2 Å²	47.2	44%	0.442	24%	0.242	S	C	.	.	H	α-helix	trans	-66.1	-41.9	174.2	-49.3	0	0	0	0	111.1	R959 P960 F961 C1004	R959-T963 PolarHBondContact O-N 2.89Å; R959-T963 PolarHBondContact O-OG1 2.94Å; R959-T963 VanDerWaalsContact O-OG1 3.07Å; P960-T963 WeakPolarHBondContact O-CB 3.44Å; P960-T963 PolarHBondContact O-N 3.42Å; F961-T963 PolarHBondContact O-N 3.06Å; T963-C1004 WeakPolarHBondContact OG1-CB 3.35Å; T963-C1004 PolarHBondContact OG1-O 3.44Å
964	E	98	Very high	97.7	Very high	76 Å²	76	48.2 Å²	48.2	36%	0.355	25%	0.251	S	S	.	.	H	α-helix	trans	-69.1	-37.4	178.2	-171.9	178.3	177.6	0	0	112.9	R926 P960 F961 P967	R926-E964 IonicContact CZ-OE1 3.27Å; R926-E964 IonicContact CZ-OE2 3.8Å; R926-E964 IonicContact NH1-OE1 2.87Å; R926-E964 PolarHBondContact NH1-OE1 3.07Å; R926-E964 IonicContact NH1-OE2 2.92Å; R926-E964 PolarHBondContact NH1-OE2 3.05Å; R926-E964 IonicContact NH2-OE1 2.72Å; R926-E964 IonicContact NH2-OE2 2.96Å; R926-E964 PolarHBondContact NH2-OE2 3.47Å; P960-E964 PolarHBondContact O-N 3.14Å; P960-E964 VanDerWaalsContact O-N 3.15Å; F961-E964 PolarHBondContact O-N 3.21Å; F961-E964 VanDerWaalsContact O-N 3.17Å; E964-P967 VanDerWaalsContact O-CD 3.31Å; E964-P967 WeakPolarHBondContact O-CD 3.24Å; E964-P967 WeakPolarHBondContact O-CG 3.38Å
965	A	98.3	Very high	97.7	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-37.9	-175.3	0	0	0	0	0	113.4	L929 L947 F961 L968 L969 I997	L929-A965 HydrophobicContact CD2-CB 3.8Å; L947-A965 HydrophobicContact CD1-CB 4.08Å; L947-A965 HydrophobicContact CD2-CB 4.04Å; L947-A965 HydrophobicContact CG-CB 4.46Å; F961-A965 VanDerWaalsContact O-CB 3.23Å; F961-A965 WeakPolarHBondContact O-CB 3.47Å; F961-A965 PolarHBondContact O-N 3.18Å; A965-L968 WeakPolarHBondContact O-CB 3.33Å; A965-L968 PolarHBondContact O-N 3.03Å; A965-L969 HydrophobicContact CB-CD1 4.4Å; A965-L969 PolarHBondContact O-N 3.07Å; A965-I997 HydrophobicContact CB-CD1 4.39Å
966	L	97.8	Very high	97.7	Very high	24 Å²	24	53.8 Å²	53.8	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-50	-55.7	-174.7	-179.9	74.2	0	0	0	113.8	C962 L968 L969 V970 V994 V1005 V1010	C962-L966 PolarHBondContact O-N 3.06Å; L966-L968 PolarHBondContact O-N 3.37Å; L966-L969 PolarHBondContact O-N 2.98Å; L966-V970 HydrophobicContact CD1-CG2 4.38Å; L966-V970 VanDerWaalsContact O-CG2 3.3Å; L966-V970 WeakPolarHBondContact O-CG2 3.22Å; L966-V970 PolarHBondContact O-N 3.43Å; L966-V994 HydrophobicContact CD1-CB 4.47Å; L966-V994 HydrophobicContact CD1-CG1 3.8Å; L966-V994 HydrophobicContact CD1-CG2 4.15Å; L966-V1005 HydrophobicContact CD1-CG2 4.39Å; L966-V1005 HydrophobicContact CD2-CB 3.95Å; L966-V1005 HydrophobicContact CD2-CG2 3.32Å; L966-V1005 HydrophobicContact CG-CG2 4.48Å; L966-V1010 HydrophobicContact CD2-CG2 4.21Å
967	P	97.9	Very high	97.6	Very high	73 Å²	73	54.1 Å²	54.1	47%	0.474	29%	0.292	S	S	.	.	H	α-helix	trans	-65.2	-23.4	179.9	26.2	-36.7	0	0	0	113.9	E964 R971	E964-P967 VanDerWaalsContact O-CD 3.31Å; E964-P967 WeakPolarHBondContact O-CD 3.24Å; E964-P967 WeakPolarHBondContact O-CG 3.38Å; P967-R971 WeakPolarHBondContact O-CB 3.37Å; P967-R971 PolarHBondContact O-N 3.39Å
968	L	98.5	Very high	97.5	Very high	30 Å²	30	50.7 Å²	50.7	16%	0.157	28%	0.275	C	S	.	.	H	α-helix	trans	-73.1	-47.1	175.9	-57.1	176.3	0	0	0	110.5	L929 V932 A965 L966 R971 V972	L929-L968 HydrophobicContact CD2-CD1 4.49Å; L929-L968 WeakPolarHBondContact O-CD1 3.38Å; V932-L968 HydrophobicContact CG1-CB 3.61Å; V932-L968 HydrophobicContact CG1-CD1 4.14Å; V932-L968 HydrophobicContact CG1-CG 4.48Å; A965-L968 WeakPolarHBondContact O-CB 3.33Å; A965-L968 PolarHBondContact O-N 3.03Å; L966-L968 PolarHBondContact O-N 3.37Å; L968-R971 WeakPolarHBondContact O-CB 3.36Å; L968-R971 PolarHBondContact O-N 3.45Å; L968-V972 PolarHBondContact O-N 2.98Å
969	L	98.7	Very high	97.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.1	-48.8	175.1	-68.4	162.6	0	0	0	111.2	V932 A944 L947 A965 L966 R971 V972 I973 C990 A993 V994 I997	V932-L969 HydrophobicContact CG2-CD2 3.55Å; V932-L969 HydrophobicContact CG2-CG 4.23Å; A944-L969 HydrophobicContact CB-CD2 3.94Å; L947-L969 HydrophobicContact CD1-CD2 4.36Å; L947-L969 HydrophobicContact CD1-CG 4.48Å; A965-L969 HydrophobicContact CB-CD1 4.4Å; A965-L969 PolarHBondContact O-N 3.07Å; L966-L969 PolarHBondContact O-N 2.98Å; L969-R971 PolarHBondContact O-N 3.48Å; L969-V972 PolarHBondContact O-N 3.22Å; L969-V972 VanDerWaalsContact O-N 3.1Å; L969-I973 VanDerWaalsContact O-CG1 3.28Å; L969-I973 WeakPolarHBondContact O-CG1 3.4Å; L969-I973 PolarHBondContact O-N 2.88Å; L969-I973 VanDerWaalsContact O-N 3.09Å; L969-C990 HydrophobicContact CD2-CB 4Å; L969-A993 HydrophobicContact CD1-CB 3.93Å; L969-A993 HydrophobicContact CD2-CB 4.02Å; L969-V994 HydrophobicContact CB-CG2 3.67Å; L969-V994 HydrophobicContact CD1-CG2 4.07Å; L969-V994 HydrophobicContact CG-CG2 4.48Å; L969-I997 HydrophobicContact CD1-CD1 3.74Å
970	V	98.3	Very high	97.2	Very high	27 Å²	27	53.6 Å²	53.6	16%	0.164	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-36.9	179	175	0	0	0	0	111.8	L966 V972 I973 Q974 V994 W1017	L966-V970 HydrophobicContact CD1-CG2 4.38Å; L966-V970 VanDerWaalsContact O-CG2 3.3Å; L966-V970 WeakPolarHBondContact O-CG2 3.22Å; L966-V970 PolarHBondContact O-N 3.43Å; V970-V972 PolarHBondContact O-N 3.24Å; V970-I973 PolarHBondContact O-N 3Å; V970-Q974 HydrophobicContact CG1-CG 4.16Å; V970-Q974 WeakPolarHBondContact O-CB 3.47Å; V970-Q974 VanDerWaalsContact O-CG 3.32Å; V970-Q974 WeakPolarHBondContact O-CG 3.46Å; V970-Q974 PolarHBondContact O-N 3.4Å; V970-V994 HydrophobicContact CG2-CG2 4.37Å; V970-W1017 HydrophobicContact CB-CH2 4.48Å; V970-W1017 HydrophobicContact CG1-CH2 4.18Å; V970-W1017 HydrophobicContact CG1-CZ2 4.27Å; V970-W1017 HydrophobicContact CG2-CH2 3.89Å
971	R	98.1	Very high	96.9	Very high	148 Å²	148	58.5 Å²	58.5	56%	0.558	31%	0.306	S	S	*	.	H	α-helix	trans	-61.7	-42.6	177.1	-175.2	-171.5	-60	144.2	3.9	112.1	P967 L968 L969 S975	P967-R971 WeakPolarHBondContact O-CB 3.37Å; P967-R971 PolarHBondContact O-N 3.39Å; L968-R971 WeakPolarHBondContact O-CB 3.36Å; L968-R971 PolarHBondContact O-N 3.45Å; L969-R971 PolarHBondContact O-N 3.48Å; R971-S975 PolarHBondContact O-N 2.8Å; R971-S975 VanDerWaalsContact O-N 3.13Å
972	V	98.2	Very high	96.7	Very high	9 Å²	9	62.7 Å²	62.7	6%	0.055	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-46.6	179	179.8	0	0	0	0	110.1	V932 L968 L969 V970 Q974 S975	V932-V972 WeakPolarHBondContact O-CG2 3.43Å; L968-V972 PolarHBondContact O-N 2.98Å; L969-V972 PolarHBondContact O-N 3.22Å; L969-V972 VanDerWaalsContact O-N 3.1Å; V970-V972 PolarHBondContact O-N 3.24Å; V972-Q974 VanDerWaalsContact C-N 3.29Å; V972-Q974 PolarHBondContact O-N 3.11Å; V972-S975 VanDerWaalsContact O-CB 3.26Å; V972-S975 WeakPolarHBondContact O-CB 3.49Å; V972-S975 PolarHBondContact O-N 2.95Å; V972-S975 VanDerWaalsContact O-N 3.13Å
973	I	98.4	Very high	96.6	Very high	7 Å²	7	64.1 Å²	64.1	4%	0.036	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-41.4	-179.1	-59.6	163.6	0	0	0	111.4	L969 V970 S975 S978 T987 C990 I991 V994 W1017	L969-I973 VanDerWaalsContact O-CG1 3.28Å; L969-I973 WeakPolarHBondContact O-CG1 3.4Å; L969-I973 PolarHBondContact O-N 2.88Å; L969-I973 VanDerWaalsContact O-N 3.09Å; V970-I973 PolarHBondContact O-N 3Å; I973-S975 VanDerWaalsContact C-N 3.32Å; I973-S978 WeakPolarHBondContact O-CB 3.35Å; I973-S978 PolarHBondContact O-OG 3.24Å; I973-T987 HydrophobicContact CG2-CG2 4.34Å; I973-C990 HydrophobicContact CD1-CB 3.88Å; I973-C990 HydrophobicContact CG1-CB 3.52Å; I973-I991 HydrophobicContact CD1-CB 4.44Å; I973-I991 HydrophobicContact CD1-CG1 3.86Å; I973-I991 HydrophobicContact CG1-CG1 3.93Å; I973-I991 HydrophobicContact CG2-CD1 4.27Å; I973-I991 HydrophobicContact CG2-CG1 3.79Å; I973-V994 HydrophobicContact CD1-CG2 3.95Å; I973-W1017 HydrophobicContact CD1-CD2 4.47Å; I973-W1017 HydrophobicContact CD1-CE3 3.81Å; I973-W1017 HydrophobicContact CD1-CH2 4.16Å; I973-W1017 HydrophobicContact CD1-CZ3 3.65Å; I973-W1017 HydrophobicContact CG2-CB 4.39Å; I973-W1017 HydrophobicContact CG2-CD2 3.45Å; I973-W1017 VanDerWaalsContact CG2-CD2 3.45Å; I973-W1017 HydrophobicContact CG2-CE3 3.9Å; I973-W1017 HydrophobicContact CG2-CG 3.65Å; I973-W1017 HydrophobicContact CG2-CZ2 4.16Å; I973-W1017 HydrophobicContact CG2-CZ3 4.46Å
974	Q	97.4	Very high	96.6	Very high	116 Å²	116	61.1 Å²	61.1	54%	0.542	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-2	-178.7	-67	-179.8	-12.7	0	0	114	V970 V972 W1017	V970-Q974 HydrophobicContact CG1-CG 4.16Å; V970-Q974 WeakPolarHBondContact O-CB 3.47Å; V970-Q974 VanDerWaalsContact O-CG 3.32Å; V970-Q974 WeakPolarHBondContact O-CG 3.46Å; V970-Q974 PolarHBondContact O-N 3.4Å; V972-Q974 VanDerWaalsContact C-N 3.29Å; V972-Q974 PolarHBondContact O-N 3.11Å; Q974-W1017 HydrophobicContact CG-CZ2 4.27Å
975	S	96.5	Very high	96.5	Very high	63 Å²	63	60 Å²	60	44%	0.441	31%	0.312	S	S	.	.	S	Bend	trans	-61.4	149.7	174.6	-176.5	0	0	0	0	110.7	R971 V972 I973 S978	R971-S975 PolarHBondContact O-N 2.8Å; R971-S975 VanDerWaalsContact O-N 3.13Å; V972-S975 VanDerWaalsContact O-CB 3.26Å; V972-S975 WeakPolarHBondContact O-CB 3.49Å; V972-S975 PolarHBondContact O-N 2.95Å; V972-S975 VanDerWaalsContact O-N 3.13Å; I973-S975 VanDerWaalsContact C-N 3.32Å; S975-S978 WeakPolarHBondContact O-CB 3.49Å; S975-S978 PolarHBondContact O-N 3.03Å; S975-S978 PolarHBondContact O-OG 3.3Å
976	A	93.6	Very high	96.5	Very high	77 Å²	77	60 Å²	60	64%	0.636	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	148.4	164	0	0	0	0	0	109.5	S978	A976-S978 PolarHBondContact O-N 3.24Å; A976-S978 VanDerWaalsContact O-N 3.11Å
977	D	95.2	Very high	96.6	Very high	117 Å²	117	58.9 Å²	58.9	63%	0.626	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	15.3	176.5	-49.7	-35.8	0	0	0	115	K979 T980 N983	D977-K979 PolarHBondContact O-N 2.96Å; D977-K979 VanDerWaalsContact O-N 3.16Å; D977-T980 HydrophobicContact CB-CG2 3.73Å; D977-T980 WeakPolarHBondContact O-CG2 3.47Å; D977-T980 PolarHBondContact O-N 3.07Å; D977-T980 PolarHBondContact O-OG1 3.44Å; D977-N983 PolarHBondContact O-ND2 2.88Å
978	S	95.1	Very high	96.6	Very high	17 Å²	17	55.4 Å²	55.4	12%	0.119	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.8	180	64.4	0	0	0	0	113.7	I973 S975 A976 N983 T987	I973-S978 WeakPolarHBondContact O-CB 3.35Å; I973-S978 PolarHBondContact O-OG 3.24Å; S975-S978 WeakPolarHBondContact O-CB 3.49Å; S975-S978 PolarHBondContact O-N 3.03Å; S975-S978 PolarHBondContact O-OG 3.3Å; A976-S978 PolarHBondContact O-N 3.24Å; A976-S978 VanDerWaalsContact O-N 3.11Å; S978-N983 CarbonylContact O-C 3.59Å; S978-N983 WeakPolarHBondContact O-CB 3.4Å; S978-T987 WeakPolarHBondContact CB-OG1 3.42Å; S978-T987 VanDerWaalsContact O-CB 3.26Å; S978-T987 WeakPolarHBondContact O-CB 3.13Å; S978-T987 PolarHBondContact O-OG1 3.22Å
979	K	93.8	Very high	96.6	Very high	101 Å²	101	54.1 Å²	54.1	44%	0.439	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	24.9	178	-61.3	-138.9	-179.5	-173.2	0	114.1	D977 W1017	D977-K979 PolarHBondContact O-N 2.96Å; D977-K979 VanDerWaalsContact O-N 3.16Å; K979-W1017 PolarHBondContact NZ-O 3.39Å
980	T	95.4	Very high	96.6	Very high	43 Å²	43	54.1 Å²	54.1	26%	0.264	28%	0.277	S	S	.	.	S	Bend	trans	-72.5	163.2	166.6	67	0	0	0	0	110.7	D977 E982 N983 V984	D977-T980 HydrophobicContact CB-CG2 3.73Å; D977-T980 WeakPolarHBondContact O-CG2 3.47Å; D977-T980 PolarHBondContact O-N 3.07Å; D977-T980 PolarHBondContact O-OG1 3.44Å; T980-E982 WeakPolarHBondContact CB-OE2 3.49Å; T980-E982 PolarHBondContact O-N 3.04Å; T980-E982 VanDerWaalsContact O-N 3.12Å; T980-E982 PolarHBondContact OG1-OE2 3.48Å; T980-N983 PolarHBondContact O-N 3.07Å; T980-N983 PolarHBondContact OG1-ND2 2.93Å; T980-V984 WeakPolarHBondContact O-CB 3.35Å; T980-V984 PolarHBondContact O-N 3.36Å
981	K	92.8	Very high	96.6	Very high	184 Å²	184	52.9 Å²	52.9	80%	0.8	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-34.6	-179.3	-173.3	-177.3	176.3	-172.2	0	112.5
982	E	93.7	Very high	96.6	Very high	131 Å²	131	45.9 Å²	45.9	61%	0.612	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-29.8	-178.3	-54.7	72	-154.8	0	0	112.5	P937 T980	P937-E982 VanDerWaalsContact CB-O 3.29Å; P937-E982 WeakPolarHBondContact CB-O 3.42Å; P937-E982 WeakPolarHBondContact CG-O 3.36Å; T980-E982 WeakPolarHBondContact CB-OE2 3.49Å; T980-E982 PolarHBondContact O-N 3.04Å; T980-E982 VanDerWaalsContact O-N 3.12Å; T980-E982 PolarHBondContact OG1-OE2 3.48Å
983	N	96.3	Very high	96.6	Very high	30 Å²	30	45.5 Å²	45.5	16%	0.16	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-13.9	-170.1	-66.5	-55	0	0	0	114.1	R940 D977 S978 T980 N985 A986 T987	R940-N983 PolarHBondContact NH2-OD1 3.46Å; D977-N983 PolarHBondContact O-ND2 2.88Å; S978-N983 CarbonylContact O-C 3.59Å; S978-N983 WeakPolarHBondContact O-CB 3.4Å; T980-N983 PolarHBondContact O-N 3.07Å; T980-N983 PolarHBondContact OG1-ND2 2.93Å; N983-N985 PolarHBondContact O-N 3.38Å; N983-A986 PolarHBondContact O-N 3.35Å; N983-T987 PolarHBondContact O-N 2.9Å; N983-T987 PolarHBondContact O-OG1 3.24Å
984	V	96.9	Very high	96.6	Very high	9 Å²	9	45.1 Å²	45.1	6%	0.055	24%	0.239	C	C	.	.	H	α-helix	trans	-57.3	-48.1	-169.4	59.4	0	0	0	0	112.1	T980 A986 T987 E988 E1022	T980-V984 WeakPolarHBondContact O-CB 3.35Å; T980-V984 PolarHBondContact O-N 3.36Å; V984-A986 PolarHBondContact O-N 3.39Å; V984-T987 CarbonylContact O-C 3.4Å; V984-T987 PolarHBondContact O-N 2.8Å; V984-T987 VanDerWaalsContact O-N 3.12Å; V984-E988 HydrophobicContact CG2-CG 4.11Å; V984-E988 WeakPolarHBondContact O-CB 3.34Å; V984-E988 WeakPolarHBondContact O-CG 3.41Å; V984-E988 PolarHBondContact O-N 3.18Å; V984-E1022 HydrophobicContact CB-CG 4.33Å; V984-E1022 HydrophobicContact CG1-CB 4.36Å; V984-E1022 HydrophobicContact CG1-CG 3.71Å; V984-E1022 HydrophobicContact CG2-CB 4.4Å; V984-E1022 HydrophobicContact CG2-CG 3.67Å
