A0A5K4F477_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F477, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 900 aa.

						>A0A5K4F477_SCHMA|A0A5K4F477
MNNNITATTTTNTTYNTTYFYIINNQSIIYNTLNNTTNHLLHLERRYWCLCLMIFSIATLFGNSLVVLSVIRERSLRNATNWFIVSLAIADISLAILVMPLATWLEVVNGYWVFGTMICDVFVMFDVLFCTASILNLVAICLDRYLAVTKPIIYAKHNNMRRVQISIALVWIVSFLIAVPLICGLNINRYNDPTICQSFNALYIICSSLGSFYLPAIILIVVYQRIFALIKQRHKSLRLNQSTKQQSTTLSSFQQSQQLLHQQQSNLHDEEEERRRQRQQQQEEVPTLQLYDSQCFNDDQTLTIQSSSSTKVLEDPIQHIQLTNDLNHIRNSCISSESYENSLDLHFEGPRNDIPSPNLNSHTDRLIYAITHTYPLDHFKSTNQIQGINLNEDHNHNNNLINNPFNQLSTSETDLNTLKSFESPKHILSNSNQASLISPHTNDDDDDDDDGDEEEEEVSGTTFQCDHVYNTSPIKHSPFKQSKKEEESLKEQNQITHNSSMILQEEVICNSIKQSNTSRLSIQKLKYHTKNLSCHHQHHHHHYILFKSTLRNLFTLSWIHTCLNNNHSNVYNSSTSNDSNYSWPNMSECYGLSSDEITDHCLKNYSDQDDNEDDDVDDDDDDDDVVDEDEGNDHEYSSCKCCQHSLCQSSFEQSYECSQCHPMIIQYTTYQSLNKNGFMKLNNGFNNNNNNNNNKIIKNNQQKNKKINLNLNEKHKFKFKKFSRGKPIFEFNDQFKQNLQLMIQYLNKFFKLFHINTNRNHYINEKNQNHNHINHSILPIDIDISSEKFIKKISCNHSPKHHIILKNKNILSNKEKKATKTLAIVLGVFLACWLPFFSINITLGLCIYLGLDQYNICEYANQLMSSCTWLGYINSALNPIIYTIFNMEFRIAFQKLLHIK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	38.1	Very low	42.9	Very low	241 Å²	241	133.3 Å²	133.3	100%	1.187	76%	0.759	S	S	*	*				0	140.1	0	-74.2	165.7	168.1	0	0	108.3
2	N	38.5	Very low	43.3	Very low	154 Å²	154	131.3 Å²	131.3	82%	0.824	75%	0.745	S	S	*	*			trans	30.8	96.6	171.5	-61.6	12.1	0	0	0	118.9
3	N	41.7	Very low	43.9	Very low	157 Å²	157	128.1 Å²	128.1	84%	0.84	73%	0.729	S	S	*	*			trans	-160.8	159.9	139.9	-92.6	-36	0	0	0	108.1
4	N	42.5	Very low	44.6	Very low	161 Å²	161	125.1 Å²	125.1	86%	0.861	72%	0.715	S	S	*	*			trans	85.3	40.5	175.6	-51.9	-11.2	0	0	0	119.9
5	I	43.9	Very low	45.2	Very low	158 Å²	158	128.3 Å²	128.3	81%	0.81	71%	0.713	S	S	*	*			trans	-137	98.8	158.9	-52.5	178.7	0	0	0	110.5
6	T	42.9	Very low	46	Very low	132 Å²	132	127.6 Å²	127.6	81%	0.81	71%	0.707	S	S	*	*	S	Bend	trans	-168.3	-17.3	166.2	-7.7	0	0	0	0	115.2
7	A	43.6	Very low	47.1	Very low	83 Å²	83	126.1 Å²	126.1	69%	0.686	70%	0.702	S	S	*	*	S	Bend	trans	-89	-5.2	-170.2	0	0	0	0	0	116
8	T	43.6	Very low	48.1	Very low	100 Å²	100	123.3 Å²	123.3	61%	0.613	69%	0.69	S	S	*	*	S	Bend	trans	-96.8	-9.2	-167.2	40.9	0	0	0	0	115.4	T11	T8-T11 PolarHBondContact O-OG1 3.4Å
9	T	44.3	Very low	48.6	Very low	109 Å²	109	125.3 Å²	125.3	67%	0.669	69%	0.686	S	S	*	*	H	α-helix	trans	-82.8	-27.8	-174.2	-33.7	0	0	0	0	113.3
10	T	46.6	Very low	49.3	Very low	102 Å²	102	126.1 Å²	126.1	63%	0.626	68%	0.683	S	S	*	*	H	α-helix	trans	-82.3	-17.5	-175.5	42.7	0	0	0	0	114.5	T13 T14	T10-T13 PolarHBondContact O-OG1 3.44Å; T10-T14 PolarHBondContact O-OG1 3.16Å; T10-T14 VanDerWaalsContact O-OG1 3.11Å