985	N	96.4	Very high	96.7	Very high	53 Å²	53	39.9 Å²	39.9	28%	0.283	22%	0.216	S	C	.	.	H	α-helix	trans	-59.8	-42.7	179.7	-76.3	-66.7	0	0	0	113.1	N983 T987 E988 N989 E1022	N983-N985 PolarHBondContact O-N 3.38Å; N985-T987 VanDerWaalsContact C-N 3.34Å; N985-T987 PolarHBondContact O-N 3.04Å; N985-E988 PolarHBondContact O-N 2.99Å; N985-N989 WeakPolarHBondContact O-CB 3.4Å; N985-N989 PolarHBondContact O-N 2.97Å; N985-N989 PolarHBondContact O-ND2 2.63Å; N985-E1022 WeakPolarHBondContact OD1-CB 3.35Å
986	A	98.1	Very high	96.8	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-41.5	176	0	0	0	0	0	112	P937 R940 Q941 N983 V984 C990	P937-A986 HydrophobicContact CB-CB 4.22Å; P937-A986 VanDerWaalsContact O-CB 3.22Å; P937-A986 WeakPolarHBondContact O-CB 3.4Å; R940-A986 HydrophobicContact CB-CB 4.13Å; Q941-A986 HydrophobicContact CB-CB 4.01Å; N983-A986 PolarHBondContact O-N 3.35Å; V984-A986 PolarHBondContact O-N 3.39Å; A986-C990 PolarHBondContact O-N 2.92Å; A986-C990 PolarHBondContact O-SG 3.03Å
987	T	98.4	Very high	97	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69.5	-40.6	178	-64	0	0	0	0	112	I973 S978 N983 V984 N985 C990 I991	I973-T987 HydrophobicContact CG2-CG2 4.34Å; S978-T987 WeakPolarHBondContact CB-OG1 3.42Å; S978-T987 VanDerWaalsContact O-CB 3.26Å; S978-T987 WeakPolarHBondContact O-CB 3.13Å; S978-T987 PolarHBondContact O-OG1 3.22Å; N983-T987 PolarHBondContact O-N 2.9Å; N983-T987 PolarHBondContact O-OG1 3.24Å; V984-T987 CarbonylContact O-C 3.4Å; V984-T987 PolarHBondContact O-N 2.8Å; V984-T987 VanDerWaalsContact O-N 3.12Å; N985-T987 VanDerWaalsContact C-N 3.34Å; N985-T987 PolarHBondContact O-N 3.04Å; T987-C990 WeakPolarHBondContact O-CB 3.34Å; T987-C990 PolarHBondContact O-N 3.01Å; T987-I991 HydrophobicContact CG2-CD1 3.97Å; T987-I991 HydrophobicContact CG2-CG1 4.48Å; T987-I991 VanDerWaalsContact O-CG1 3.27Å; T987-I991 WeakPolarHBondContact O-CG1 3.41Å; T987-I991 PolarHBondContact O-N 3.33Å
988	E	98.1	Very high	97.2	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-60.6	-45.7	175	-71.8	-161.7	164.1	0	0	111.1	V984 N985 C990 I991 S992 L1020 H1021 E1022 D1023	V984-E988 HydrophobicContact CG2-CG 4.11Å; V984-E988 WeakPolarHBondContact O-CB 3.34Å; V984-E988 WeakPolarHBondContact O-CG 3.41Å; V984-E988 PolarHBondContact O-N 3.18Å; N985-E988 PolarHBondContact O-N 2.99Å; E988-C990 VanDerWaalsContact C-N 3.31Å; E988-C990 PolarHBondContact O-N 3.21Å; E988-I991 WeakPolarHBondContact O-CB 3.44Å; E988-I991 PolarHBondContact O-N 3.13Å; E988-I991 VanDerWaalsContact O-N 3.12Å; E988-S992 PolarHBondContact O-N 2.9Å; E988-L1020 HydrophobicContact CB-CD2 3.88Å; E988-L1020 HydrophobicContact CB-CG 3.81Å; E988-L1020 HydrophobicContact CG-CB 4.27Å; E988-L1020 HydrophobicContact CG-CD2 4.41Å; E988-L1020 HydrophobicContact CG-CG 3.78Å; E988-L1020 VanDerWaalsContact OE1-CA 3.28Å; E988-L1020 WeakPolarHBondContact OE1-CA 3.38Å; E988-H1021 PolarHBondContact OE1-N 2.97Å; E988-H1021 PolarHBondContact OE2-N 3.24Å; E988-E1022 PolarHBondContact OE1-N 2.71Å; E988-E1022 PolarHBondContact OE2-N 3.39Å; E988-D1023 PolarHBondContact OE2-N 3.47Å
989	N	98.6	Very high	97.3	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-38.9	173	-87.5	-88.9	0	0	0	112.4	Q941 A944 N985 S992 A993 D1023	Q941-N989 HydrophobicContact CG-CB 4.11Å; Q941-N989 PolarHBondContact NE2-ND2 3.4Å; A944-N989 HydrophobicContact CB-CB 4.19Å; N985-N989 WeakPolarHBondContact O-CB 3.4Å; N985-N989 PolarHBondContact O-N 2.97Å; N985-N989 PolarHBondContact O-ND2 2.63Å; N989-S992 PolarHBondContact O-N 3.48Å; N989-A993 VanDerWaalsContact O-CB 3.29Å; N989-A993 WeakPolarHBondContact O-CB 3.39Å; N989-A993 PolarHBondContact O-N 3.39Å; N989-D1023 PolarHBondContact ND2-OD2 2.97Å
990	C	98.8	Very high	97.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-44.9	172.6	-68.7	0	0	0	0	112.4	A944 L969 I973 A986 T987 E988 S992 A993 V994	A944-C990 HydrophobicContact CB-CB 4.39Å; A944-C990 WeakPolarHBondContact CB-SG 3.41Å; L969-C990 HydrophobicContact CD2-CB 4Å; I973-C990 HydrophobicContact CD1-CB 3.88Å; I973-C990 HydrophobicContact CG1-CB 3.52Å; A986-C990 PolarHBondContact O-N 2.92Å; A986-C990 PolarHBondContact O-SG 3.03Å; T987-C990 WeakPolarHBondContact O-CB 3.34Å; T987-C990 PolarHBondContact O-N 3.01Å; E988-C990 VanDerWaalsContact C-N 3.31Å; E988-C990 PolarHBondContact O-N 3.21Å; C990-S992 VanDerWaalsContact C-N 3.3Å; C990-S992 PolarHBondContact O-N 3.34Å; C990-A993 PolarHBondContact O-N 2.98Å; C990-V994 WeakPolarHBondContact O-CG2 3.31Å; C990-V994 PolarHBondContact O-N 2.93Å
991	I	98.7	Very high	97.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-43.2	178.6	-66.5	159	0	0	0	110	I973 T987 E988 V994 G995 W1014 W1017 L1018 L1020	I973-I991 HydrophobicContact CD1-CB 4.44Å; I973-I991 HydrophobicContact CD1-CG1 3.86Å; I973-I991 HydrophobicContact CG1-CG1 3.93Å; I973-I991 HydrophobicContact CG2-CD1 4.27Å; I973-I991 HydrophobicContact CG2-CG1 3.79Å; T987-I991 HydrophobicContact CG2-CD1 3.97Å; T987-I991 HydrophobicContact CG2-CG1 4.48Å; T987-I991 VanDerWaalsContact O-CG1 3.27Å; T987-I991 WeakPolarHBondContact O-CG1 3.41Å; T987-I991 PolarHBondContact O-N 3.33Å; E988-I991 WeakPolarHBondContact O-CB 3.44Å; E988-I991 PolarHBondContact O-N 3.13Å; E988-I991 VanDerWaalsContact O-N 3.12Å; I991-V994 PolarHBondContact O-N 3.35Å; I991-G995 PolarHBondContact O-N 3.49Å; I991-W1014 PolarHBondContact O-NE1 3.08Å; I991-W1017 HydrophobicContact CD1-CB 3.67Å; I991-W1017 HydrophobicContact CG1-CB 3.81Å; I991-W1017 HydrophobicContact CG1-CD2 4.4Å; I991-W1017 HydrophobicContact CG1-CE3 4.09Å; I991-W1017 HydrophobicContact CG1-CG 4.32Å; I991-W1017 HydrophobicContact CG2-CB 4.1Å; I991-W1017 HydrophobicContact CG2-CE3 4.28Å; I991-L1018 HydrophobicContact CG2-CD2 4.18Å; I991-L1020 HydrophobicContact CB-CD1 4.27Å; I991-L1020 HydrophobicContact CD1-CD1 4.45Å; I991-L1020 HydrophobicContact CG2-CD1 3.78Å
992	S	98.6	Very high	97.7	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.007	11%	0.114	C	C	.	.	H	α-helix	trans	-69.3	-40.5	178	-168.3	0	0	0	0	112.6	E988 N989 C990 V994 G995 K996 E1026	E988-S992 PolarHBondContact O-N 2.9Å; N989-S992 PolarHBondContact O-N 3.48Å; C990-S992 VanDerWaalsContact C-N 3.3Å; C990-S992 PolarHBondContact O-N 3.34Å; S992-V994 VanDerWaalsContact C-N 3.31Å; S992-V994 PolarHBondContact O-N 3.27Å; S992-G995 CarbonylContact O-C 3.59Å; S992-G995 VanDerWaalsContact O-CA 3.26Å; S992-G995 WeakPolarHBondContact O-CA 3.4Å; S992-G995 PolarHBondContact O-N 3.47Å; S992-K996 WeakPolarHBondContact O-CG 3.25Å; S992-K996 PolarHBondContact O-N 3.16Å; S992-E1026 WeakPolarHBondContact CB-OE2 3.5Å; S992-E1026 PolarHBondContact OG-OE2 3.02Å
993	A	98.7	Very high	97.8	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-58.3	-41.4	173.7	0	0	0	0	0	112.2	A944 L969 N989 C990 G995 K996 I997	A944-A993 VanDerWaalsContact O-CB 3.26Å; A944-A993 WeakPolarHBondContact O-CB 3.4Å; L969-A993 HydrophobicContact CD1-CB 3.93Å; L969-A993 HydrophobicContact CD2-CB 4.02Å; N989-A993 VanDerWaalsContact O-CB 3.29Å; N989-A993 WeakPolarHBondContact O-CB 3.39Å; N989-A993 PolarHBondContact O-N 3.39Å; C990-A993 PolarHBondContact O-N 2.98Å; A993-G995 VanDerWaalsContact C-N 3.33Å; A993-G995 PolarHBondContact O-N 3.2Å; A993-K996 PolarHBondContact O-N 3.32Å; A993-I997 WeakPolarHBondContact O-CG1 3.21Å; A993-I997 PolarHBondContact O-N 2.99Å
994	V	98.8	Very high	97.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.4	-42.7	171.1	174.8	0	0	0	0	111	L966 L969 V970 I973 C990 I991 S992 I997 M998 V1010 W1017	L966-V994 HydrophobicContact CD1-CB 4.47Å; L966-V994 HydrophobicContact CD1-CG1 3.8Å; L966-V994 HydrophobicContact CD1-CG2 4.15Å; L969-V994 HydrophobicContact CB-CG2 3.67Å; L969-V994 HydrophobicContact CD1-CG2 4.07Å; L969-V994 HydrophobicContact CG-CG2 4.48Å; V970-V994 HydrophobicContact CG2-CG2 4.37Å; I973-V994 HydrophobicContact CD1-CG2 3.95Å; C990-V994 WeakPolarHBondContact O-CG2 3.31Å; C990-V994 PolarHBondContact O-N 2.93Å; I991-V994 PolarHBondContact O-N 3.35Å; S992-V994 VanDerWaalsContact C-N 3.31Å; S992-V994 PolarHBondContact O-N 3.27Å; V994-I997 PolarHBondContact O-N 3.09Å; V994-M998 HydrophobicContact CG1-CE 4.17Å; V994-M998 WeakPolarHBondContact O-CG 3.27Å; V994-M998 PolarHBondContact O-N 3.29Å; V994-V1010 HydrophobicContact CG1-CG1 3.88Å; V994-W1017 HydrophobicContact CB-CZ3 4.46Å; V994-W1017 HydrophobicContact CG1-CZ3 4.14Å; V994-W1017 HydrophobicContact CG2-CZ3 4.49Å
995	G	98.2	Very high	97.6	Very high	5 Å²	5	22.4 Å²	22.4	5%	0.052	12%	0.118	C	C	.	.	H	α-helix	trans	-55.4	-49.7	172.6	0	0	0	0	0	113	I991 S992 A993 I997 M998 K999	I991-G995 PolarHBondContact O-N 3.49Å; S992-G995 CarbonylContact O-C 3.59Å; S992-G995 VanDerWaalsContact O-CA 3.26Å; S992-G995 WeakPolarHBondContact O-CA 3.4Å; S992-G995 PolarHBondContact O-N 3.47Å; A993-G995 VanDerWaalsContact C-N 3.33Å; A993-G995 PolarHBondContact O-N 3.2Å; G995-I997 PolarHBondContact O-N 2.83Å; G995-M998 PolarHBondContact O-N 3.01Å; G995-K999 WeakPolarHBondContact O-CB 3.32Å; G995-K999 PolarHBondContact O-N 2.98Å
996	K	98.6	Very high	97.5	Very high	11 Å²	11	24.1 Å²	24.1	5%	0.048	13%	0.127	C	C	.	.	H	α-helix	trans	-61.6	-42	177.5	-67.9	172.8	-176.4	170.1	0	111.2	S992 A993 K999 F1000 E1026	S992-K996 WeakPolarHBondContact O-CG 3.25Å; S992-K996 PolarHBondContact O-N 3.16Å; A993-K996 PolarHBondContact O-N 3.32Å; K996-K999 PolarHBondContact O-N 3.2Å; K996-F1000 HydrophobicContact CB-CD2 4.15Å; K996-F1000 HydrophobicContact CB-CE2 4.49Å; K996-F1000 HydrophobicContact CG-CE2 4.41Å; K996-F1000 WeakPolarHBondContact O-CB 3.36Å; K996-F1000 VanDerWaalsContact O-CD2 3.28Å; K996-F1000 WeakPolarHBondContact O-CD2 3.36Å; K996-F1000 PolarHBondContact O-N 3.49Å; K996-E1026 WeakPolarHBondContact CE-OE2 3.29Å; K996-E1026 IonicContact NZ-OE1 3.71Å; K996-E1026 PolarHBondContact NZ-OE1 2.95Å; K996-E1026 IonicContact NZ-OE2 3.05Å; K996-E1026 PolarHBondContact NZ-OE2 3.49Å
997	I	98.5	Very high	97.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-48.6	174.1	-68.3	165.8	0	0	0	111	A951 C962 A965 L969 A993 V994 G995 K999 K1001 V1005	A951-I997 HydrophobicContact CB-CB 4.39Å; A951-I997 HydrophobicContact CB-CG1 3.72Å; C962-I997 HydrophobicContact CB-CG1 4.48Å; A965-I997 HydrophobicContact CB-CD1 4.39Å; L969-I997 HydrophobicContact CD1-CD1 3.74Å; A993-I997 WeakPolarHBondContact O-CG1 3.21Å; A993-I997 PolarHBondContact O-N 2.99Å; V994-I997 PolarHBondContact O-N 3.09Å; G995-I997 PolarHBondContact O-N 2.83Å; I997-K999 VanDerWaalsContact C-N 3.35Å; I997-K999 PolarHBondContact O-N 2.93Å; I997-K1001 CarbonylContact O-C 3.52Å; I997-K1001 WeakPolarHBondContact O-CA 3.42Å; I997-K1001 PolarHBondContact O-N 2.92Å; I997-V1005 HydrophobicContact CG2-CB 4.39Å; I997-V1005 HydrophobicContact CG2-CG1 3.99Å
998	M	98.2	Very high	97	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-62	-41.7	178.9	-68.7	-169.8	-70	0	0	112.3	V994 G995 V1005 V1007 V1010 W1014 Y1033	V994-M998 HydrophobicContact CG1-CE 4.17Å; V994-M998 WeakPolarHBondContact O-CG 3.27Å; V994-M998 PolarHBondContact O-N 3.29Å; G995-M998 PolarHBondContact O-N 3.01Å; M998-V1005 HydrophobicContact CG-CG1 4.34Å; M998-V1007 HydrophobicContact CB-CG1 4.24Å; M998-V1007 HydrophobicContact CB-CG2 4.16Å; M998-V1007 HydrophobicContact CG-CG1 4.39Å; M998-V1007 HydrophobicContact CG-CG2 4.36Å; M998-V1007 HydrophobicContact SD-CG1 4.15Å; M998-V1010 HydrophobicContact SD-CB 3.98Å; M998-V1010 HydrophobicContact SD-CG1 3.82Å; M998-W1014 HydrophobicContact CE-CB 3.52Å; M998-W1014 HydrophobicContact CE-CD2 3.55Å; M998-W1014 HydrophobicContact CE-CE3 4.11Å; M998-W1014 HydrophobicContact CE-CG 3.25Å; M998-W1014 HydrophobicContact SD-CB 4.5Å; M998-Y1033 HydrophobicContact CB-CE1 4.05Å; M998-Y1033 WeakPolarHBondContact CB-OH 3.34Å; M998-Y1033 HydrophobicContact CE-CE1 3.89Å
999	K	97.7	Very high	96.7	Very high	70 Å²	70	37.8 Å²	37.8	30%	0.304	19%	0.193	S	C	.	.	H	α-helix	trans	-72.5	-48.9	-177.5	-178	171.7	177.1	160.2	0	112.9	G995 K996 I997 Y1033 D1036	G995-K999 WeakPolarHBondContact O-CB 3.32Å; G995-K999 PolarHBondContact O-N 2.98Å; K996-K999 PolarHBondContact O-N 3.2Å; I997-K999 VanDerWaalsContact C-N 3.35Å; I997-K999 PolarHBondContact O-N 2.93Å; K999-Y1033 HydrophobicContact CB-CD2 3.75Å; K999-Y1033 HydrophobicContact CB-CE1 4.47Å; K999-Y1033 HydrophobicContact CB-CE2 3.64Å; K999-Y1033 HydrophobicContact CB-CG 4.21Å; K999-Y1033 HydrophobicContact CD-CD2 3.62Å; K999-Y1033 HydrophobicContact CD-CE2 4.29Å; K999-Y1033 HydrophobicContact CD-CG 4.06Å; K999-Y1033 HydrophobicContact CG-CD2 3.8Å; K999-Y1033 HydrophobicContact CG-CE2 3.95Å; K999-D1036 VanDerWaalsContact CE-OD2 3.28Å; K999-D1036 WeakPolarHBondContact CE-OD2 3.18Å; K999-D1036 IonicContact NZ-OD2 3.82Å; K999-D1036 PolarHBondContact NZ-OD2 3.26Å
1000	F	97.8	Very high	96.6	Very high	71 Å²	71	38.6 Å²	38.6	31%	0.311	20%	0.198	S	C	.	.	H	α-helix	trans	-100.9	-16.8	-167.9	-62.8	-73.2	0	0	0	114.2	A951 Q952 K996 P1002	A951-F1000 WeakPolarHBondContact O-CB 3.44Å; Q952-F1000 HydrophobicContact CB-CD2 3.77Å; Q952-F1000 HydrophobicContact CB-CE2 3.92Å; Q952-F1000 HydrophobicContact CB-CG 4.27Å; Q952-F1000 HydrophobicContact CG-CD1 4.44Å; Q952-F1000 HydrophobicContact CG-CD2 3.85Å; Q952-F1000 HydrophobicContact CG-CE1 4.15Å; Q952-F1000 HydrophobicContact CG-CE2 3.53Å; Q952-F1000 HydrophobicContact CG-CG 4.3Å; Q952-F1000 HydrophobicContact CG-CZ 3.69Å; K996-F1000 HydrophobicContact CB-CD2 4.15Å; K996-F1000 HydrophobicContact CB-CE2 4.49Å; K996-F1000 HydrophobicContact CG-CE2 4.41Å; K996-F1000 WeakPolarHBondContact O-CB 3.36Å; K996-F1000 VanDerWaalsContact O-CD2 3.28Å; K996-F1000 WeakPolarHBondContact O-CD2 3.36Å; K996-F1000 PolarHBondContact O-N 3.49Å; F1000-P1002 VanDerWaalsContact C-CD 3.46Å
1001	K	97	Very high	96.4	Very high	25 Å²	25	39 Å²	39	11%	0.109	20%	0.2	C	C	.	.			trans	-135.2	51.1	178.2	-61	-67.3	173.3	-69.5	0	111.8	A951 R959 I997 D1003 C1004	A951-K1001 HydrophobicContact CB-CG 4.14Å; A951-K1001 WeakPolarHBondContact O-CE 3.41Å; A951-K1001 PolarHBondContact O-NZ 3.15Å; R959-K1001 HydrophobicContact CG-CD 4.09Å; I997-K1001 CarbonylContact O-C 3.52Å; I997-K1001 WeakPolarHBondContact O-CA 3.42Å; I997-K1001 PolarHBondContact O-N 2.92Å; K1001-D1003 PolarHBondContact O-N 3.05Å; K1001-D1003 VanDerWaalsContact O-N 3.12Å; K1001-C1004 HydrophobicContact CB-CB 4.27Å; K1001-C1004 WeakPolarHBondContact O-CB 3.44Å; K1001-C1004 PolarHBondContact O-N 3.46Å
1002	P	95.6	Very high	96.3	Very high	62 Å²	62	42.6 Å²	42.6	40%	0.403	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-59.7	-27.6	-177.2	25.6	-35.5	0	0	0	113.2	F1000 C1004 V1005 V1007	F1000-P1002 VanDerWaalsContact C-CD 3.46Å; P1002-C1004 PolarHBondContact O-N 3.11Å; P1002-C1004 VanDerWaalsContact O-N 3.17Å; P1002-V1005 PolarHBondContact O-N 3.36Å; P1002-V1007 HydrophobicContact CB-CG2 3.9Å
1003	D	95.6	Very high	96.2	Very high	129 Å²	129	46.8 Å²	46.8	69%	0.69	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-66.8	-13.8	175.8	-62.9	-28.7	0	0	0	113.8	R959 K1001	R959-D1003 IonicContact CZ-OD2 2.77Å; R959-D1003 IonicContact NH2-OD2 3.45Å; R959-D1003 PolarHBondContact NH2-OD2 3.32Å; K1001-D1003 PolarHBondContact O-N 3.05Å; K1001-D1003 VanDerWaalsContact O-N 3.12Å
1004	C	94.2	Very high	96.1	Very high	16 Å²	16	46.8 Å²	46.8	11%	0.108	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-96.1	-5.1	-178.5	-55.6	0	0	0	0	112.6	C962 T963 K1001 P1002	C962-C1004 HydrophobicContact CB-CB 4.42Å; T963-C1004 WeakPolarHBondContact OG1-CB 3.35Å; T963-C1004 PolarHBondContact OG1-O 3.44Å; K1001-C1004 HydrophobicContact CB-CB 4.27Å; K1001-C1004 WeakPolarHBondContact O-CB 3.44Å; K1001-C1004 PolarHBondContact O-N 3.46Å; P1002-C1004 PolarHBondContact O-N 3.11Å; P1002-C1004 VanDerWaalsContact O-N 3.17Å
1005	V	95	Very high	96.1	Very high	19 Å²	19	47.1 Å²	47.1	12%	0.115	24%	0.244	C	C	.	.	S	Bend	trans	-146.1	145	-174.5	53.3	0	0	0	0	111.1	L966 I997 M998 P1002 V1007 V1010	L966-V1005 HydrophobicContact CD1-CG2 4.39Å; L966-V1005 HydrophobicContact CD2-CB 3.95Å; L966-V1005 HydrophobicContact CD2-CG2 3.32Å; L966-V1005 HydrophobicContact CG-CG2 4.48Å; I997-V1005 HydrophobicContact CG2-CB 4.39Å; I997-V1005 HydrophobicContact CG2-CG1 3.99Å; M998-V1005 HydrophobicContact CG-CG1 4.34Å; P1002-V1005 PolarHBondContact O-N 3.36Å; V1005-V1007 VanDerWaalsContact C-N 3.33Å; V1005-V1007 HydrophobicContact CG1-CG2 3.83Å; V1005-V1007 PolarHBondContact O-N 3.27Å; V1005-V1010 HydrophobicContact CG2-CB 4.46Å; V1005-V1010 HydrophobicContact CG2-CG2 3.73Å
1006	N	95.1	Very high	96	Very high	90 Å²	90	50.2 Å²	50.2	48%	0.481	27%	0.265	S	S	.	.			trans	-76.1	86.4	166.4	-170.9	0.5	0	0	0	110.1	E1008 E1009 V1010	N1006-E1008 VanDerWaalsContact C-N 3.25Å; N1006-E1008 PolarHBondContact O-N 3.28Å; N1006-E1009 HydrophobicContact CB-CB 4.18Å; N1006-E1009 PolarHBondContact ND2-OE2 3.06Å; N1006-E1009 PolarHBondContact O-N 3.47Å; N1006-E1009 VanDerWaalsContact O-N 3.11Å; N1006-V1010 PolarHBondContact O-N 3.06Å
1007	V	92.6	Very high	95.9	Very high	31 Å²	31	51 Å²	51	19%	0.188	27%	0.268	C	S	.	.	H	α-helix	trans	-56.2	-39.7	-175.2	179.4	0	0	0	0	111.8	M998 P1002 V1005 E1009 V1010 L1011	M998-V1007 HydrophobicContact CB-CG1 4.24Å; M998-V1007 HydrophobicContact CB-CG2 4.16Å; M998-V1007 HydrophobicContact CG-CG1 4.39Å; M998-V1007 HydrophobicContact CG-CG2 4.36Å; M998-V1007 HydrophobicContact SD-CG1 4.15Å; P1002-V1007 HydrophobicContact CB-CG2 3.9Å; V1005-V1007 VanDerWaalsContact C-N 3.33Å; V1005-V1007 HydrophobicContact CG1-CG2 3.83Å; V1005-V1007 PolarHBondContact O-N 3.27Å; V1007-E1009 PolarHBondContact O-N 2.9Å; V1007-V1010 PolarHBondContact O-N 2.8Å; V1007-L1011 WeakPolarHBondContact O-CB 3.44Å; V1007-L1011 PolarHBondContact O-N 3.09Å
1008	E	92.2	Very high	95.8	Very high	130 Å²	130	51.2 Å²	51.2	61%	0.607	27%	0.269	S	S	*	.	H	α-helix	trans	-62.4	-30.4	-178.8	-65.5	-168.6	172.8	0	0	113.2	N1006 P1012 I1044	N1006-E1008 VanDerWaalsContact C-N 3.25Å; N1006-E1008 PolarHBondContact O-N 3.28Å; E1008-P1012 WeakPolarHBondContact O-CD 3.42Å; E1008-I1044 HydrophobicContact CG-CD1 3.77Å; E1008-I1044 VanDerWaalsContact OE1-CD1 3.28Å; E1008-I1044 WeakPolarHBondContact OE1-CD1 3.37Å
1009	E	93	Very high	95.7	Very high	128 Å²	128	52 Å²	52	60%	0.598	27%	0.274	S	S	*	.	H	α-helix	trans	-82.1	-35.9	179.8	-174.4	175.4	176.8	0	0	112.2	N1006 V1007 H1013	N1006-E1009 HydrophobicContact CB-CB 4.18Å; N1006-E1009 PolarHBondContact ND2-OE2 3.06Å; N1006-E1009 PolarHBondContact O-N 3.47Å; N1006-E1009 VanDerWaalsContact O-N 3.11Å; V1007-E1009 PolarHBondContact O-N 2.9Å; E1009-H1013 PolarHBondContact O-CE1 3.35Å; E1009-H1013 PolarHBondContact O-ND1 2.9Å
1010	V	95.6	Very high	95.5	Very high	20 Å²	20	48.6 Å²	48.6	12%	0.121	26%	0.26	C	S	.	.	H	α-helix	trans	-82.8	-32.5	-177.9	-178	0	0	0	0	111.8	L966 V994 M998 V1005 N1006 V1007 H1013 W1014	L966-V1010 HydrophobicContact CD2-CG2 4.21Å; V994-V1010 HydrophobicContact CG1-CG1 3.88Å; M998-V1010 HydrophobicContact SD-CB 3.98Å; M998-V1010 HydrophobicContact SD-CG1 3.82Å; V1005-V1010 HydrophobicContact CG2-CB 4.46Å; V1005-V1010 HydrophobicContact CG2-CG2 3.73Å; N1006-V1010 PolarHBondContact O-N 3.06Å; V1007-V1010 PolarHBondContact O-N 2.8Å; V1010-H1013 WeakPolarHBondContact O-CA 3.48Å; V1010-H1013 WeakPolarHBondContact O-CB 3.4Å; V1010-H1013 PolarHBondContact O-N 3.33Å; V1010-W1014 PolarHBondContact O-N 3.28Å
1011	L	95.2	Very high	95.3	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-53.9	-44.1	-173.3	176.8	64.2	0	0	0	114.6	V1007 H1013 W1014 L1015 L1037 I1044 V1045	V1007-L1011 WeakPolarHBondContact O-CB 3.44Å; V1007-L1011 PolarHBondContact O-N 3.09Å; L1011-H1013 VanDerWaalsContact C-N 3.29Å; L1011-H1013 PolarHBondContact O-N 3.37Å; L1011-W1014 HydrophobicContact CD1-CE3 4.13Å; L1011-W1014 PolarHBondContact O-N 2.95Å; L1011-L1015 WeakPolarHBondContact O-CB 3.43Å; L1011-L1015 PolarHBondContact O-N 3.47Å; L1011-L1037 HydrophobicContact CD1-CD1 3.56Å; L1011-L1037 HydrophobicContact CD1-CD2 4.06Å; L1011-L1037 HydrophobicContact CD1-CG 4.43Å; L1011-L1037 HydrophobicContact CD2-CD2 4.19Å; L1011-I1044 HydrophobicContact CD2-CB 4.34Å; L1011-I1044 HydrophobicContact CD2-CG2 4.47Å; L1011-V1045 HydrophobicContact CD1-CG2 4.29Å; L1011-V1045 HydrophobicContact CD2-CB 4.13Å
1012	P	95.6	Very high	95	Very high	76 Å²	76	50.7 Å²	50.7	49%	0.494	27%	0.27	S	S	.	.	H	α-helix	trans	-62.9	-34.9	176.4	-22.5	34	0	0	0	113.2	E1008 S1016	E1008-P1012 WeakPolarHBondContact O-CD 3.42Å; P1012-S1016 PolarHBondContact O-N 3.36Å
1013	H	96.1	Very high	94.9	Very high	90 Å²	90	48.7 Å²	48.7	42%	0.417	26%	0.256	S	S	.	.	H	α-helix	trans	-69.8	-47.6	176.4	-56.9	91.2	0	0	0	110.2	E1009 V1010 L1011 L1015 S1016 W1017	E1009-H1013 PolarHBondContact O-CE1 3.35Å; E1009-H1013 PolarHBondContact O-ND1 2.9Å; V1010-H1013 WeakPolarHBondContact O-CA 3.48Å; V1010-H1013 WeakPolarHBondContact O-CB 3.4Å; V1010-H1013 PolarHBondContact O-N 3.33Å; L1011-H1013 VanDerWaalsContact C-N 3.29Å; L1011-H1013 PolarHBondContact O-N 3.37Å; H1013-L1015 VanDerWaalsContact C-N 3.33Å; H1013-L1015 PolarHBondContact O-N 3.36Å; H1013-S1016 WeakPolarHBondContact O-CB 3.49Å; H1013-S1016 PolarHBondContact O-N 2.9Å; H1013-S1016 PolarHBondContact O-OG 3.33Å; H1013-W1017 HydrophobicContact CB-CH2 4.1Å; H1013-W1017 HydrophobicContact CB-CZ2 3.8Å; H1013-W1017 PolarHBondContact O-N 2.92Å
1014	W	98.2	Very high	94.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-43.9	177.8	-178	82.1	0	0	0	112.4	I991 M998 V1010 L1011 S1016 W1017 L1018 T1030 Y1033 L1034 L1037	I991-W1014 PolarHBondContact O-NE1 3.08Å; M998-W1014 HydrophobicContact CE-CB 3.52Å; M998-W1014 HydrophobicContact CE-CD2 3.55Å; M998-W1014 HydrophobicContact CE-CE3 4.11Å; M998-W1014 HydrophobicContact CE-CG 3.25Å; M998-W1014 HydrophobicContact SD-CB 4.5Å; V1010-W1014 PolarHBondContact O-N 3.28Å; L1011-W1014 HydrophobicContact CD1-CE3 4.13Å; L1011-W1014 PolarHBondContact O-N 2.95Å; W1014-S1016 PolarHBondContact O-N 3.42Å; W1014-W1017 HydrophobicContact CB-CE3 4.21Å; W1014-W1017 HydrophobicContact CB-CZ3 4.2Å; W1014-W1017 HydrophobicContact CG-CE3 4.45Å; W1014-W1017 PolarHBondContact O-N 3.38Å; W1014-W1017 VanDerWaalsContact O-N 3.08Å; W1014-L1018 HydrophobicContact CE3-CD1 4.23Å; W1014-L1018 HydrophobicContact CH2-CD1 3.79Å; W1014-L1018 HydrophobicContact CZ2-CD1 4.26Å; W1014-L1018 HydrophobicContact CZ2-CD2 4.2Å; W1014-L1018 HydrophobicContact CZ3-CD1 3.77Å; W1014-T1030 HydrophobicContact CZ2-CG2 3.96Å; W1014-Y1033 AromaticContact CH2-CD1 3.58Å; W1014-Y1033 HydrophobicContact CH2-CD1 3.58Å; W1014-Y1033 HydrophobicContact CH2-CE1 4.32Å; W1014-Y1033 HydrophobicContact CH2-CG 4.37Å; W1014-Y1033 AromaticContact CZ2-CD1 3.82Å; W1014-Y1033 HydrophobicContact CZ2-CD1 3.82Å; W1014-Y1033 HydrophobicContact CZ3-CD1 4.04Å; W1014-Y1033 HydrophobicContact CZ3-CE1 4.38Å; W1014-L1034 HydrophobicContact CH2-CB 4.4Å; W1014-L1037 HydrophobicContact CE3-CD1 4.38Å; W1014-L1037 HydrophobicContact CH2-CD1 4.43Å; W1014-L1037 HydrophobicContact CZ3-CD1 3.72Å
1015	L	97.3	Very high	94.4	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-31	175.4	-172.9	65.4	0	0	0	112.6	L1011 H1013 W1017 L1018 L1034 V1045 N1052 I1056 I1059	L1011-L1015 WeakPolarHBondContact O-CB 3.43Å; L1011-L1015 PolarHBondContact O-N 3.47Å; H1013-L1015 VanDerWaalsContact C-N 3.33Å; H1013-L1015 PolarHBondContact O-N 3.36Å; L1015-W1017 VanDerWaalsContact C-N 3.32Å; L1015-L1018 HydrophobicContact CD1-CD1 4.38Å; L1015-L1034 HydrophobicContact CD1-CD1 3.79Å; L1015-V1045 HydrophobicContact CD1-CG2 3.96Å; L1015-V1045 HydrophobicContact CD2-CG2 3.92Å; L1015-V1045 HydrophobicContact CG-CG2 4.46Å; L1015-N1052 HydrophobicContact CD2-CB 4.11Å; L1015-I1056 HydrophobicContact CD1-CG1 4.22Å; L1015-I1059 HydrophobicContact CD1-CD1 3.9Å; L1015-I1059 HydrophobicContact CG-CD1 4.37Å
1016	S	96.3	Very high	94.4	Very high	70 Å²	70	51 Å²	51	49%	0.49	26%	0.259	S	S	.	.	H	α-helix	trans	-73.5	-22.4	178.8	79.6	0	0	0	0	113.9	P1012 H1013 W1014	P1012-S1016 PolarHBondContact O-N 3.36Å; H1013-S1016 WeakPolarHBondContact O-CB 3.49Å; H1013-S1016 PolarHBondContact O-N 2.9Å; H1013-S1016 PolarHBondContact O-OG 3.33Å; W1014-S1016 PolarHBondContact O-N 3.42Å
1017	W	97.7	Very high	94.3	Very high	26 Å²	26	46.8 Å²	46.8	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-83.6	-16.7	-178.9	-54.9	-33.4	0	0	0	113.5	V970 I973 Q974 K979 I991 V994 H1013 W1014 L1015	V970-W1017 HydrophobicContact CB-CH2 4.48Å; V970-W1017 HydrophobicContact CG1-CH2 4.18Å; V970-W1017 HydrophobicContact CG1-CZ2 4.27Å; V970-W1017 HydrophobicContact CG2-CH2 3.89Å; I973-W1017 HydrophobicContact CD1-CD2 4.47Å; I973-W1017 HydrophobicContact CD1-CE3 3.81Å; I973-W1017 HydrophobicContact CD1-CH2 4.16Å; I973-W1017 HydrophobicContact CD1-CZ3 3.65Å; I973-W1017 HydrophobicContact CG2-CB 4.39Å; I973-W1017 HydrophobicContact CG2-CD2 3.45Å; I973-W1017 VanDerWaalsContact CG2-CD2 3.45Å; I973-W1017 HydrophobicContact CG2-CE3 3.9Å; I973-W1017 HydrophobicContact CG2-CG 3.65Å; I973-W1017 HydrophobicContact CG2-CZ2 4.16Å; I973-W1017 HydrophobicContact CG2-CZ3 4.46Å; Q974-W1017 HydrophobicContact CG-CZ2 4.27Å; K979-W1017 PolarHBondContact NZ-O 3.39Å; I991-W1017 HydrophobicContact CD1-CB 3.67Å; I991-W1017 HydrophobicContact CG1-CB 3.81Å; I991-W1017 HydrophobicContact CG1-CD2 4.4Å; I991-W1017 HydrophobicContact CG1-CE3 4.09Å; I991-W1017 HydrophobicContact CG1-CG 4.32Å; I991-W1017 HydrophobicContact CG2-CB 4.1Å; I991-W1017 HydrophobicContact CG2-CE3 4.28Å; V994-W1017 HydrophobicContact CB-CZ3 4.46Å; V994-W1017 HydrophobicContact CG1-CZ3 4.14Å; V994-W1017 HydrophobicContact CG2-CZ3 4.49Å; H1013-W1017 HydrophobicContact CB-CH2 4.1Å; H1013-W1017 HydrophobicContact CB-CZ2 3.8Å; H1013-W1017 PolarHBondContact O-N 2.92Å; W1014-W1017 HydrophobicContact CB-CE3 4.21Å; W1014-W1017 HydrophobicContact CB-CZ3 4.2Å; W1014-W1017 HydrophobicContact CG-CE3 4.45Å; W1014-W1017 PolarHBondContact O-N 3.38Å; W1014-W1017 VanDerWaalsContact O-N 3.08Å; L1015-W1017 VanDerWaalsContact C-N 3.32Å
1018	L	96.2	Very high	94.3	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.026	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-74.3	152.8	177.3	-61.4	-175.2	0	0	0	112.6	I991 W1014 L1015 L1020 T1030 L1034 I1059	I991-L1018 HydrophobicContact CG2-CD2 4.18Å; W1014-L1018 HydrophobicContact CE3-CD1 4.23Å; W1014-L1018 HydrophobicContact CH2-CD1 3.79Å; W1014-L1018 HydrophobicContact CZ2-CD1 4.26Å; W1014-L1018 HydrophobicContact CZ2-CD2 4.2Å; W1014-L1018 HydrophobicContact CZ3-CD1 3.77Å; L1015-L1018 HydrophobicContact CD1-CD1 4.38Å; L1018-L1020 HydrophobicContact CD2-CD1 3.47Å; L1018-L1020 VanDerWaalsContact CD2-CD1 3.47Å; L1018-T1030 HydrophobicContact CD2-CG2 4.43Å; L1018-L1034 HydrophobicContact CD1-CD2 4.18Å; L1018-I1059 HydrophobicContact CB-CD1 3.9Å; L1018-I1059 HydrophobicContact CB-CG1 4.1Å; L1018-I1059 HydrophobicContact CB-CG2 3.77Å; L1018-I1059 HydrophobicContact CD1-CG2 4.43Å
1019	P	95.4	Very high	94.4	Very high	18 Å²	18	43.3 Å²	43.3	12%	0.117	22%	0.22	C	C	.	.	P	Polyproline II helix	cis	-85.8	170.7	3.4	20.2	-8.1	0	0	0	114.2	F1031 I1059 E1062	P1019-F1031 HydrophobicContact CB-CZ 3.93Å; P1019-I1059 HydrophobicContact CB-CG2 3.98Å; P1019-I1059 HydrophobicContact CG-CG2 4.34Å; P1019-E1062 HydrophobicContact CG-CB 3.47Å; P1019-E1062 VanDerWaalsContact CG-CB 3.47Å; P1019-E1062 HydrophobicContact CG-CG 4.3Å