11	T	46.5	Very low	50	Low	69 Å²	69	127.5 Å²	127.5	42%	0.423	68%	0.68	S	S	.	*	H	α-helix	trans	-78.5	-38.2	-180	46.9	0	0	0	0	112.6	T8 T14 Y15	T8-T11 PolarHBondContact O-OG1 3.4Å; T11-T14 PolarHBondContact O-N 3.01Å; T11-T14 PolarHBondContact O-OG1 2.98Å; T11-Y15 PolarHBondContact O-N 3.5Å
12	N	47	Very low	51.5	Low	110 Å²	110	120.7 Å²	120.7	59%	0.588	65%	0.647	S	S	*	*	H	α-helix	trans	-69.5	-34.8	-176.5	-72.9	9.9	0	0	0	112.5	Y15 N16	N12-Y15 PolarHBondContact O-N 3.47Å; N12-N16 PolarHBondContact O-N 2.87Å; N12-N16 VanDerWaalsContact O-N 3.11Å
13	T	50.9	Low	53.1	Low	89 Å²	89	117 Å²	117	55%	0.546	63%	0.626	S	S	.	*	H	α-helix	trans	-65.5	-45.6	175	48.4	0	0	0	0	111.3	T10 Y15 N16 T17	T10-T13 PolarHBondContact O-OG1 3.44Å; T13-Y15 PolarHBondContact O-N 3.28Å; T13-N16 PolarHBondContact O-N 3.43Å; T13-T17 PolarHBondContact O-N 3.07Å; T13-T17 PolarHBondContact O-OG1 2.84Å; T13-T17 VanDerWaalsContact O-OG1 3.05Å
14	T	54.4	Low	54.7	Low	86 Å²	86	113 Å²	113	53%	0.528	61%	0.605	S	S	.	*	H	α-helix	trans	-59.7	-44.8	174.2	29.3	0	0	0	0	113	T10 T11 N16 T17 T18	T10-T14 PolarHBondContact O-OG1 3.16Å; T10-T14 VanDerWaalsContact O-OG1 3.11Å; T11-T14 PolarHBondContact O-N 3.01Å; T11-T14 PolarHBondContact O-OG1 2.98Å; T14-N16 PolarHBondContact O-N 3.49Å; T14-T17 PolarHBondContact O-N 3.32Å; T14-T18 PolarHBondContact O-N 3.27Å; T14-T18 PolarHBondContact O-OG1 3.28Å
15	Y	53	Low	56.3	Low	173 Å²	173	108 Å²	108	68%	0.678	58%	0.579	S	S	*	*	H	α-helix	trans	-58.7	-48.2	179.2	-105	-88.7	0	0	0	111.9	T11 N12 T13 T17 T18 Y19	T11-Y15 PolarHBondContact O-N 3.5Å; N12-Y15 PolarHBondContact O-N 3.47Å; T13-Y15 PolarHBondContact O-N 3.28Å; Y15-T17 PolarHBondContact O-N 2.95Å; Y15-T18 WeakPolarHBondContact CA-OG1 3.24Å; Y15-T18 PolarHBondContact O-N 2.91Å; Y15-T18 PolarHBondContact O-OG1 2.76Å; Y15-Y19 PolarHBondContact O-N 3.17Å
16	N	58.7	Low	57.7	Low	117 Å²	117	106.9 Å²	106.9	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-61.2	-41.7	177.6	-74.8	-0.5	0	0	0	112	N12 T13 T14 Y19 F20	N12-N16 PolarHBondContact O-N 2.87Å; N12-N16 VanDerWaalsContact O-N 3.11Å; T13-N16 PolarHBondContact O-N 3.43Å; T14-N16 PolarHBondContact O-N 3.49Å; N16-Y19 PolarHBondContact O-N 2.9Å; N16-F20 PolarHBondContact O-N 2.93Å
17	T	64.8	Low	59.2	Low	102 Å²	102	102.9 Å²	102.9	63%	0.626	55%	0.547	S	S	*	.	H	α-helix	trans	-63	-43.4	176.4	-53.8	0	0	0	0	112.1	T13 T14 Y15 Y21	T13-T17 PolarHBondContact O-N 3.07Å; T13-T17 PolarHBondContact O-OG1 2.84Å; T13-T17 VanDerWaalsContact O-OG1 3.05Å; T14-T17 PolarHBondContact O-N 3.32Å; Y15-T17 PolarHBondContact O-N 2.95Å; T17-Y21 WeakPolarHBondContact O-CB 3.36Å; T17-Y21 PolarHBondContact O-N 2.88Å