1020	L	94.6	Very high	94.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-100.1	143.6	162.7	-77.2	62.5	0	0	0	107.8	E988 I991 L1018 E1026 A1027 T1030	E988-L1020 HydrophobicContact CB-CD2 3.88Å; E988-L1020 HydrophobicContact CB-CG 3.81Å; E988-L1020 HydrophobicContact CG-CB 4.27Å; E988-L1020 HydrophobicContact CG-CD2 4.41Å; E988-L1020 HydrophobicContact CG-CG 3.78Å; E988-L1020 VanDerWaalsContact OE1-CA 3.28Å; E988-L1020 WeakPolarHBondContact OE1-CA 3.38Å; I991-L1020 HydrophobicContact CB-CD1 4.27Å; I991-L1020 HydrophobicContact CD1-CD1 4.45Å; I991-L1020 HydrophobicContact CG2-CD1 3.78Å; L1018-L1020 HydrophobicContact CD2-CD1 3.47Å; L1018-L1020 VanDerWaalsContact CD2-CD1 3.47Å; L1020-E1026 HydrophobicContact CD2-CB 3.93Å; L1020-A1027 HydrophobicContact CB-CB 3.96Å; L1020-T1030 HydrophobicContact CD1-CG2 4.12Å; L1020-T1030 HydrophobicContact CD2-CG2 3.77Å
1021	H	92.1	Very high	94.6	Very high	44 Å²	44	36.5 Å²	36.5	20%	0.204	19%	0.187	C	C	.	.			trans	-146.2	-17.9	-179.8	58.1	79.2	0	0	0	115.6	E988 K1024 H1066 A1068	E988-H1021 PolarHBondContact OE1-N 2.97Å; E988-H1021 PolarHBondContact OE2-N 3.24Å; H1021-K1024 WeakPolarHBondContact O-CE 3.15Å; H1021-K1024 PolarHBondContact O-NZ 3.06Å; H1021-H1066 HydrophobicContact CB-CB 3.67Å; H1021-A1068 HydrophobicContact CB-CB 4.07Å
1022	E	91.8	Very high	94.6	Very high	95 Å²	95	37.6 Å²	37.6	44%	0.444	19%	0.193	S	C	.	.	S	Bend	trans	-82.6	-50.6	179	-61.2	-64.7	144.1	0	0	110.5	V984 N985 E988 K1024	V984-E1022 HydrophobicContact CB-CG 4.33Å; V984-E1022 HydrophobicContact CG1-CB 4.36Å; V984-E1022 HydrophobicContact CG1-CG 3.71Å; V984-E1022 HydrophobicContact CG2-CB 4.4Å; V984-E1022 HydrophobicContact CG2-CG 3.67Å; N985-E1022 WeakPolarHBondContact OD1-CB 3.35Å; E988-E1022 PolarHBondContact OE1-N 2.71Å; E988-E1022 PolarHBondContact OE2-N 3.39Å; E1022-K1024 PolarHBondContact O-N 2.96Å
1023	D	92.6	Very high	94.6	Very high	20 Å²	20	34.9 Å²	34.9	11%	0.107	17%	0.173	C	C	.	.	S	Bend	trans	-88.6	105.8	176.1	-168.7	-51.5	0	0	0	109.9	E988 N989 E1025 E1026 A1027	E988-D1023 PolarHBondContact OE2-N 3.47Å; N989-D1023 PolarHBondContact ND2-OD2 2.97Å; D1023-E1025 PolarHBondContact OD1-N 3.26Å; D1023-E1026 HydrophobicContact CB-CB 4.22Å; D1023-E1026 WeakPolarHBondContact OD1-CB 3.42Å; D1023-E1026 WeakPolarHBondContact OD1-CG 3.24Å; D1023-E1026 PolarHBondContact OD1-N 2.92Å; D1023-A1027 VanDerWaalsContact O-CB 3.28Å; D1023-A1027 WeakPolarHBondContact O-CB 3.08Å; D1023-A1027 PolarHBondContact O-N 2.99Å
1024	K	90.1	Very high	94.6	Very high	74 Å²	74	30.6 Å²	30.6	32%	0.322	15%	0.153	S	C	.	.	H	α-helix	trans	-71.7	-39.7	-171.2	-57.2	-58.3	-178.3	-178.5	0	111.4	H1021 E1022 A1027 V1028 H1066 E1067	H1021-K1024 WeakPolarHBondContact O-CE 3.15Å; H1021-K1024 PolarHBondContact O-NZ 3.06Å; E1022-K1024 PolarHBondContact O-N 2.96Å; K1024-A1027 PolarHBondContact O-N 3.4Å; K1024-V1028 WeakPolarHBondContact O-CG2 3.32Å; K1024-V1028 PolarHBondContact O-N 3.26Å; K1024-H1066 PolarHBondContact NZ-O 3.37Å; K1024-E1067 PolarHBondContact NZ-O 3.29Å
1025	E	90.4	Very high	94.5	Very high	135 Å²	135	30.6 Å²	30.6	63%	0.631	15%	0.153	S	C	*	.	H	α-helix	trans	-59.4	-50.3	176.3	-70.6	77.6	-175.2	0	0	110.5	D1023 V1028 Q1029	D1023-E1025 PolarHBondContact OD1-N 3.26Å; E1025-V1028 PolarHBondContact O-N 2.94Å; E1025-Q1029 WeakPolarHBondContact O-CG 3.34Å; E1025-Q1029 PolarHBondContact O-N 2.9Å; E1025-Q1029 VanDerWaalsContact O-N 3.13Å
1026	E	94.8	Very high	94.4	Very high	5 Å²	5	32.9 Å²	32.9	2%	0.023	17%	0.165	C	C	.	.	H	α-helix	trans	-73.3	-29.4	-179.1	-63.2	-54	146.8	0	0	112.9	Y945 S992 K996 L1020 D1023 Q1029 T1030	Y945-E1026 WeakPolarHBondContact CE2-OE1 3.5Å; S992-E1026 WeakPolarHBondContact CB-OE2 3.5Å; S992-E1026 PolarHBondContact OG-OE2 3.02Å; K996-E1026 WeakPolarHBondContact CE-OE2 3.29Å; K996-E1026 IonicContact NZ-OE1 3.71Å; K996-E1026 PolarHBondContact NZ-OE1 2.95Å; K996-E1026 IonicContact NZ-OE2 3.05Å; K996-E1026 PolarHBondContact NZ-OE2 3.49Å; L1020-E1026 HydrophobicContact CD2-CB 3.93Å; D1023-E1026 HydrophobicContact CB-CB 4.22Å; D1023-E1026 WeakPolarHBondContact OD1-CB 3.42Å; D1023-E1026 WeakPolarHBondContact OD1-CG 3.24Å; D1023-E1026 PolarHBondContact OD1-N 2.92Å; E1026-Q1029 PolarHBondContact O-N 3.29Å; E1026-T1030 WeakPolarHBondContact O-CG2 3.5Å; E1026-T1030 PolarHBondContact O-N 2.71Å; E1026-T1030 PolarHBondContact O-OG1 3.4Å; E1026-T1030 VanDerWaalsContact O-OG1 3.08Å
1027	A	92.9	Very high	94.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58	-49.8	168	0	0	0	0	0	111	L1020 D1023 K1024 Q1029 T1030 F1031 A1068	L1020-A1027 HydrophobicContact CB-CB 3.96Å; D1023-A1027 VanDerWaalsContact O-CB 3.28Å; D1023-A1027 WeakPolarHBondContact O-CB 3.08Å; D1023-A1027 PolarHBondContact O-N 2.99Å; K1024-A1027 PolarHBondContact O-N 3.4Å; A1027-Q1029 VanDerWaalsContact C-N 3.31Å; A1027-Q1029 PolarHBondContact O-N 3.26Å; A1027-T1030 PolarHBondContact O-N 3Å; A1027-T1030 PolarHBondContact O-OG1 3.02Å; A1027-F1031 HydrophobicContact CB-CD2 4.42Å; A1027-F1031 HydrophobicContact CB-CE2 4.49Å; A1027-F1031 WeakPolarHBondContact O-CB 3.49Å; A1027-F1031 WeakPolarHBondContact O-CD2 3.41Å; A1027-F1031 PolarHBondContact O-N 3.33Å; A1027-A1068 HydrophobicContact CB-CB 4.13Å
1028	V	92.2	Very high	94.2	Very high	23 Å²	23	30.3 Å²	30.3	14%	0.139	15%	0.148	C	C	.	.	H	α-helix	trans	-58.9	-41.4	177.1	171.7	0	0	0	0	111.5	K1024 E1025 N1032	K1024-V1028 WeakPolarHBondContact O-CG2 3.32Å; K1024-V1028 PolarHBondContact O-N 3.26Å; E1025-V1028 PolarHBondContact O-N 2.94Å; V1028-N1032 WeakPolarHBondContact CG1-ND2 3.21Å; V1028-N1032 WeakPolarHBondContact O-CB 3.42Å; V1028-N1032 PolarHBondContact O-N 2.93Å; V1028-N1032 PolarHBondContact O-ND2 2.72Å
1029	Q	94.8	Very high	94.1	Very high	65 Å²	65	34.8 Å²	34.8	30%	0.304	17%	0.168	S	C	.	.	H	α-helix	trans	-64	-46.7	178.1	-62.7	-54.4	-23.4	0	0	112.6	E1025 E1026 A1027 N1032 Y1033	E1025-Q1029 WeakPolarHBondContact O-CG 3.34Å; E1025-Q1029 PolarHBondContact O-N 2.9Å; E1025-Q1029 VanDerWaalsContact O-N 3.13Å; E1026-Q1029 PolarHBondContact O-N 3.29Å; A1027-Q1029 VanDerWaalsContact C-N 3.31Å; A1027-Q1029 PolarHBondContact O-N 3.26Å; Q1029-N1032 PolarHBondContact O-N 3.09Å; Q1029-Y1033 PolarHBondContact O-N 3.13Å
1030	T	96.4	Very high	94	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-68.1	-39.7	-179.1	56.4	0	0	0	0	112.1	W1014 L1018 L1020 E1026 A1027 Y1033 L1034	W1014-T1030 HydrophobicContact CZ2-CG2 3.96Å; L1018-T1030 HydrophobicContact CD2-CG2 4.43Å; L1020-T1030 HydrophobicContact CD1-CG2 4.12Å; L1020-T1030 HydrophobicContact CD2-CG2 3.77Å; E1026-T1030 WeakPolarHBondContact O-CG2 3.5Å; E1026-T1030 PolarHBondContact O-N 2.71Å; E1026-T1030 PolarHBondContact O-OG1 3.4Å; E1026-T1030 VanDerWaalsContact O-OG1 3.08Å; A1027-T1030 PolarHBondContact O-N 3Å; A1027-T1030 PolarHBondContact O-OG1 3.02Å; T1030-Y1033 PolarHBondContact O-N 3.39Å; T1030-L1034 WeakPolarHBondContact O-CB 3.41Å; T1030-L1034 PolarHBondContact O-N 2.97Å
1031	F	95.3	Very high	93.8	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-39	174.1	-80.8	-63.5	0	0	0	112.8	P1019 A1027 Y1033 L1034 C1035 I1059 I1069 L1079	P1019-F1031 HydrophobicContact CB-CZ 3.93Å; A1027-F1031 HydrophobicContact CB-CD2 4.42Å; A1027-F1031 HydrophobicContact CB-CE2 4.49Å; A1027-F1031 WeakPolarHBondContact O-CB 3.49Å; A1027-F1031 WeakPolarHBondContact O-CD2 3.41Å; A1027-F1031 PolarHBondContact O-N 3.33Å; F1031-Y1033 VanDerWaalsContact C-N 3.32Å; F1031-Y1033 PolarHBondContact O-N 2.92Å; F1031-L1034 HydrophobicContact CD1-CD2 4.33Å; F1031-L1034 PolarHBondContact O-N 3.43Å; F1031-C1035 PolarHBondContact O-N 3.17Å; F1031-C1035 PolarHBondContact O-SG 2.98Å; F1031-I1059 HydrophobicContact CE1-CG2 3.9Å; F1031-I1059 HydrophobicContact CZ-CG2 4.37Å; F1031-I1069 HydrophobicContact CB-CD1 4.19Å; F1031-I1069 HydrophobicContact CD1-CD1 4.07Å; F1031-I1069 HydrophobicContact CD2-CD1 3.37Å; F1031-I1069 HydrophobicContact CD2-CG1 3.66Å; F1031-I1069 HydrophobicContact CE1-CD1 4.27Å; F1031-I1069 HydrophobicContact CE2-CD1 3.62Å; F1031-I1069 HydrophobicContact CE2-CG1 3.84Å; F1031-I1069 HydrophobicContact CG-CD1 3.62Å; F1031-I1069 HydrophobicContact CG-CG1 4.37Å; F1031-I1069 HydrophobicContact CZ-CD1 4.07Å; F1031-L1079 HydrophobicContact CB-CD1 4.21Å; F1031-L1079 HydrophobicContact CD1-CD1 3.78Å; F1031-L1079 HydrophobicContact CD1-CD2 4.07Å; F1031-L1079 HydrophobicContact CE1-CD1 4.35Å; F1031-L1079 HydrophobicContact CG-CD1 4.08Å
1032	N	94.8	Very high	93.7	Very high	30 Å²	30	49.2 Å²	49.2	16%	0.16	25%	0.245	C	C	.	.	H	α-helix	trans	-59.9	-44.1	172.7	-87.8	-52.5	0	0	0	111.8	V1028 Q1029 C1035 D1036 C1075 R1078	V1028-N1032 WeakPolarHBondContact CG1-ND2 3.21Å; V1028-N1032 WeakPolarHBondContact O-CB 3.42Å; V1028-N1032 PolarHBondContact O-N 2.93Å; V1028-N1032 PolarHBondContact O-ND2 2.72Å; Q1029-N1032 PolarHBondContact O-N 3.09Å; N1032-C1035 PolarHBondContact O-N 3.35Å; N1032-D1036 PolarHBondContact O-N 3.5Å; N1032-C1075 WeakPolarHBondContact OD1-CB 3.46Å; N1032-R1078 PolarHBondContact O-NH1 3.32Å; N1032-R1078 PolarHBondContact OD1-NH1 3.49Å
1033	Y	97.1	Very high	93.5	Very high	20 Å²	20	46.8 Å²	46.8	8%	0.078	24%	0.237	C	C	.	.	H	α-helix	trans	-68.6	-38	176.8	-176.9	-135.3	0	0	0	112.6	M998 K999 W1014 Q1029 T1030 F1031 C1035 D1036 L1037	M998-Y1033 HydrophobicContact CB-CE1 4.05Å; M998-Y1033 WeakPolarHBondContact CB-OH 3.34Å; M998-Y1033 HydrophobicContact CE-CE1 3.89Å; K999-Y1033 HydrophobicContact CB-CD2 3.75Å; K999-Y1033 HydrophobicContact CB-CE1 4.47Å; K999-Y1033 HydrophobicContact CB-CE2 3.64Å; K999-Y1033 HydrophobicContact CB-CG 4.21Å; K999-Y1033 HydrophobicContact CD-CD2 3.62Å; K999-Y1033 HydrophobicContact CD-CE2 4.29Å; K999-Y1033 HydrophobicContact CD-CG 4.06Å; K999-Y1033 HydrophobicContact CG-CD2 3.8Å; K999-Y1033 HydrophobicContact CG-CE2 3.95Å; W1014-Y1033 AromaticContact CH2-CD1 3.58Å; W1014-Y1033 HydrophobicContact CH2-CD1 3.58Å; W1014-Y1033 HydrophobicContact CH2-CE1 4.32Å; W1014-Y1033 HydrophobicContact CH2-CG 4.37Å; W1014-Y1033 AromaticContact CZ2-CD1 3.82Å; W1014-Y1033 HydrophobicContact CZ2-CD1 3.82Å; W1014-Y1033 HydrophobicContact CZ3-CD1 4.04Å; W1014-Y1033 HydrophobicContact CZ3-CE1 4.38Å; Q1029-Y1033 PolarHBondContact O-N 3.13Å; T1030-Y1033 PolarHBondContact O-N 3.39Å; F1031-Y1033 VanDerWaalsContact C-N 3.32Å; F1031-Y1033 PolarHBondContact O-N 2.92Å; Y1033-C1035 VanDerWaalsContact C-N 3.29Å; Y1033-C1035 PolarHBondContact O-N 3.13Å; Y1033-D1036 HydrophobicContact CD2-CB 4.33Å; Y1033-D1036 WeakPolarHBondContact O-CB 3.45Å; Y1033-D1036 PolarHBondContact O-N 2.73Å; Y1033-D1036 VanDerWaalsContact O-N 3.14Å; Y1033-L1037 HydrophobicContact CD1-CD1 3.93Å; Y1033-L1037 HydrophobicContact CD2-CD1 4.32Å; Y1033-L1037 HydrophobicContact CD2-CG 4.18Å; Y1033-L1037 HydrophobicContact CE1-CD1 3.69Å; Y1033-L1037 HydrophobicContact CE1-CG 4.32Å; Y1033-L1037 HydrophobicContact CE2-CD1 4.12Å; Y1033-L1037 HydrophobicContact CE2-CD2 4.03Å; Y1033-L1037 HydrophobicContact CE2-CG 3.85Å; Y1033-L1037 HydrophobicContact CG-CD1 4.24Å; Y1033-L1037 VanDerWaalsContact O-CG 3.32Å; Y1033-L1037 WeakPolarHBondContact O-CG 3.43Å; Y1033-L1037 PolarHBondContact O-N 2.95Å
1034	L	96.6	Very high	93.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-42.2	173.2	-179.3	61	0	0	0	111.3	W1014 L1015 L1018 T1030 F1031 L1037 I1038 V1045 I1059	W1014-L1034 HydrophobicContact CH2-CB 4.4Å; L1015-L1034 HydrophobicContact CD1-CD1 3.79Å; L1018-L1034 HydrophobicContact CD1-CD2 4.18Å; T1030-L1034 WeakPolarHBondContact O-CB 3.41Å; T1030-L1034 PolarHBondContact O-N 2.97Å; F1031-L1034 HydrophobicContact CD1-CD2 4.33Å; F1031-L1034 PolarHBondContact O-N 3.43Å; L1034-L1037 WeakPolarHBondContact O-CB 3.32Å; L1034-L1037 PolarHBondContact O-N 3.12Å; L1034-I1038 HydrophobicContact CD1-CD1 4.06Å; L1034-I1038 HydrophobicContact CD1-CG1 4.42Å; L1034-I1038 HydrophobicContact CG-CD1 3.94Å; L1034-I1038 VanDerWaalsContact O-CG1 3.3Å; L1034-I1038 WeakPolarHBondContact O-CG1 3.37Å; L1034-I1038 PolarHBondContact O-N 3.09Å; L1034-V1045 HydrophobicContact CD1-CG2 4.09Å; L1034-I1059 HydrophobicContact CD2-CG2 4.18Å
1035	C	95.1	Very high	93.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-45.2	173.7	-65.9	0	0	0	0	111.5	F1031 N1032 Y1033 L1037 I1038 E1039 R1078 L1079	F1031-C1035 PolarHBondContact O-N 3.17Å; F1031-C1035 PolarHBondContact O-SG 2.98Å; N1032-C1035 PolarHBondContact O-N 3.35Å; Y1033-C1035 VanDerWaalsContact C-N 3.29Å; Y1033-C1035 PolarHBondContact O-N 3.13Å; C1035-L1037 PolarHBondContact O-N 3.35Å; C1035-I1038 PolarHBondContact O-N 3.31Å; C1035-I1038 VanDerWaalsContact O-N 3.16Å; C1035-E1039 VanDerWaalsContact O-CB 3.3Å; C1035-E1039 WeakPolarHBondContact O-CB 3.25Å; C1035-E1039 VanDerWaalsContact O-CG 3.27Å; C1035-E1039 WeakPolarHBondContact O-CG 3.5Å; C1035-E1039 PolarHBondContact O-N 2.9Å; C1035-R1078 HydrophobicContact CB-CB 4.12Å; C1035-L1079 WeakPolarHBondContact SG-CD2 3.29Å
1036	D	95.6	Very high	93.8	Very high	55 Å²	55	41.4 Å²	41.4	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-57.7	-39.5	177.2	-58.6	-26.1	0	0	0	111.6	K999 N1032 Y1033 S1040 R1078	K999-D1036 VanDerWaalsContact CE-OD2 3.28Å; K999-D1036 WeakPolarHBondContact CE-OD2 3.18Å; K999-D1036 IonicContact NZ-OD2 3.82Å; K999-D1036 PolarHBondContact NZ-OD2 3.26Å; N1032-D1036 PolarHBondContact O-N 3.5Å; Y1033-D1036 HydrophobicContact CD2-CB 4.33Å; Y1033-D1036 WeakPolarHBondContact O-CB 3.45Å; Y1033-D1036 PolarHBondContact O-N 2.73Å; Y1033-D1036 VanDerWaalsContact O-N 3.14Å; D1036-S1040 WeakPolarHBondContact O-CB 3.31Å; D1036-S1040 PolarHBondContact O-N 3.46Å; D1036-S1040 VanDerWaalsContact O-N 3.08Å; D1036-R1078 IonicContact OD1-CZ 3.18Å; D1036-R1078 VanDerWaalsContact OD1-CZ 3.31Å; D1036-R1078 IonicContact OD1-NH1 2.85Å; D1036-R1078 PolarHBondContact OD1-NH1 2.87Å; D1036-R1078 IonicContact OD1-NH2 2.96Å; D1036-R1078 PolarHBondContact OD1-NH2 3.2Å
1037	L	95.8	Very high	93.7	Very high	23 Å²	23	41.9 Å²	41.9	12%	0.12	22%	0.222	C	C	.	.	H	α-helix	trans	-68.3	-36.9	179	-71.6	162.8	0	0	0	112.8	L1011 W1014 Y1033 L1034 C1035 S1040 P1043 V1045	L1011-L1037 HydrophobicContact CD1-CD1 3.56Å; L1011-L1037 HydrophobicContact CD1-CD2 4.06Å; L1011-L1037 HydrophobicContact CD1-CG 4.43Å; L1011-L1037 HydrophobicContact CD2-CD2 4.19Å; W1014-L1037 HydrophobicContact CE3-CD1 4.38Å; W1014-L1037 HydrophobicContact CH2-CD1 4.43Å; W1014-L1037 HydrophobicContact CZ3-CD1 3.72Å; Y1033-L1037 HydrophobicContact CD1-CD1 3.93Å; Y1033-L1037 HydrophobicContact CD2-CD1 4.32Å; Y1033-L1037 HydrophobicContact CD2-CG 4.18Å; Y1033-L1037 HydrophobicContact CE1-CD1 3.69Å; Y1033-L1037 HydrophobicContact CE1-CG 4.32Å; Y1033-L1037 HydrophobicContact CE2-CD1 4.12Å; Y1033-L1037 HydrophobicContact CE2-CD2 4.03Å; Y1033-L1037 HydrophobicContact CE2-CG 3.85Å; Y1033-L1037 HydrophobicContact CG-CD1 4.24Å; Y1033-L1037 VanDerWaalsContact O-CG 3.32Å; Y1033-L1037 WeakPolarHBondContact O-CG 3.43Å; Y1033-L1037 PolarHBondContact O-N 2.95Å; L1034-L1037 WeakPolarHBondContact O-CB 3.32Å; L1034-L1037 PolarHBondContact O-N 3.12Å; C1035-L1037 PolarHBondContact O-N 3.35Å; L1037-S1040 WeakPolarHBondContact O-CB 3.48Å; L1037-P1043 WeakPolarHBondContact O-CB 3.34Å; L1037-V1045 HydrophobicContact CB-CB 4.06Å; L1037-V1045 HydrophobicContact CB-CG1 3.85Å; L1037-V1045 HydrophobicContact CB-CG2 4.41Å; L1037-V1045 WeakPolarHBondContact O-CG1 3.25Å
1038	I	93.9	Very high	93.7	Very high	20 Å²	20	47.2 Å²	47.2	10%	0.103	26%	0.256	C	S	.	.	H	α-helix	trans	-78	-39.1	179.2	-63.2	165.8	0	0	0	111.1	L1034 C1035 S1040 V1045 L1046 I1056 V1082	L1034-I1038 HydrophobicContact CD1-CD1 4.06Å; L1034-I1038 HydrophobicContact CD1-CG1 4.42Å; L1034-I1038 HydrophobicContact CG-CD1 3.94Å; L1034-I1038 VanDerWaalsContact O-CG1 3.3Å; L1034-I1038 WeakPolarHBondContact O-CG1 3.37Å; L1034-I1038 PolarHBondContact O-N 3.09Å; C1035-I1038 PolarHBondContact O-N 3.31Å; C1035-I1038 VanDerWaalsContact O-N 3.16Å; I1038-S1040 VanDerWaalsContact C-N 3.26Å; I1038-S1040 PolarHBondContact O-N 3.28Å; I1038-V1045 HydrophobicContact CG1-CG1 3.74Å; I1038-L1046 HydrophobicContact CG1-CD2 4.29Å; I1038-L1046 HydrophobicContact CG2-CD2 4.22Å; I1038-I1056 HydrophobicContact CD1-CD1 4.23Å; I1038-I1056 HydrophobicContact CD1-CG2 3.84Å; I1038-I1056 HydrophobicContact CG1-CD1 4.42Å; I1038-V1082 HydrophobicContact CB-CG1 4.5Å; I1038-V1082 HydrophobicContact CB-CG2 4.48Å; I1038-V1082 HydrophobicContact CD1-CG1 3.99Å; I1038-V1082 HydrophobicContact CG2-CB 4.48Å; I1038-V1082 HydrophobicContact CG2-CG1 3.62Å; I1038-V1082 HydrophobicContact CG2-CG2 3.99Å
1039	E	93.6	Very high	93.6	Very high	99 Å²	99	53.6 Å²	53.6	46%	0.463	29%	0.29	S	S	.	.	H	α-helix	trans	-76.9	-11.6	179.5	-67	170.3	-173.8	0	0	113	C1035 R1078 V1082	C1035-E1039 VanDerWaalsContact O-CB 3.3Å; C1035-E1039 WeakPolarHBondContact O-CB 3.25Å; C1035-E1039 VanDerWaalsContact O-CG 3.27Å; C1035-E1039 WeakPolarHBondContact O-CG 3.5Å; C1035-E1039 PolarHBondContact O-N 2.9Å; E1039-R1078 IonicContact OE1-CZ 3.9Å; E1039-R1078 IonicContact OE1-NE 3.26Å; E1039-R1078 PolarHBondContact OE1-NE 3.37Å; E1039-R1078 IonicContact OE1-NH2 3.64Å; E1039-R1078 IonicContact OE2-CZ 3.53Å; E1039-R1078 IonicContact OE2-NE 3.47Å; E1039-R1078 PolarHBondContact OE2-NE 3.29Å; E1039-R1078 IonicContact OE2-NH2 2.73Å; E1039-R1078 PolarHBondContact OE2-NH2 3.42Å; E1039-V1082 HydrophobicContact CG-CG2 4.49Å
1040	S	94.1	Very high	93.5	Very high	55 Å²	55	53.5 Å²	53.5	39%	0.385	29%	0.291	S	S	.	.	S	Bend	trans	-57.1	145.1	176.1	177.3	0	0	0	0	112.9	D1036 L1037 I1038 H1042 P1043	D1036-S1040 WeakPolarHBondContact O-CB 3.31Å; D1036-S1040 PolarHBondContact O-N 3.46Å; D1036-S1040 VanDerWaalsContact O-N 3.08Å; L1037-S1040 WeakPolarHBondContact O-CB 3.48Å; I1038-S1040 VanDerWaalsContact C-N 3.26Å; I1038-S1040 PolarHBondContact O-N 3.28Å; S1040-H1042 PolarHBondContact O-N 3.41Å; S1040-H1042 VanDerWaalsContact O-N 3.14Å; S1040-H1042 PolarHBondContact OG-N 3.46Å; S1040-P1043 WeakPolarHBondContact O-CD 3.46Å
1041	N	90.1	Very high	93.4	Very high	154 Å²	154	57.8 Å²	57.8	82%	0.824	32%	0.318	S	S	*	.	S	Bend	trans	-58.6	-25.8	174.9	-72.2	74.4	0	0	0	113.8
1042	H	90.1	Very high	93.4	Very high	155 Å²	155	60.2 Å²	60.2	72%	0.718	33%	0.331	S	S	*	.	S	Bend	trans	-127.6	82.3	174.8	-60.1	111.6	0	0	0	108.8	S1040 I1044	S1040-H1042 PolarHBondContact O-N 3.41Å; S1040-H1042 VanDerWaalsContact O-N 3.14Å; S1040-H1042 PolarHBondContact OG-N 3.46Å; H1042-I1044 VanDerWaalsContact C-N 3.32Å; H1042-I1044 PolarHBondContact O-N 2.72Å
1043	P	88	Confident	93.3	Very high	44 Å²	44	59.1 Å²	59.1	29%	0.286	33%	0.325	S	S	.	.			trans	-83.4	77.1	-169	34.6	-36.1	0	0	0	110.8	L1037 S1040 V1045 L1046	L1037-P1043 WeakPolarHBondContact O-CB 3.34Å; S1040-P1043 WeakPolarHBondContact O-CD 3.46Å; P1043-V1045 PolarHBondContact O-N 2.86Å; P1043-V1045 VanDerWaalsContact O-N 3.12Å; P1043-L1046 HydrophobicContact CB-CD1 3.86Å; P1043-L1046 HydrophobicContact CB-CG 3.99Å; P1043-L1046 HydrophobicContact CG-CD1 3.65Å; P1043-L1046 HydrophobicContact CG-CG 4.26Å; P1043-L1046 PolarHBondContact O-N 3.21Å; P1043-L1046 VanDerWaalsContact O-N 3.13Å
1044	I	91.9	Very high	93.1	Very high	91 Å²	91	58.4 Å²	58.4	47%	0.467	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-56.1	-30.5	179.7	-55.5	173.2	0	0	0	111	E1008 L1011 H1042 L1046 G1047	E1008-I1044 HydrophobicContact CG-CD1 3.77Å; E1008-I1044 VanDerWaalsContact OE1-CD1 3.28Å; E1008-I1044 WeakPolarHBondContact OE1-CD1 3.37Å; L1011-I1044 HydrophobicContact CD2-CB 4.34Å; L1011-I1044 HydrophobicContact CD2-CG2 4.47Å; H1042-I1044 VanDerWaalsContact C-N 3.32Å; H1042-I1044 PolarHBondContact O-N 2.72Å; I1044-L1046 PolarHBondContact O-N 2.9Å; I1044-G1047 PolarHBondContact O-N 2.92Å
1045	V	94	Very high	93	Very high	3 Å²	3	63 Å²	63	2%	0.018	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-57	-31.8	179.3	72.1	0	0	0	0	113.6	L1011 L1015 L1034 L1037 I1038 P1043 G1047 N1052	L1011-V1045 HydrophobicContact CD1-CG2 4.29Å; L1011-V1045 HydrophobicContact CD2-CB 4.13Å; L1015-V1045 HydrophobicContact CD1-CG2 3.96Å; L1015-V1045 HydrophobicContact CD2-CG2 3.92Å; L1015-V1045 HydrophobicContact CG-CG2 4.46Å; L1034-V1045 HydrophobicContact CD1-CG2 4.09Å; L1037-V1045 HydrophobicContact CB-CB 4.06Å; L1037-V1045 HydrophobicContact CB-CG1 3.85Å; L1037-V1045 HydrophobicContact CB-CG2 4.41Å; L1037-V1045 WeakPolarHBondContact O-CG1 3.25Å; I1038-V1045 HydrophobicContact CG1-CG1 3.74Å; P1043-V1045 PolarHBondContact O-N 2.86Å; P1043-V1045 VanDerWaalsContact O-N 3.12Å; V1045-G1047 PolarHBondContact O-N 3.08Å; V1045-N1052 WeakPolarHBondContact O-CB 3.46Å; V1045-N1052 PolarHBondContact O-ND2 3.04Å; V1045-N1052 VanDerWaalsContact O-ND2 3.09Å
1046	L	92.8	Very high	93	Very high	22 Å²	22	63 Å²	63	12%	0.115	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-68.9	-19.1	179.8	-60.9	-178.9	0	0	0	112.6	I1038 P1043 I1044 N1050 T1051 N1052 L1053 I1056	I1038-L1046 HydrophobicContact CG1-CD2 4.29Å; I1038-L1046 HydrophobicContact CG2-CD2 4.22Å; P1043-L1046 HydrophobicContact CB-CD1 3.86Å; P1043-L1046 HydrophobicContact CB-CG 3.99Å; P1043-L1046 HydrophobicContact CG-CD1 3.65Å; P1043-L1046 HydrophobicContact CG-CG 4.26Å; P1043-L1046 PolarHBondContact O-N 3.21Å; P1043-L1046 VanDerWaalsContact O-N 3.13Å; I1044-L1046 PolarHBondContact O-N 2.9Å; L1046-N1050 CarbonylContact O-C 3.15Å; L1046-N1050 WeakPolarHBondContact O-CA 3.17Å; L1046-T1051 PolarHBondContact O-N 3.48Å; L1046-N1052 WeakPolarHBondContact O-CB 3.37Å; L1046-N1052 PolarHBondContact O-N 3.48Å; L1046-L1053 HydrophobicContact CD2-CD1 3.93Å; L1046-I1056 HydrophobicContact CD2-CD1 3.84Å
1047	G	92.8	Very high	93	Very high	16 Å²	16	60.4 Å²	60.4	17%	0.165	33%	0.329	C	S	.	.			trans	73	162.9	-172.1	0	0	0	0	0	112.8	I1044 V1045 N1049 N1050	I1044-G1047 PolarHBondContact O-N 2.92Å; V1045-G1047 PolarHBondContact O-N 3.08Å; G1047-N1049 PolarHBondContact O-N 2.93Å; G1047-N1050 PolarHBondContact O-N 3.27Å
1048	P	91.9	Very high	93	Very high	111 Å²	111	60.5 Å²	60.5	72%	0.721	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-56.5	127.6	175.2	-22.2	33.1	0	0	0	110.7	N1050 T1051	P1048-N1050 VanDerWaalsContact C-N 3.29Å; P1048-N1050 PolarHBondContact O-N 3.39Å; P1048-T1051 VanDerWaalsContact O-CG2 3.26Å; P1048-T1051 WeakPolarHBondContact O-CG2 3.29Å; P1048-T1051 PolarHBondContact O-OG1 2.96Å
1049	N	92.1	Very high	93	Very high	158 Å²	158	59.6 Å²	59.6	85%	0.845	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	58.6	31.8	-175.4	-54.7	-48	0	0	0	115	G1047 T1051	G1047-N1049 PolarHBondContact O-N 2.93Å; N1049-T1051 VanDerWaalsContact C-N 3.26Å; N1049-T1051 PolarHBondContact O-N 3.06Å
1050	N	92.6	Very high	93	Very high	62 Å²	62	55 Å²	55	33%	0.332	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	62	26.5	175.8	-52.3	-34.3	0	0	0	114.3	L1046 G1047 P1048 N1052 L1053 L1092	L1046-N1050 CarbonylContact O-C 3.15Å; L1046-N1050 WeakPolarHBondContact O-CA 3.17Å; G1047-N1050 PolarHBondContact O-N 3.27Å; P1048-N1050 VanDerWaalsContact C-N 3.29Å; P1048-N1050 PolarHBondContact O-N 3.39Å; N1050-N1052 PolarHBondContact O-N 3.48Å; N1050-N1052 VanDerWaalsContact O-N 3.16Å; N1050-L1053 HydrophobicContact CB-CB 4.15Å; N1050-L1053 HydrophobicContact CB-CD2 4.3Å; N1050-L1053 WeakPolarHBondContact O-CB 3.36Å; N1050-L1053 PolarHBondContact O-N 3.36Å; N1050-L1092 HydrophobicContact CB-CD2 4.35Å
1051	T	93	Very high	92.9	Very high	93 Å²	93	52.3 Å²	52.3	57%	0.571	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-24	-176.4	50.4	0	0	0	0	114.2	L1046 P1048 N1049	L1046-T1051 PolarHBondContact O-N 3.48Å; P1048-T1051 VanDerWaalsContact O-CG2 3.26Å; P1048-T1051 WeakPolarHBondContact O-CG2 3.29Å; P1048-T1051 PolarHBondContact O-OG1 2.96Å; N1049-T1051 VanDerWaalsContact C-N 3.26Å; N1049-T1051 PolarHBondContact O-N 3.06Å
1052	N	94.7	Very high	92.8	Very high	53 Å²	53	47.6 Å²	47.6	28%	0.283	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.4	178.6	-61.7	-15.6	0	0	0	112.7	L1015 V1045 L1046 N1050 K1055 I1056	L1015-N1052 HydrophobicContact CD2-CB 4.11Å; V1045-N1052 WeakPolarHBondContact O-CB 3.46Å; V1045-N1052 PolarHBondContact O-ND2 3.04Å; V1045-N1052 VanDerWaalsContact O-ND2 3.09Å; L1046-N1052 WeakPolarHBondContact O-CB 3.37Å; L1046-N1052 PolarHBondContact O-N 3.48Å; N1050-N1052 PolarHBondContact O-N 3.48Å; N1050-N1052 VanDerWaalsContact O-N 3.16Å; N1052-K1055 WeakPolarHBondContact O-CB 3.33Å; N1052-K1055 PolarHBondContact O-N 3.04Å; N1052-K1055 VanDerWaalsContact O-N 3.1Å; N1052-I1056 WeakPolarHBondContact O-CG1 3.1Å; N1052-I1056 PolarHBondContact O-N 3.49Å
1053	L	93.5	Very high	92.4	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-39.3	-175.8	-170.3	67.1	0	0	0	113.4	L1046 N1050 K1055 I1056 F1057 V1086 L1092	L1046-L1053 HydrophobicContact CD2-CD1 3.93Å; N1050-L1053 HydrophobicContact CB-CB 4.15Å; N1050-L1053 HydrophobicContact CB-CD2 4.3Å; N1050-L1053 WeakPolarHBondContact O-CB 3.36Å; N1050-L1053 PolarHBondContact O-N 3.36Å; L1053-K1055 VanDerWaalsContact C-N 3.32Å; L1053-K1055 PolarHBondContact O-N 3.07Å; L1053-I1056 WeakPolarHBondContact O-CB 3.48Å; L1053-I1056 PolarHBondContact O-N 3.46Å; L1053-F1057 HydrophobicContact CD1-CD2 4.42Å; L1053-F1057 HydrophobicContact CD1-CE2 4.17Å; L1053-F1057 HydrophobicContact CG-CD2 4.3Å; L1053-F1057 HydrophobicContact CG-CE2 4.12Å; L1053-F1057 WeakPolarHBondContact O-CD2 3.5Å; L1053-F1057 PolarHBondContact O-N 3.1Å; L1053-V1086 HydrophobicContact CD1-CG2 4.26Å; L1053-V1086 HydrophobicContact CD2-CG1 3.92Å; L1053-V1086 HydrophobicContact CD2-CG2 3.82Å; L1053-V1086 HydrophobicContact CG-CG2 4.47Å; L1053-L1092 HydrophobicContact CD2-CD1 4.11Å; L1053-L1092 HydrophobicContact CD2-CD2 3.54Å; L1053-L1092 HydrophobicContact CD2-CG 3.81Å
1054	P	93.4	Very high	92	Very high	6 Å²	6	39 Å²	39	4%	0.039	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-38.4	173.1	-24.2	34.7	0	0	0	113.4	F1057 S1058	P1054-F1057 WeakPolarHBondContact O-CB 3.38Å; P1054-F1057 PolarHBondContact O-N 2.86Å; P1054-S1058 PolarHBondContact O-N 2.98Å; P1054-S1058 VanDerWaalsContact O-N 3.16Å; P1054-S1058 PolarHBondContact O-OG 3.48Å
1055	K	94.4	Very high	91.5	Very high	96 Å²	96	38.1 Å²	38.1	42%	0.417	21%	0.211	S	C	.	.	H	α-helix	trans	-66.7	-38	175.1	175.8	59.3	179.8	170.8	0	111.5	N1052 L1053 F1057 S1058 I1059	N1052-K1055 WeakPolarHBondContact O-CB 3.33Å; N1052-K1055 PolarHBondContact O-N 3.04Å; N1052-K1055 VanDerWaalsContact O-N 3.1Å; L1053-K1055 VanDerWaalsContact C-N 3.32Å; L1053-K1055 PolarHBondContact O-N 3.07Å; K1055-F1057 VanDerWaalsContact C-N 3.28Å; K1055-F1057 PolarHBondContact O-N 2.97Å; K1055-S1058 WeakPolarHBondContact O-CB 3.43Å; K1055-S1058 PolarHBondContact O-N 3.37Å; K1055-I1059 HydrophobicContact CD-CD1 4.43Å; K1055-I1059 HydrophobicContact CD-CG1 4.48Å; K1055-I1059 HydrophobicContact CG-CD1 4.11Å; K1055-I1059 WeakPolarHBondContact O-CG1 3.46Å; K1055-I1059 PolarHBondContact O-N 2.98Å
1056	I	95.6	Very high	90.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-41.1	173.4	-67.7	168.4	0	0	0	110.3	L1015 I1038 L1046 N1052 L1053 S1058 I1059 I1060	L1015-I1056 HydrophobicContact CD1-CG1 4.22Å; I1038-I1056 HydrophobicContact CD1-CD1 4.23Å; I1038-I1056 HydrophobicContact CD1-CG2 3.84Å; I1038-I1056 HydrophobicContact CG1-CD1 4.42Å; L1046-I1056 HydrophobicContact CD2-CD1 3.84Å; N1052-I1056 WeakPolarHBondContact O-CG1 3.1Å; N1052-I1056 PolarHBondContact O-N 3.49Å; L1053-I1056 WeakPolarHBondContact O-CB 3.48Å; L1053-I1056 PolarHBondContact O-N 3.46Å; I1056-S1058 VanDerWaalsContact C-N 3.35Å; I1056-S1058 PolarHBondContact O-N 2.71Å; I1056-I1059 WeakPolarHBondContact O-CB 3.4Å; I1056-I1059 PolarHBondContact O-N 3.33Å; I1056-I1060 HydrophobicContact CG2-CD1 3.94Å; I1056-I1060 HydrophobicContact CG2-CG1 4.43Å; I1056-I1060 WeakPolarHBondContact O-CG1 3.47Å; I1056-I1060 PolarHBondContact O-N 3.43Å
1057	F	95.1	Very high	90.2	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-42.6	174.5	-90.2	-121.8	0	0	0	112.4	L1053 P1054 K1055 I1059 I1060 A1061 V1083 V1086 W1093 C1096 I1097 L1100	L1053-F1057 HydrophobicContact CD1-CD2 4.42Å; L1053-F1057 HydrophobicContact CD1-CE2 4.17Å; L1053-F1057 HydrophobicContact CG-CD2 4.3Å; L1053-F1057 HydrophobicContact CG-CE2 4.12Å; L1053-F1057 WeakPolarHBondContact O-CD2 3.5Å; L1053-F1057 PolarHBondContact O-N 3.1Å; P1054-F1057 WeakPolarHBondContact O-CB 3.38Å; P1054-F1057 PolarHBondContact O-N 2.86Å; K1055-F1057 VanDerWaalsContact C-N 3.28Å; K1055-F1057 PolarHBondContact O-N 2.97Å; F1057-I1059 VanDerWaalsContact C-N 3.34Å; F1057-I1059 PolarHBondContact O-N 3.18Å; F1057-I1060 PolarHBondContact O-N 3.17Å; F1057-A1061 WeakPolarHBondContact O-CB 3.41Å; F1057-A1061 PolarHBondContact O-N 2.94Å; F1057-V1083 HydrophobicContact CE1-CG1 3.85Å; F1057-V1083 HydrophobicContact CZ-CB 4.41Å; F1057-V1083 HydrophobicContact CZ-CG1 3.89Å; F1057-V1083 HydrophobicContact CZ-CG2 4.45Å; F1057-V1086 HydrophobicContact CE2-CB 4.28Å; F1057-V1086 HydrophobicContact CE2-CG1 4.31Å; F1057-V1086 HydrophobicContact CE2-CG2 3.98Å; F1057-V1086 HydrophobicContact CZ-CB 3.92Å; F1057-V1086 HydrophobicContact CZ-CG1 4.02Å; F1057-V1086 HydrophobicContact CZ-CG2 4.1Å; F1057-W1093 AromaticContact CE1-CE3 3.97Å; F1057-W1093 HydrophobicContact CE1-CE3 3.97Å; F1057-W1093 HydrophobicContact CE1-CH2 4.36Å; F1057-W1093 AromaticContact CE1-CZ3 3.6Å; F1057-W1093 HydrophobicContact CE1-CZ3 3.6Å; F1057-W1093 HydrophobicContact CZ-CE3 4.07Å; F1057-W1093 AromaticContact CZ-CZ3 3.88Å; F1057-W1093 HydrophobicContact CZ-CZ3 3.88Å; F1057-C1096 HydrophobicContact CB-CB 4.4Å; F1057-C1096 HydrophobicContact CD1-CB 3.73Å; F1057-C1096 HydrophobicContact CD2-CB 4.01Å; F1057-C1096 HydrophobicContact CE1-CB 3.9Å; F1057-C1096 HydrophobicContact CE2-CB 4.19Å; F1057-C1096 HydrophobicContact CG-CB 3.78Å; F1057-C1096 HydrophobicContact CZ-CB 4.14Å; F1057-I1097 HydrophobicContact CD1-CD1 4.04Å; F1057-I1097 HydrophobicContact CE1-CD1 3.98Å; F1057-I1097 HydrophobicContact CE1-CG1 4.48Å; F1057-L1100 HydrophobicContact CB-CD1 4.4Å; F1057-L1100 HydrophobicContact CB-CD2 4.41Å; F1057-L1100 HydrophobicContact CD1-CD1 4.45Å
1058	S	94.9	Very high	89.4	Confident	25 Å²	25	47.5 Å²	47.5	18%	0.175	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-41.6	174.6	-52.6	0	0	0	0	112	P1054 K1055 I1056 I1060 A1061 E1062 L1100	P1054-S1058 PolarHBondContact O-N 2.98Å; P1054-S1058 VanDerWaalsContact O-N 3.16Å; P1054-S1058 PolarHBondContact O-OG 3.48Å; K1055-S1058 WeakPolarHBondContact O-CB 3.43Å; K1055-S1058 PolarHBondContact O-N 3.37Å; I1056-S1058 VanDerWaalsContact C-N 3.35Å; I1056-S1058 PolarHBondContact O-N 2.71Å; S1058-I1060 VanDerWaalsContact C-N 3.34Å; S1058-I1060 PolarHBondContact O-N 3.43Å; S1058-A1061 PolarHBondContact O-N 3.3Å; S1058-E1062 VanDerWaalsContact O-CG 3.24Å; S1058-E1062 WeakPolarHBondContact O-CG 3.24Å; S1058-E1062 PolarHBondContact O-N 2.99Å; S1058-L1100 WeakPolarHBondContact OG-CD2 3.21Å
1059	I	95.3	Very high	88.5	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-44	178.7	-69.1	162.5	0	0	0	111.1	L1015 L1018 P1019 F1031 L1034 K1055 I1056 F1057 G1063	L1015-I1059 HydrophobicContact CD1-CD1 3.9Å; L1015-I1059 HydrophobicContact CG-CD1 4.37Å; L1018-I1059 HydrophobicContact CB-CD1 3.9Å; L1018-I1059 HydrophobicContact CB-CG1 4.1Å; L1018-I1059 HydrophobicContact CB-CG2 3.77Å; L1018-I1059 HydrophobicContact CD1-CG2 4.43Å; P1019-I1059 HydrophobicContact CB-CG2 3.98Å; P1019-I1059 HydrophobicContact CG-CG2 4.34Å; F1031-I1059 HydrophobicContact CE1-CG2 3.9Å; F1031-I1059 HydrophobicContact CZ-CG2 4.37Å; L1034-I1059 HydrophobicContact CD2-CG2 4.18Å; K1055-I1059 HydrophobicContact CD-CD1 4.43Å; K1055-I1059 HydrophobicContact CD-CG1 4.48Å; K1055-I1059 HydrophobicContact CG-CD1 4.11Å; K1055-I1059 WeakPolarHBondContact O-CG1 3.46Å; K1055-I1059 PolarHBondContact O-N 2.98Å; I1056-I1059 WeakPolarHBondContact O-CB 3.4Å; I1056-I1059 PolarHBondContact O-N 3.33Å; F1057-I1059 VanDerWaalsContact C-N 3.34Å; F1057-I1059 PolarHBondContact O-N 3.18Å; I1059-G1063 PolarHBondContact O-N 2.97Å
1060	I	93.6	Very high	87.6	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-67.1	-42.9	178.9	-61.8	174.4	0	0	0	110.8	I1056 F1057 S1058 E1062 G1063 E1064 L1079 V1083 I1108 L1111	I1056-I1060 HydrophobicContact CG2-CD1 3.94Å; I1056-I1060 HydrophobicContact CG2-CG1 4.43Å; I1056-I1060 WeakPolarHBondContact O-CG1 3.47Å; I1056-I1060 PolarHBondContact O-N 3.43Å; F1057-I1060 PolarHBondContact O-N 3.17Å; S1058-I1060 VanDerWaalsContact C-N 3.34Å; S1058-I1060 PolarHBondContact O-N 3.43Å; I1060-E1062 PolarHBondContact O-N 2.94Å; I1060-G1063 PolarHBondContact O-N 3.49Å; I1060-E1064 PolarHBondContact O-N 2.9Å; I1060-L1079 HydrophobicContact CD1-CD2 3.99Å; I1060-L1079 HydrophobicContact CG1-CD2 4.02Å; I1060-L1079 HydrophobicContact CG2-CB 4.37Å; I1060-V1083 HydrophobicContact CD1-CG2 3.71Å; I1060-V1083 HydrophobicContact CG2-CG2 4.36Å; I1060-I1108 HydrophobicContact CB-CD1 4.14Å; I1060-I1108 HydrophobicContact CG2-CD1 3.86Å; I1060-L1111 HydrophobicContact CG2-CD2 3.42Å; I1060-L1111 VanDerWaalsContact CG2-CD2 3.42Å
1061	A	91.5	Very high	86.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-44.4	-180	0	0	0	0	0	112.5	F1057 S1058 G1063 E1064 M1065 Q1104 I1108	F1057-A1061 WeakPolarHBondContact O-CB 3.41Å; F1057-A1061 PolarHBondContact O-N 2.94Å; S1058-A1061 PolarHBondContact O-N 3.3Å; A1061-G1063 VanDerWaalsContact C-N 3.34Å; A1061-G1063 PolarHBondContact O-N 3.46Å; A1061-E1064 PolarHBondContact O-N 3.23Å; A1061-M1065 WeakPolarHBondContact O-CG 3.27Å; A1061-M1065 PolarHBondContact O-N 3.23Å; A1061-Q1104 HydrophobicContact CB-CB 3.73Å; A1061-Q1104 HydrophobicContact CB-CG 3.97Å; A1061-I1108 HydrophobicContact CB-CD1 3.98Å; A1061-I1108 HydrophobicContact CB-CG1 3.83Å
1062	E	87.8	Confident	85.8	Confident	55 Å²	55	46.2 Å²	46.2	26%	0.257	22%	0.219	S	C	.	.	H	α-helix	trans	-67.3	-33.1	179.6	-68.3	-70.8	168.8	0	0	112.7	P1019 S1058 I1060 E1064 M1065 H1066 Q1104	P1019-E1062 HydrophobicContact CG-CB 3.47Å; P1019-E1062 VanDerWaalsContact CG-CB 3.47Å; P1019-E1062 HydrophobicContact CG-CG 4.3Å; S1058-E1062 VanDerWaalsContact O-CG 3.24Å; S1058-E1062 WeakPolarHBondContact O-CG 3.24Å; S1058-E1062 PolarHBondContact O-N 2.99Å; I1060-E1062 PolarHBondContact O-N 2.94Å; E1062-E1064 VanDerWaalsContact C-N 3.32Å; E1062-M1065 PolarHBondContact O-N 3.25Å; E1062-H1066 PolarHBondContact O-N 3.31Å; E1062-H1066 PolarHBondContact O-ND1 2.85Å; E1062-H1066 IonicContact OE2-CE1 2.66Å; E1062-H1066 PolarHBondContact OE2-CE1 3.25Å; E1062-H1066 IonicContact OE2-ND1 3.45Å; E1062-Q1104 PolarHBondContact OE1-NE2 3.33Å
1063	G	80.6	Confident	85.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-37.5	175.2	0	0	0	0	0	112.7	I1059 I1060 A1061 E1067 A1068	I1059-G1063 PolarHBondContact O-N 2.97Å; I1060-G1063 PolarHBondContact O-N 3.49Å; A1061-G1063 VanDerWaalsContact C-N 3.34Å; A1061-G1063 PolarHBondContact O-N 3.46Å; G1063-E1067 PolarHBondContact O-N 2.78Å; G1063-A1068 VanDerWaalsContact O-CB 3.31Å; G1063-A1068 WeakPolarHBondContact O-CB 3.48Å; G1063-A1068 PolarHBondContact O-N 2.95Å
1064	E	80.4	Confident	85	Confident	18 Å²	18	49.6 Å²	49.6	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-74	-43.2	175.4	-66.4	-72.9	136.5	0	0	111.7	I1060 A1061 E1062 H1066 E1067 A1107 L1111	I1060-E1064 PolarHBondContact O-N 2.9Å; A1061-E1064 PolarHBondContact O-N 3.23Å; E1062-E1064 VanDerWaalsContact C-N 3.32Å; E1064-H1066 PolarHBondContact O-N 3.03Å; E1064-E1067 PolarHBondContact O-N 3.28Å; E1064-A1107 HydrophobicContact CB-CB 4.05Å; E1064-L1111 HydrophobicContact CG-CB 3.91Å; E1064-L1111 HydrophobicContact CG-CD1 4.46Å; E1064-L1111 HydrophobicContact CG-CD2 3.94Å; E1064-L1111 HydrophobicContact CG-CG 4.3Å; E1064-L1111 VanDerWaalsContact OE1-CD1 3.27Å; E1064-L1111 WeakPolarHBondContact OE1-CD1 3.27Å
1065	M	81.4	Confident	84.8	Confident	72 Å²	72	49.3 Å²	49.3	36%	0.355	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-31.2	179.6	-74.8	-173.3	65.2	0	0	113.7	A1061 E1062 E1103 Q1104 A1107	A1061-M1065 WeakPolarHBondContact O-CG 3.27Å; A1061-M1065 PolarHBondContact O-N 3.23Å; E1062-M1065 PolarHBondContact O-N 3.25Å; M1065-E1103 HydrophobicContact CE-CB 3.64Å; M1065-E1103 HydrophobicContact SD-CB 4.11Å; M1065-Q1104 HydrophobicContact SD-CB 4.41Å; M1065-Q1104 HydrophobicContact SD-CG 3.77Å; M1065-A1107 HydrophobicContact CG-CB 3.56Å
1066	H	80.7	Confident	84.5	Confident	80 Å²	80	44.8 Å²	44.8	37%	0.37	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	12.3	179.8	-63.1	86.1	0	0	0	112.8	H1021 K1024 E1062 E1064 A1068	H1021-H1066 HydrophobicContact CB-CB 3.67Å; K1024-H1066 PolarHBondContact NZ-O 3.37Å; E1062-H1066 PolarHBondContact O-N 3.31Å; E1062-H1066 PolarHBondContact O-ND1 2.85Å; E1062-H1066 IonicContact OE2-CE1 2.66Å; E1062-H1066 PolarHBondContact OE2-CE1 3.25Å; E1062-H1066 IonicContact OE2-ND1 3.45Å; E1064-H1066 PolarHBondContact O-N 3.03Å; H1066-A1068 PolarHBondContact O-N 3.3Å
1067	E	78.6	Confident	84.3	Confident	157 Å²	157	50.7 Å²	50.7	73%	0.734	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.2	38.3	-179	-56.7	177.5	-169.8	0	0	111.5	K1024 G1063 E1064 I1069	K1024-E1067 PolarHBondContact NZ-O 3.29Å; G1063-E1067 PolarHBondContact O-N 2.78Å; E1064-E1067 PolarHBondContact O-N 3.28Å; E1067-I1069 PolarHBondContact O-N 2.94Å
1068	A	75.4	Confident	84.2	Confident	2 Å²	2	53 Å²	53	2%	0.017	26%	0.255	C	S	.	.			trans	-73.2	-19.9	178.3	0	0	0	0	0	111.8	H1021 A1027 G1063 H1066	H1021-A1068 HydrophobicContact CB-CB 4.07Å; A1027-A1068 HydrophobicContact CB-CB 4.13Å; G1063-A1068 VanDerWaalsContact O-CB 3.31Å; G1063-A1068 WeakPolarHBondContact O-CB 3.48Å; G1063-A1068 PolarHBondContact O-N 2.95Å; H1066-A1068 PolarHBondContact O-N 3.3Å
1069	I	74.4	Confident	84.1	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.036	25%	0.247	C	C	.	.	S	Bend	trans	-128	130.2	179.1	-50.4	177.9	0	0	0	108	F1031 E1067 D1073 C1075 A1076 L1079	F1031-I1069 HydrophobicContact CB-CD1 4.19Å; F1031-I1069 HydrophobicContact CD1-CD1 4.07Å; F1031-I1069 HydrophobicContact CD2-CD1 3.37Å; F1031-I1069 HydrophobicContact CD2-CG1 3.66Å; F1031-I1069 HydrophobicContact CE1-CD1 4.27Å; F1031-I1069 HydrophobicContact CE2-CD1 3.62Å; F1031-I1069 HydrophobicContact CE2-CG1 3.84Å; F1031-I1069 HydrophobicContact CG-CD1 3.62Å; F1031-I1069 HydrophobicContact CG-CG1 4.37Å; F1031-I1069 HydrophobicContact CZ-CD1 4.07Å; E1067-I1069 PolarHBondContact O-N 2.94Å; I1069-D1073 HydrophobicContact CG2-CB 3.92Å; I1069-C1075 VanDerWaalsContact CG2-SG 3.52Å; I1069-A1076 HydrophobicContact CG2-CB 3.89Å; I1069-L1079 HydrophobicContact CD1-CD1 3.22Å
1070	K	72.7	Confident	83.9	Confident	121 Å²	121	51.8 Å²	51.8	53%	0.526	25%	0.247	S	C	.	.			trans	-88.9	152.1	175.2	-60.9	177.4	-177.5	172.3	0	109.8	E1072 D1073	K1070-E1072 HydrophobicContact CB-CG 3.82Å; K1070-E1072 HydrophobicContact CD-CG 4.42Å; K1070-E1072 WeakPolarHBondContact CD-OE1 3.39Å; K1070-E1072 PolarHBondContact O-N 3.4Å; K1070-D1073 PolarHBondContact N-OD2 3.11Å; K1070-D1073 WeakPolarHBondContact O-CB 3.44Å; K1070-D1073 PolarHBondContact O-N 3.42Å
1071	H	72.8	Confident	83.9	Confident	113 Å²	113	54.5 Å²	54.5	52%	0.523	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.5	176.6	-60.2	-47.8	0	0	0	114	D1073 S1114	H1071-D1073 VanDerWaalsContact C-N 3.33Å; H1071-S1114 PolarHBondContact CE1-OG 3.03Å; H1071-S1114 PolarHBondContact ND1-OG 3.18Å
1072	E	75.8	Confident	83.9	Confident	155 Å²	155	55 Å²	55	72%	0.724	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-17.6	175.9	61.2	-173.7	169.2	0	0	113.6	K1070	K1070-E1072 HydrophobicContact CB-CG 3.82Å; K1070-E1072 HydrophobicContact CD-CG 4.42Å; K1070-E1072 WeakPolarHBondContact CD-OE1 3.39Å; K1070-E1072 PolarHBondContact O-N 3.4Å
1073	D	83.7	Confident	84.1	Confident	36 Å²	36	52.4 Å²	52.4	19%	0.193	25%	0.252	C	S	.	.	S	Bend	trans	-70	133.9	-178.5	-70.2	-47.3	0	0	0	111.1	I1069 K1070 H1071 C1075 A1076	I1069-D1073 HydrophobicContact CG2-CB 3.92Å; K1070-D1073 PolarHBondContact N-OD2 3.11Å; K1070-D1073 WeakPolarHBondContact O-CB 3.44Å; K1070-D1073 PolarHBondContact O-N 3.42Å; H1071-D1073 VanDerWaalsContact C-N 3.33Å; D1073-C1075 PolarHBondContact O-N 3.47Å; D1073-C1075 VanDerWaalsContact O-N 3.09Å; D1073-A1076 WeakPolarHBondContact O-CB 3.4Å; D1073-A1076 PolarHBondContact O-N 2.97Å; D1073-A1076 VanDerWaalsContact O-N 3.12Å
1074	P	86.4	Confident	84.6	Confident	95 Å²	95	56.9 Å²	56.9	62%	0.617	27%	0.269	S	S	*	.	H	α-helix	trans	-59.4	-27.5	178.1	-18.5	27.5	0	0	0	112.9	R1078	P1074-R1078 PolarHBondContact O-N 3.39Å
1075	C	88.8	Confident	85.1	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-69.3	-31.4	-179.6	64.8	0	0	0	0	112.5	N1032 I1069 D1073 K1077 R1078 L1079	N1032-C1075 WeakPolarHBondContact OD1-CB 3.46Å; I1069-C1075 VanDerWaalsContact CG2-SG 3.52Å; D1073-C1075 PolarHBondContact O-N 3.47Å; D1073-C1075 VanDerWaalsContact O-N 3.09Å; C1075-K1077 VanDerWaalsContact C-N 3.29Å; C1075-K1077 PolarHBondContact O-N 2.84Å; C1075-R1078 WeakPolarHBondContact O-CB 3.42Å; C1075-R1078 PolarHBondContact O-N 3.13Å; C1075-L1079 VanDerWaalsContact O-CG 3.31Å; C1075-L1079 WeakPolarHBondContact O-CG 3.24Å; C1075-L1079 PolarHBondContact O-N 3.03Å
1076	A	89	Confident	85.6	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-55.6	-47.1	177.3	0	0	0	0	0	111	I1069 D1073 R1078 L1079 A1080 L1111 A1115	I1069-A1076 HydrophobicContact CG2-CB 3.89Å; D1073-A1076 WeakPolarHBondContact O-CB 3.4Å; D1073-A1076 PolarHBondContact O-N 2.97Å; D1073-A1076 VanDerWaalsContact O-N 3.12Å; A1076-R1078 PolarHBondContact O-N 2.93Å; A1076-L1079 PolarHBondContact O-N 3.1Å; A1076-A1080 WeakPolarHBondContact O-CB 3.47Å; A1076-A1080 PolarHBondContact O-N 3.22Å; A1076-L1111 HydrophobicContact CB-CD1 4.29Å; A1076-A1115 HydrophobicContact CB-CB 4.43Å
1077	K	90.9	Very high	86.1	Confident	125 Å²	125	60 Å²	60	54%	0.543	28%	0.284	S	S	.	.	H	α-helix	trans	-63.9	-38.3	175.9	-172.8	169	-168.8	170.8	0	113.2	C1075 N1081	C1075-K1077 VanDerWaalsContact C-N 3.29Å; C1075-K1077 PolarHBondContact O-N 2.84Å; K1077-N1081 WeakPolarHBondContact O-CB 3.44Å; K1077-N1081 PolarHBondContact O-N 3.11Å; K1077-N1081 PolarHBondContact O-ND2 3.48Å
1078	R	94.2	Very high	86.7	Confident	49 Å²	49	58.4 Å²	58.4	19%	0.185	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-46.6	177.1	-66	178.4	68.1	-165.2	6	110.8	N1032 C1035 D1036 E1039 P1074 C1075 A1076 N1081 V1082	N1032-R1078 PolarHBondContact O-NH1 3.32Å; N1032-R1078 PolarHBondContact OD1-NH1 3.49Å; C1035-R1078 HydrophobicContact CB-CB 4.12Å; D1036-R1078 IonicContact OD1-CZ 3.18Å; D1036-R1078 VanDerWaalsContact OD1-CZ 3.31Å; D1036-R1078 IonicContact OD1-NH1 2.85Å; D1036-R1078 PolarHBondContact OD1-NH1 2.87Å; D1036-R1078 IonicContact OD1-NH2 2.96Å; D1036-R1078 PolarHBondContact OD1-NH2 3.2Å; E1039-R1078 IonicContact OE1-CZ 3.9Å; E1039-R1078 IonicContact OE1-NE 3.26Å; E1039-R1078 PolarHBondContact OE1-NE 3.37Å; E1039-R1078 IonicContact OE1-NH2 3.64Å; E1039-R1078 IonicContact OE2-CZ 3.53Å; E1039-R1078 IonicContact OE2-NE 3.47Å; E1039-R1078 PolarHBondContact OE2-NE 3.29Å; E1039-R1078 IonicContact OE2-NH2 2.73Å; E1039-R1078 PolarHBondContact OE2-NH2 3.42Å; P1074-R1078 PolarHBondContact O-N 3.39Å; C1075-R1078 WeakPolarHBondContact O-CB 3.42Å; C1075-R1078 PolarHBondContact O-N 3.13Å; A1076-R1078 PolarHBondContact O-N 2.93Å; R1078-N1081 WeakPolarHBondContact O-CB 3.44Å; R1078-N1081 PolarHBondContact O-N 3.02Å; R1078-V1082 WeakPolarHBondContact O-CG2 3.35Å; R1078-V1082 PolarHBondContact O-N 3.43Å
1079	L	92.8	Very high	87.4	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-47.1	176.7	-66.6	171.3	0	0	0	111.7	F1031 C1035 I1060 I1069 C1075 A1076 N1081 V1082 V1083 L1111	F1031-L1079 HydrophobicContact CB-CD1 4.21Å; F1031-L1079 HydrophobicContact CD1-CD1 3.78Å; F1031-L1079 HydrophobicContact CD1-CD2 4.07Å; F1031-L1079 HydrophobicContact CE1-CD1 4.35Å; F1031-L1079 HydrophobicContact CG-CD1 4.08Å; C1035-L1079 WeakPolarHBondContact SG-CD2 3.29Å; I1060-L1079 HydrophobicContact CD1-CD2 3.99Å; I1060-L1079 HydrophobicContact CG1-CD2 4.02Å; I1060-L1079 HydrophobicContact CG2-CB 4.37Å; I1069-L1079 HydrophobicContact CD1-CD1 3.22Å; C1075-L1079 VanDerWaalsContact O-CG 3.31Å; C1075-L1079 WeakPolarHBondContact O-CG 3.24Å; C1075-L1079 PolarHBondContact O-N 3.03Å; A1076-L1079 PolarHBondContact O-N 3.1Å; L1079-N1081 VanDerWaalsContact C-N 3.29Å; L1079-N1081 PolarHBondContact O-N 3.03Å; L1079-V1082 WeakPolarHBondContact O-CB 3.37Å; L1079-V1082 PolarHBondContact O-N 2.7Å; L1079-V1082 VanDerWaalsContact O-N 3.17Å; L1079-V1083 WeakPolarHBondContact O-CG2 3.27Å; L1079-V1083 PolarHBondContact O-N 3.27Å; L1079-L1111 HydrophobicContact CB-CD2 4.26Å
1080	A	91.1	Very high	88.1	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-41.2	175.6	0	0	0	0	0	111.9	A1076 V1083 R1084 L1111 L1112 A1115	A1076-A1080 WeakPolarHBondContact O-CB 3.47Å; A1076-A1080 PolarHBondContact O-N 3.22Å; A1080-V1083 PolarHBondContact O-N 3.16Å; A1080-R1084 WeakPolarHBondContact O-CB 3.19Å; A1080-R1084 PolarHBondContact O-N 3.43Å; A1080-L1111 HydrophobicContact CB-CD1 4.29Å; A1080-L1111 HydrophobicContact CB-CG 4.16Å; A1080-L1112 HydrophobicContact CB-CD2 4.45Å; A1080-A1115 HydrophobicContact CB-CB 3.85Å
1081	N	93.2	Very high	88.9	Confident	59 Å²	59	60 Å²	60	32%	0.316	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-41.7	176.1	-73.3	-35.3	0	0	0	112.6	K1077 R1078 L1079 R1084 Q1085	K1077-N1081 WeakPolarHBondContact O-CB 3.44Å; K1077-N1081 PolarHBondContact O-N 3.11Å; K1077-N1081 PolarHBondContact O-ND2 3.48Å; R1078-N1081 WeakPolarHBondContact O-CB 3.44Å; R1078-N1081 PolarHBondContact O-N 3.02Å; L1079-N1081 VanDerWaalsContact C-N 3.29Å; L1079-N1081 PolarHBondContact O-N 3.03Å; N1081-R1084 PolarHBondContact O-N 3.44Å; N1081-R1084 PolarHBondContact OD1-NH1 3.27Å; N1081-Q1085 WeakPolarHBondContact O-CG 3.43Å; N1081-Q1085 PolarHBondContact O-N 3.38Å
1082	V	90.7	Very high	89.7	Confident	9 Å²	9	56.2 Å²	56.2	6%	0.055	31%	0.312	C	S	.	.	H	α-helix	trans	-59.1	-48.5	174.6	168.6	0	0	0	0	110.4	I1038 E1039 R1078 L1079 Q1085	I1038-V1082 HydrophobicContact CB-CG1 4.5Å; I1038-V1082 HydrophobicContact CB-CG2 4.48Å; I1038-V1082 HydrophobicContact CD1-CG1 3.99Å; I1038-V1082 HydrophobicContact CG2-CB 4.48Å; I1038-V1082 HydrophobicContact CG2-CG1 3.62Å; I1038-V1082 HydrophobicContact CG2-CG2 3.99Å; E1039-V1082 HydrophobicContact CG-CG2 4.49Å; R1078-V1082 WeakPolarHBondContact O-CG2 3.35Å; R1078-V1082 PolarHBondContact O-N 3.43Å; L1079-V1082 WeakPolarHBondContact O-CB 3.37Å; L1079-V1082 PolarHBondContact O-N 2.7Å; L1079-V1082 VanDerWaalsContact O-N 3.17Å; V1082-Q1085 PolarHBondContact O-N 3Å
1083	V	91.9	Very high	90.6	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-44	178.4	174.5	0	0	0	0	111.3	F1057 I1060 L1079 A1080 Q1085 V1086 W1093 I1108 L1112	F1057-V1083 HydrophobicContact CE1-CG1 3.85Å; F1057-V1083 HydrophobicContact CZ-CB 4.41Å; F1057-V1083 HydrophobicContact CZ-CG1 3.89Å; F1057-V1083 HydrophobicContact CZ-CG2 4.45Å; I1060-V1083 HydrophobicContact CD1-CG2 3.71Å; I1060-V1083 HydrophobicContact CG2-CG2 4.36Å; L1079-V1083 WeakPolarHBondContact O-CG2 3.27Å; L1079-V1083 PolarHBondContact O-N 3.27Å; A1080-V1083 PolarHBondContact O-N 3.16Å; V1083-Q1085 VanDerWaalsContact C-N 3.32Å; V1083-Q1085 PolarHBondContact O-N 3.43Å; V1083-V1086 WeakPolarHBondContact O-CB 3.43Å; V1083-V1086 PolarHBondContact O-N 3.12Å; V1083-V1086 VanDerWaalsContact O-N 3.17Å; V1083-W1093 HydrophobicContact CG1-CH2 4.12Å; V1083-W1093 HydrophobicContact CG1-CZ3 3.75Å; V1083-I1108 HydrophobicContact CG1-CG2 3.97Å; V1083-L1112 HydrophobicContact CB-CD2 4.27Å; V1083-L1112 HydrophobicContact CG1-CD1 4.04Å; V1083-L1112 HydrophobicContact CG1-CD2 4.05Å; V1083-L1112 HydrophobicContact CG1-CG 4.25Å
1084	R	91.3	Very high	91	Very high	94 Å²	94	54.1 Å²	54.1	36%	0.355	31%	0.305	S	S	.	.	H	α-helix	trans	-63.7	-34.2	180	-167.5	178.7	-69.6	143.1	-3.5	112.3	A1080 N1081 V1086 Q1087 L1112 A1115	A1080-R1084 WeakPolarHBondContact O-CB 3.19Å; A1080-R1084 PolarHBondContact O-N 3.43Å; N1081-R1084 PolarHBondContact O-N 3.44Å; N1081-R1084 PolarHBondContact OD1-NH1 3.27Å; R1084-V1086 VanDerWaalsContact C-N 3.27Å; R1084-V1086 PolarHBondContact O-N 3.43Å; R1084-Q1087 WeakPolarHBondContact O-CB 3.16Å; R1084-Q1087 PolarHBondContact O-N 2.95Å; R1084-L1112 HydrophobicContact CB-CD2 4.04Å; R1084-L1112 PolarHBondContact NH2-O 2.99Å; R1084-A1115 PolarHBondContact NH2-O 3.42Å
1085	Q	91.9	Very high	91.2	Very high	134 Å²	134	54.5 Å²	54.5	63%	0.626	30%	0.298	S	S	*	.	H	α-helix	trans	-61.8	-35.2	175.6	-77.8	177.6	20.7	0	0	112.4	N1081 V1082 V1083 Q1087 T1088	N1081-Q1085 WeakPolarHBondContact O-CG 3.43Å; N1081-Q1085 PolarHBondContact O-N 3.38Å; V1082-Q1085 PolarHBondContact O-N 3Å; V1083-Q1085 VanDerWaalsContact C-N 3.32Å; V1083-Q1085 PolarHBondContact O-N 3.43Å; Q1085-Q1087 VanDerWaalsContact C-N 3.27Å; Q1085-Q1087 PolarHBondContact O-N 3.45Å; Q1085-T1088 PolarHBondContact O-N 3.1Å; Q1085-T1088 PolarHBondContact O-OG1 3.04Å
1086	V	92.3	Very high	91.4	Very high	15 Å²	15	54.5 Å²	54.5	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-68.2	-26.4	180	-176.6	0	0	0	0	112.1	L1053 F1057 V1083 R1084 T1088 S1089 L1092 W1093	L1053-V1086 HydrophobicContact CD1-CG2 4.26Å; L1053-V1086 HydrophobicContact CD2-CG1 3.92Å; L1053-V1086 HydrophobicContact CD2-CG2 3.82Å; L1053-V1086 HydrophobicContact CG-CG2 4.47Å; F1057-V1086 HydrophobicContact CE2-CB 4.28Å; F1057-V1086 HydrophobicContact CE2-CG1 4.31Å; F1057-V1086 HydrophobicContact CE2-CG2 3.98Å; F1057-V1086 HydrophobicContact CZ-CB 3.92Å; F1057-V1086 HydrophobicContact CZ-CG1 4.02Å; F1057-V1086 HydrophobicContact CZ-CG2 4.1Å; V1083-V1086 WeakPolarHBondContact O-CB 3.43Å; V1083-V1086 PolarHBondContact O-N 3.12Å; V1083-V1086 VanDerWaalsContact O-N 3.17Å; R1084-V1086 VanDerWaalsContact C-N 3.27Å; R1084-V1086 PolarHBondContact O-N 3.43Å; V1086-T1088 PolarHBondContact O-N 2.95Å; V1086-T1088 VanDerWaalsContact O-N 3.1Å; V1086-S1089 PolarHBondContact O-N 3.46Å; V1086-L1092 HydrophobicContact CG1-CD2 4.24Å; V1086-L1092 HydrophobicContact CG1-CG 4.05Å; V1086-W1093 HydrophobicContact CB-CE3 4.37Å; V1086-W1093 HydrophobicContact CG1-CE3 4.38Å
1087	Q	89.9	Confident	91.7	Very high	86 Å²	86	56 Å²	56	40%	0.402	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.3	176.4	-64.4	-178.7	-28.1	0	0	113	R1084 Q1085 S1089 W1093	R1084-Q1087 WeakPolarHBondContact O-CB 3.16Å; R1084-Q1087 PolarHBondContact O-N 2.95Å; Q1085-Q1087 VanDerWaalsContact C-N 3.27Å; Q1085-Q1087 PolarHBondContact O-N 3.45Å; Q1087-S1089 PolarHBondContact O-N 3.15Å; Q1087-W1093 HydrophobicContact CB-CD2 4.4Å; Q1087-W1093 HydrophobicContact CB-CE3 4.27Å; Q1087-W1093 HydrophobicContact CG-CD2 3.75Å; Q1087-W1093 HydrophobicContact CG-CE3 3.43Å; Q1087-W1093 VanDerWaalsContact CG-CE3 3.43Å; Q1087-W1093 HydrophobicContact CG-CH2 3.69Å; Q1087-W1093 HydrophobicContact CG-CZ2 3.97Å; Q1087-W1093 HydrophobicContact CG-CZ3 3.39Å
1088	T	91.4	Very high	91.7	Very high	124 Å²	124	53.7 Å²	53.7	76%	0.761	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.9	176.5	66.7	0	0	0	0	112.9	Q1085 V1086	Q1085-T1088 PolarHBondContact O-N 3.1Å; Q1085-T1088 PolarHBondContact O-OG1 3.04Å; V1086-T1088 PolarHBondContact O-N 2.95Å; V1086-T1088 VanDerWaalsContact O-N 3.1Å
1089	S	90.8	Very high	91.7	Very high	58 Å²	58	56.7 Å²	56.7	41%	0.406	33%	0.326	S	S	.	.	S	Bend	trans	-104.2	80.7	178.3	-65.5	0	0	0	0	110.5	V1086 Q1087 G1091 L1092 W1093	V1086-S1089 PolarHBondContact O-N 3.46Å; Q1087-S1089 PolarHBondContact O-N 3.15Å; S1089-G1091 VanDerWaalsContact C-N 3.3Å; S1089-G1091 PolarHBondContact O-N 3.2Å; S1089-G1091 VanDerWaalsContact O-N 3.08Å; S1089-L1092 PolarHBondContact O-N 3.4Å; S1089-W1093 PolarHBondContact O-N 3.36Å
1090	G	87.5	Confident	91.7	Very high	45 Å²	45	57.1 Å²	57.1	46%	0.464	33%	0.329	S	S	.	.	H	α-helix	trans	-51.8	-38.2	-168.8	0	0	0	0	0	116.3	T1094	G1090-T1094 WeakPolarHBondContact O-CB 3.49Å; G1090-T1094 PolarHBondContact O-N 3.38Å; G1090-T1094 VanDerWaalsContact O-N 3.13Å; G1090-T1094 PolarHBondContact O-OG1 3.32Å
1091	G	90.4	Very high	91.9	Very high	60 Å²	60	59.3 Å²	59.3	62%	0.619	34%	0.343	S	S	*	.	H	α-helix	trans	-66.5	-45.5	175.6	0	0	0	0	0	113.1	S1089 T1094 E1095	S1089-G1091 VanDerWaalsContact C-N 3.3Å; S1089-G1091 PolarHBondContact O-N 3.2Å; S1089-G1091 VanDerWaalsContact O-N 3.08Å; G1091-T1094 PolarHBondContact O-N 3.33Å; G1091-E1095 PolarHBondContact O-N 3.27Å
1092	L	90.5	Very high	91.8	Very high	35 Å²	35	61.6 Å²	61.6	18%	0.183	36%	0.362	C	S	.	.	H	α-helix	trans	-69.5	-38.7	179.6	-174.4	60.8	0	0	0	111.8	N1050 L1053 V1086 S1089 E1095 C1096	N1050-L1092 HydrophobicContact CB-CD2 4.35Å; L1053-L1092 HydrophobicContact CD2-CD1 4.11Å; L1053-L1092 HydrophobicContact CD2-CD2 3.54Å; L1053-L1092 HydrophobicContact CD2-CG 3.81Å; V1086-L1092 HydrophobicContact CG1-CD2 4.24Å; V1086-L1092 HydrophobicContact CG1-CG 4.05Å; S1089-L1092 PolarHBondContact O-N 3.4Å; L1092-E1095 PolarHBondContact O-N 3.3Å; L1092-C1096 PolarHBondContact O-N 3.21Å; L1092-C1096 PolarHBondContact O-SG 2.94Å
1093	W	92.9	Very high	91.9	Very high	57 Å²	57	67.7 Å²	67.7	22%	0.216	39%	0.39	C	S	.	.	H	α-helix	trans	-58.9	-47.1	173.1	174	-101.7	0	0	0	111.9	F1057 V1083 V1086 Q1087 S1089 E1095 C1096 I1097 L1112	F1057-W1093 AromaticContact CE1-CE3 3.97Å; F1057-W1093 HydrophobicContact CE1-CE3 3.97Å; F1057-W1093 HydrophobicContact CE1-CH2 4.36Å; F1057-W1093 AromaticContact CE1-CZ3 3.6Å; F1057-W1093 HydrophobicContact CE1-CZ3 3.6Å; F1057-W1093 HydrophobicContact CZ-CE3 4.07Å; F1057-W1093 AromaticContact CZ-CZ3 3.88Å; F1057-W1093 HydrophobicContact CZ-CZ3 3.88Å; V1083-W1093 HydrophobicContact CG1-CH2 4.12Å; V1083-W1093 HydrophobicContact CG1-CZ3 3.75Å; V1086-W1093 HydrophobicContact CB-CE3 4.37Å; V1086-W1093 HydrophobicContact CG1-CE3 4.38Å; Q1087-W1093 HydrophobicContact CB-CD2 4.4Å; Q1087-W1093 HydrophobicContact CB-CE3 4.27Å; Q1087-W1093 HydrophobicContact CG-CD2 3.75Å; Q1087-W1093 HydrophobicContact CG-CE3 3.43Å; Q1087-W1093 VanDerWaalsContact CG-CE3 3.43Å; Q1087-W1093 HydrophobicContact CG-CH2 3.69Å; Q1087-W1093 HydrophobicContact CG-CZ2 3.97Å; Q1087-W1093 HydrophobicContact CG-CZ3 3.39Å; S1089-W1093 PolarHBondContact O-N 3.36Å; W1093-E1095 VanDerWaalsContact C-N 3.32Å; W1093-E1095 PolarHBondContact O-N 3.04Å; W1093-C1096 PolarHBondContact O-N 3.08Å; W1093-I1097 HydrophobicContact CD2-CG1 3.94Å; W1093-I1097 HydrophobicContact CE3-CG1 4.3Å; W1093-I1097 HydrophobicContact CH2-CD1 3.8Å; W1093-I1097 HydrophobicContact CH2-CG1 4.05Å; W1093-I1097 HydrophobicContact CZ2-CD1 3.79Å; W1093-I1097 HydrophobicContact CZ2-CG1 3.66Å; W1093-I1097 HydrophobicContact CZ3-CD1 4.27Å; W1093-I1097 HydrophobicContact CZ3-CG1 4.36Å; W1093-I1097 WeakPolarHBondContact O-CB 3.49Å; W1093-I1097 WeakPolarHBondContact O-CG1 3.42Å; W1093-I1097 PolarHBondContact O-N 3.23Å; W1093-L1112 HydrophobicContact CH2-CD1 4.02Å
1094	T	92	Very high	91.9	Very high	90 Å²	90	68.8 Å²	68.8	55%	0.552	40%	0.395	S	S	*	.	H	α-helix	trans	-64.8	-39.7	-179.8	-57.1	0	0	0	0	111	G1090 G1091 A1098	G1090-T1094 WeakPolarHBondContact O-CB 3.49Å; G1090-T1094 PolarHBondContact O-N 3.38Å; G1090-T1094 VanDerWaalsContact O-N 3.13Å; G1090-T1094 PolarHBondContact O-OG1 3.32Å; G1091-T1094 PolarHBondContact O-N 3.33Å; T1094-A1098 WeakPolarHBondContact O-CB 3.29Å; T1094-A1098 PolarHBondContact O-N 3.14Å
1095	E	92.4	Very high	92	Very high	103 Å²	103	67.2 Å²	67.2	48%	0.481	39%	0.391	S	S	.	.	H	α-helix	trans	-62.3	-46.4	175.4	-176.9	178	178.8	0	0	112.4	G1091 L1092 W1093 Q1099	G1091-E1095 PolarHBondContact O-N 3.27Å; L1092-E1095 PolarHBondContact O-N 3.3Å; W1093-E1095 VanDerWaalsContact C-N 3.32Å; W1093-E1095 PolarHBondContact O-N 3.04Å; E1095-Q1099 WeakPolarHBondContact O-CG 3.04Å
1096	C	93	Very high	91.9	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-66.1	-45.9	-179.3	-63	0	0	0	0	111.8	F1057 L1092 W1093	F1057-C1096 HydrophobicContact CB-CB 4.4Å; F1057-C1096 HydrophobicContact CD1-CB 3.73Å; F1057-C1096 HydrophobicContact CD2-CB 4.01Å; F1057-C1096 HydrophobicContact CE1-CB 3.9Å; F1057-C1096 HydrophobicContact CE2-CB 4.19Å; F1057-C1096 HydrophobicContact CG-CB 3.78Å; F1057-C1096 HydrophobicContact CZ-CB 4.14Å; L1092-C1096 PolarHBondContact O-N 3.21Å; L1092-C1096 PolarHBondContact O-SG 2.94Å; W1093-C1096 PolarHBondContact O-N 3.08Å
1097	I	93.5	Very high	91.9	Very high	32 Å²	32	62.6 Å²	62.6	16%	0.164	38%	0.378	C	S	.	.	H	α-helix	trans	-69.9	-37.4	-178.6	-66.2	-63.6	0	0	0	112.1	F1057 W1093 Q1099 L1100 Q1105 I1108	F1057-I1097 HydrophobicContact CD1-CD1 4.04Å; F1057-I1097 HydrophobicContact CE1-CD1 3.98Å; F1057-I1097 HydrophobicContact CE1-CG1 4.48Å; W1093-I1097 HydrophobicContact CD2-CG1 3.94Å; W1093-I1097 HydrophobicContact CE3-CG1 4.3Å; W1093-I1097 HydrophobicContact CH2-CD1 3.8Å; W1093-I1097 HydrophobicContact CH2-CG1 4.05Å; W1093-I1097 HydrophobicContact CZ2-CD1 3.79Å; W1093-I1097 HydrophobicContact CZ2-CG1 3.66Å; W1093-I1097 HydrophobicContact CZ3-CD1 4.27Å; W1093-I1097 HydrophobicContact CZ3-CG1 4.36Å; W1093-I1097 WeakPolarHBondContact O-CB 3.49Å; W1093-I1097 WeakPolarHBondContact O-CG1 3.42Å; W1093-I1097 PolarHBondContact O-N 3.23Å; I1097-Q1099 PolarHBondContact O-N 2.9Å; I1097-L1100 HydrophobicContact CD1-CD1 4.23Å; I1097-L1100 WeakPolarHBondContact O-CB 3.38Å; I1097-L1100 PolarHBondContact O-N 2.91Å; I1097-L1100 VanDerWaalsContact O-N 3.12Å; I1097-Q1105 HydrophobicContact CG2-CG 4.17Å; I1097-Q1105 PolarHBondContact O-NE2 3.48Å; I1097-I1108 HydrophobicContact CD1-CG2 4.24Å
1098	A	92.8	Very high	92	Very high	76 Å²	76	58.6 Å²	58.6	63%	0.628	36%	0.359	S	S	*	.	H	α-helix	trans	-66.7	-17.6	-177.7	0	0	0	0	0	114	T1094	T1094-A1098 WeakPolarHBondContact O-CB 3.29Å; T1094-A1098 PolarHBondContact O-N 3.14Å
1099	Q	92.6	Very high	91.9	Very high	113 Å²	113	58.3 Å²	58.3	53%	0.528	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-10.6	176.8	-67	-178.4	21	0	0	113.3	E1095 I1097	E1095-Q1099 WeakPolarHBondContact O-CG 3.04Å; I1097-Q1099 PolarHBondContact O-N 2.9Å
1100	L	94.1	Very high	91.9	Very high	9 Å²	9	61 Å²	61	5%	0.047	36%	0.355	C	S	.	.	S	Bend	trans	-87.1	147.6	179.8	-59.8	-177	0	0	0	111.7	F1057 S1058 I1097 Q1104 Q1105 I1108	F1057-L1100 HydrophobicContact CB-CD1 4.4Å; F1057-L1100 HydrophobicContact CB-CD2 4.41Å; F1057-L1100 HydrophobicContact CD1-CD1 4.45Å; S1058-L1100 WeakPolarHBondContact OG-CD2 3.21Å; I1097-L1100 HydrophobicContact CD1-CD1 4.23Å; I1097-L1100 WeakPolarHBondContact O-CB 3.38Å; I1097-L1100 PolarHBondContact O-N 2.91Å; I1097-L1100 VanDerWaalsContact O-N 3.12Å; L1100-Q1104 HydrophobicContact CB-CB 3.91Å; L1100-Q1104 HydrophobicContact CD2-CB 4.38Å; L1100-Q1104 HydrophobicContact CG-CB 4.5Å; L1100-Q1105 HydrophobicContact CB-CG 3.79Å; L1100-Q1105 PolarHBondContact O-NE2 3Å; L1100-I1108 HydrophobicContact CD1-CG1 3.91Å
1101	S	94.1	Very high	91.9	Very high	45 Å²	45	58.9 Å²	58.9	32%	0.315	33%	0.333	S	S	.	.			trans	-66	161.3	169.2	79.6	0	0	0	0	111.3	E1103 Q1104 Q1105	S1101-E1103 PolarHBondContact O-N 3.29Å; S1101-Q1104 PolarHBondContact O-N 3.31Å; S1101-Q1104 WeakPolarHBondContact OG-CG 3.43Å; S1101-Q1104 PolarHBondContact OG-N 3.13Å; S1101-Q1104 VanDerWaalsContact OG-N 3.16Å; S1101-Q1105 VanDerWaalsContact O-CG 3.27Å; S1101-Q1105 WeakPolarHBondContact O-CG 3.5Å; S1101-Q1105 PolarHBondContact O-N 3.46Å
1102	P	92.5	Very high	91.9	Very high	108 Å²	108	57 Å²	57	70%	0.701	31%	0.309	S	S	*	.	H	α-helix	trans	-56.4	-35.8	176.3	-26.1	35.5	0	0	0	113.7	Q1105 A1106	P1102-Q1105 PolarHBondContact O-N 3.26Å; P1102-A1106 PolarHBondContact O-N 3.46Å; P1102-A1106 VanDerWaalsContact O-N 3.08Å
1103	E	91.1	Very high	91.8	Very high	136 Å²	136	62.1 Å²	62.1	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-69	-46.1	177.4	-65.3	172	-176.5	0	0	111.1	M1065 S1101 Q1105 A1106 A1107	M1065-E1103 HydrophobicContact CE-CB 3.64Å; M1065-E1103 HydrophobicContact SD-CB 4.11Å; S1101-E1103 PolarHBondContact O-N 3.29Å; E1103-Q1105 VanDerWaalsContact C-N 3.29Å; E1103-Q1105 PolarHBondContact O-N 2.67Å; E1103-A1106 WeakPolarHBondContact O-CB 3.29Å; E1103-A1106 PolarHBondContact O-N 3.04Å; E1103-A1106 VanDerWaalsContact O-N 3.1Å; E1103-A1107 PolarHBondContact O-N 3Å
1104	Q	93.1	Very high	91.2	Very high	24 Å²	24	62.1 Å²	62.1	11%	0.112	35%	0.345	C	S	.	.	H	α-helix	trans	-62.1	-36.2	174.6	-73.7	172.4	-23.5	0	0	112.3	A1061 E1062 M1065 L1100 S1101 A1106 A1107 I1108	A1061-Q1104 HydrophobicContact CB-CB 3.73Å; A1061-Q1104 HydrophobicContact CB-CG 3.97Å; E1062-Q1104 PolarHBondContact OE1-NE2 3.33Å; M1065-Q1104 HydrophobicContact SD-CB 4.41Å; M1065-Q1104 HydrophobicContact SD-CG 3.77Å; L1100-Q1104 HydrophobicContact CB-CB 3.91Å; L1100-Q1104 HydrophobicContact CD2-CB 4.38Å; L1100-Q1104 HydrophobicContact CG-CB 4.5Å; S1101-Q1104 PolarHBondContact O-N 3.31Å; S1101-Q1104 WeakPolarHBondContact OG-CG 3.43Å; S1101-Q1104 PolarHBondContact OG-N 3.13Å; S1101-Q1104 VanDerWaalsContact OG-N 3.16Å; Q1104-A1106 VanDerWaalsContact C-N 3.34Å; Q1104-A1107 PolarHBondContact O-N 3.17Å; Q1104-I1108 WeakPolarHBondContact O-CG1 3.4Å; Q1104-I1108 PolarHBondContact O-N 3.43Å
1105	Q	92.9	Very high	90.6	Very high	61 Å²	61	59.4 Å²	59.4	29%	0.285	33%	0.332	S	S	.	.	H	α-helix	trans	-64.9	-39.1	174.3	-70	174.4	24.4	0	0	111.8	I1097 L1100 S1101 P1102 E1103 Q1109	I1097-Q1105 HydrophobicContact CG2-CG 4.17Å; I1097-Q1105 PolarHBondContact O-NE2 3.48Å; L1100-Q1105 HydrophobicContact CB-CG 3.79Å; L1100-Q1105 PolarHBondContact O-NE2 3Å; S1101-Q1105 VanDerWaalsContact O-CG 3.27Å; S1101-Q1105 WeakPolarHBondContact O-CG 3.5Å; S1101-Q1105 PolarHBondContact O-N 3.46Å; P1102-Q1105 PolarHBondContact O-N 3.26Å; E1103-Q1105 VanDerWaalsContact C-N 3.29Å; E1103-Q1105 PolarHBondContact O-N 2.67Å; Q1105-Q1109 VanDerWaalsContact O-CG 3.3Å; Q1105-Q1109 WeakPolarHBondContact O-CG 3.49Å; Q1105-Q1109 PolarHBondContact O-N 2.75Å; Q1105-Q1109 VanDerWaalsContact O-N 3.1Å
1106	A	90.8	Very high	90.5	Very high	49 Å²	49	57.3 Å²	57.3	41%	0.405	33%	0.325	S	S	.	.	H	α-helix	trans	-64.8	-43	175.4	0	0	0	0	0	111.1	P1102 E1103 Q1104 I1108 Q1109 E1110	P1102-A1106 PolarHBondContact O-N 3.46Å; P1102-A1106 VanDerWaalsContact O-N 3.08Å; E1103-A1106 WeakPolarHBondContact O-CB 3.29Å; E1103-A1106 PolarHBondContact O-N 3.04Å; E1103-A1106 VanDerWaalsContact O-N 3.1Å; Q1104-A1106 VanDerWaalsContact C-N 3.34Å; A1106-I1108 PolarHBondContact O-N 3.41Å; A1106-Q1109 WeakPolarHBondContact O-CB 3.16Å; A1106-Q1109 PolarHBondContact O-N 3.21Å; A1106-Q1109 VanDerWaalsContact O-N 3.08Å; A1106-E1110 PolarHBondContact O-N 3.46Å
1107	A	90.9	Very high	90.4	Very high	4 Å²	4	60.3 Å²	60.3	3%	0.033	34%	0.342	C	S	.	.	H	α-helix	trans	-60.7	-43.2	176.5	0	0	0	0	0	112.6	E1064 M1065 E1103 Q1104 Q1109 E1110 L1111	E1064-A1107 HydrophobicContact CB-CB 4.05Å; M1065-A1107 HydrophobicContact CG-CB 3.56Å; E1103-A1107 PolarHBondContact O-N 3Å; Q1104-A1107 PolarHBondContact O-N 3.17Å; A1107-Q1109 VanDerWaalsContact C-N 3.3Å; A1107-Q1109 PolarHBondContact O-N 3.43Å; A1107-E1110 PolarHBondContact O-N 2.59Å; A1107-L1111 PolarHBondContact O-N 2.7Å
1108	I	92.1	Very high	90.2	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-36.7	173.9	-68.4	-65.6	0	0	0	112	I1060 A1061 V1083 I1097 L1100 Q1104 A1106 L1112	I1060-I1108 HydrophobicContact CB-CD1 4.14Å; I1060-I1108 HydrophobicContact CG2-CD1 3.86Å; A1061-I1108 HydrophobicContact CB-CD1 3.98Å; A1061-I1108 HydrophobicContact CB-CG1 3.83Å; V1083-I1108 HydrophobicContact CG1-CG2 3.97Å; I1097-I1108 HydrophobicContact CD1-CG2 4.24Å; L1100-I1108 HydrophobicContact CD1-CG1 3.91Å; Q1104-I1108 WeakPolarHBondContact O-CG1 3.4Å; Q1104-I1108 PolarHBondContact O-N 3.43Å; A1106-I1108 PolarHBondContact O-N 3.41Å; I1108-L1112 HydrophobicContact CG2-CD1 4.01Å; I1108-L1112 WeakPolarHBondContact O-CB 3.28Å; I1108-L1112 VanDerWaalsContact O-CG 3.24Å; I1108-L1112 WeakPolarHBondContact O-CG 3.4Å; I1108-L1112 PolarHBondContact O-N 3.29Å; I1108-L1112 VanDerWaalsContact O-N 3.11Å
1109	Q	90.7	Very high	90.1	Very high	117 Å²	117	61 Å²	61	55%	0.547	34%	0.336	S	S	.	.	H	α-helix	trans	-67.7	-41.9	175.7	-71.8	171	22.5	0	0	111.5	Q1105 A1106 A1107 L1112 N1113	Q1105-Q1109 VanDerWaalsContact O-CG 3.3Å; Q1105-Q1109 WeakPolarHBondContact O-CG 3.49Å; Q1105-Q1109 PolarHBondContact O-N 2.75Å; Q1105-Q1109 VanDerWaalsContact O-N 3.1Å; A1106-Q1109 WeakPolarHBondContact O-CB 3.16Å; A1106-Q1109 PolarHBondContact O-N 3.21Å; A1106-Q1109 VanDerWaalsContact O-N 3.08Å; A1107-Q1109 VanDerWaalsContact C-N 3.3Å; A1107-Q1109 PolarHBondContact O-N 3.43Å; Q1109-L1112 PolarHBondContact O-N 3.26Å; Q1109-N1113 WeakPolarHBondContact O-CB 3.17Å; Q1109-N1113 PolarHBondContact O-N 2.92Å; Q1109-N1113 PolarHBondContact O-ND2 2.59Å
1110	E	89.2	Confident	89.9	Confident	114 Å²	114	57.8 Å²	57.8	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-59.6	-50.5	176.7	-177.7	165.2	-158.4	0	0	111.6	A1106 A1107 L1112 N1113 S1114	A1106-E1110 PolarHBondContact O-N 3.46Å; A1107-E1110 PolarHBondContact O-N 2.59Å; E1110-L1112 VanDerWaalsContact C-N 3.34Å; E1110-L1112 PolarHBondContact O-N 2.94Å; E1110-N1113 PolarHBondContact O-N 3.46Å; E1110-N1113 VanDerWaalsContact O-N 3.1Å; E1110-S1114 WeakPolarHBondContact O-CB 3.05Å; E1110-S1114 PolarHBondContact O-N 3.4Å; E1110-S1114 PolarHBondContact O-OG 3.32Å
1111	L	89	Confident	89.6	Confident	1 Å²	1	61 Å²	61	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-56.3	-45.4	174.7	178	55.1	0	0	0	112.6	I1060 E1064 A1076 L1079 A1080 A1107 N1113 S1114 A1115	I1060-L1111 HydrophobicContact CG2-CD2 3.42Å; I1060-L1111 VanDerWaalsContact CG2-CD2 3.42Å; E1064-L1111 HydrophobicContact CG-CB 3.91Å; E1064-L1111 HydrophobicContact CG-CD1 4.46Å; E1064-L1111 HydrophobicContact CG-CD2 3.94Å; E1064-L1111 HydrophobicContact CG-CG 4.3Å; E1064-L1111 VanDerWaalsContact OE1-CD1 3.27Å; E1064-L1111 WeakPolarHBondContact OE1-CD1 3.27Å; A1076-L1111 HydrophobicContact CB-CD1 4.29Å; L1079-L1111 HydrophobicContact CB-CD2 4.26Å; A1080-L1111 HydrophobicContact CB-CD1 4.29Å; A1080-L1111 HydrophobicContact CB-CG 4.16Å; A1107-L1111 PolarHBondContact O-N 2.7Å; L1111-N1113 PolarHBondContact O-N 3.14Å; L1111-S1114 PolarHBondContact O-N 3.14Å; L1111-S1114 PolarHBondContact O-OG 2.76Å; L1111-A1115 HydrophobicContact CD1-CB 4.13Å; L1111-A1115 PolarHBondContact O-N 2.78Å
1112	L	89.5	Confident	89.3	Confident	22 Å²	22	62.1 Å²	62.1	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-67.2	-25.5	180	-76.1	172.3	0	0	0	113.6	A1080 V1083 R1084 W1093 I1108 Q1109 E1110	A1080-L1112 HydrophobicContact CB-CD2 4.45Å; V1083-L1112 HydrophobicContact CB-CD2 4.27Å; V1083-L1112 HydrophobicContact CG1-CD1 4.04Å; V1083-L1112 HydrophobicContact CG1-CD2 4.05Å; V1083-L1112 HydrophobicContact CG1-CG 4.25Å; R1084-L1112 HydrophobicContact CB-CD2 4.04Å; R1084-L1112 PolarHBondContact NH2-O 2.99Å; W1093-L1112 HydrophobicContact CH2-CD1 4.02Å; I1108-L1112 HydrophobicContact CG2-CD1 4.01Å; I1108-L1112 WeakPolarHBondContact O-CB 3.28Å; I1108-L1112 VanDerWaalsContact O-CG 3.24Å; I1108-L1112 WeakPolarHBondContact O-CG 3.4Å; I1108-L1112 PolarHBondContact O-N 3.29Å; I1108-L1112 VanDerWaalsContact O-N 3.11Å; Q1109-L1112 PolarHBondContact O-N 3.26Å; E1110-L1112 VanDerWaalsContact C-N 3.34Å; E1110-L1112 PolarHBondContact O-N 2.94Å
1113	N	88.1	Confident	89.1	Confident	141 Å²	141	58.6 Å²	58.6	75%	0.754	32%	0.316	S	S	*	.	H	α-helix	trans	-85.5	-32.3	178.8	-69.8	-26	0	0	0	112	Q1109 E1110 L1111	Q1109-N1113 WeakPolarHBondContact O-CB 3.17Å; Q1109-N1113 PolarHBondContact O-N 2.92Å; Q1109-N1113 PolarHBondContact O-ND2 2.59Å; E1110-N1113 PolarHBondContact O-N 3.46Å; E1110-N1113 VanDerWaalsContact O-N 3.1Å; L1111-N1113 PolarHBondContact O-N 3.14Å
1114	S	81.3	Confident	88.9	Confident	57 Å²	57	52.2 Å²	52.2	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-86.8	-26	-177.7	60.1	0	0	0	0	113.8	H1071 E1110 L1111	H1071-S1114 PolarHBondContact CE1-OG 3.03Å; H1071-S1114 PolarHBondContact ND1-OG 3.18Å; E1110-S1114 WeakPolarHBondContact O-CB 3.05Å; E1110-S1114 PolarHBondContact O-N 3.4Å; E1110-S1114 PolarHBondContact O-OG 3.32Å; L1111-S1114 PolarHBondContact O-N 3.14Å; L1111-S1114 PolarHBondContact O-OG 2.76Å
1115	A	79.5	Confident	88.5	Confident	34 Å²	34	54.7 Å²	54.7	28%	0.281	31%	0.306	S	S	.	.			trans	-125.3	0	-169.3	0	0	0	0	0	118.1	A1076 A1080 R1084 L1111	A1076-A1115 HydrophobicContact CB-CB 4.43Å; A1080-A1115 HydrophobicContact CB-CB 3.85Å; R1084-A1115 PolarHBondContact NH2-O 3.42Å; L1111-A1115 HydrophobicContact CD1-CB 4.13Å; L1111-A1115 PolarHBondContact O-N 2.78Å

Retrieved 1,115 of 1,115 residues in 284.1 ms (Link to these results)

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