18	T	65.6	Low	60.8	Low	77 Å²	77	103.6 Å²	103.6	47%	0.472	54%	0.539	S	S	.	.	H	α-helix	trans	-64	-39.5	175	36.7	0	0	0	0	112.9	T14 Y15 Y21 I22	T14-T18 PolarHBondContact O-N 3.27Å; T14-T18 PolarHBondContact O-OG1 3.28Å; Y15-T18 WeakPolarHBondContact CA-OG1 3.24Å; Y15-T18 PolarHBondContact O-N 2.91Å; Y15-T18 PolarHBondContact O-OG1 2.76Å; T18-Y21 PolarHBondContact O-N 3.47Å; T18-I22 VanDerWaalsContact O-CG1 3.29Å; T18-I22 WeakPolarHBondContact O-CG1 3.38Å; T18-I22 PolarHBondContact O-N 2.87Å
19	Y	56.8	Low	62.3	Low	160 Å²	160	104.4 Å²	104.4	63%	0.627	54%	0.538	S	S	*	.	H	α-helix	trans	-64.6	-45	179.5	-169.6	-108.8	0	0	0	111.7	Y15 N16 Y21 I22 I23	Y15-Y19 PolarHBondContact O-N 3.17Å; N16-Y19 PolarHBondContact O-N 2.9Å; Y19-Y21 VanDerWaalsContact C-N 3.33Å; Y19-Y21 PolarHBondContact O-N 2.85Å; Y19-I22 PolarHBondContact O-N 3.33Å; Y19-I23 HydrophobicContact CD1-CD1 3.86Å; Y19-I23 HydrophobicContact CE1-CD1 3.44Å; Y19-I23 VanDerWaalsContact CE1-CD1 3.44Å; Y19-I23 PolarHBondContact O-N 2.7Å
20	F	62.2	Low	63.6	Low	141 Å²	141	105.7 Å²	105.7	62%	0.618	53%	0.531	S	S	*	.	H	α-helix	trans	-63.7	-37.8	176.3	-145.3	-83.1	0	0	0	112.2	N16 N24	N16-F20 PolarHBondContact O-N 2.93Å; F20-N24 WeakPolarHBondContact O-CB 3.37Å; F20-N24 PolarHBondContact O-N 3.36Å
21	Y	64.7	Low	65	Low	156 Å²	156	105 Å²	105	61%	0.612	52%	0.524	S	S	*	.	H	α-helix	trans	-67.2	-37.3	175.8	-172.7	-109.1	0	0	0	112.8	T17 T18 Y19 N25	T17-Y21 WeakPolarHBondContact O-CB 3.36Å; T17-Y21 PolarHBondContact O-N 2.88Å; T18-Y21 PolarHBondContact O-N 3.47Å; Y19-Y21 VanDerWaalsContact C-N 3.33Å; Y19-Y21 PolarHBondContact O-N 2.85Å; Y21-N25 WeakPolarHBondContact CD1-ND2 3.39Å; Y21-N25 WeakPolarHBondContact CE1-ND2 3.49Å; Y21-N25 VanDerWaalsContact CZ-ND2 3.32Å; Y21-N25 WeakPolarHBondContact O-CB 3.28Å; Y21-N25 PolarHBondContact O-N 3.16Å; Y21-N25 PolarHBondContact O-ND2 2.92Å
22	I	70.4	Confident	66.4	Low	98 Å²	98	105.5 Å²	105.5	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-47.6	174.9	-70.2	163.1	0	0	0	110.6	T18 Y19 N24 N25 Q26	T18-I22 VanDerWaalsContact O-CG1 3.29Å; T18-I22 WeakPolarHBondContact O-CG1 3.38Å; T18-I22 PolarHBondContact O-N 2.87Å; Y19-I22 PolarHBondContact O-N 3.33Å; I22-N24 PolarHBondContact O-N 2.85Å; I22-N25 PolarHBondContact O-N 2.93Å; I22-Q26 WeakPolarHBondContact O-CB 3.17Å; I22-Q26 PolarHBondContact O-N 3.06Å
23	I	71.2	Confident	67.7	Low	76 Å²	76	104.9 Å²	104.9	39%	0.39	52%	0.523	S	S	.	.	H	α-helix	trans	-60.5	-45.8	178.5	-70.8	174.3	0	0	0	111.3	Y19 N25 Q26 S27	Y19-I23 HydrophobicContact CD1-CD1 3.86Å; Y19-I23 HydrophobicContact CE1-CD1 3.44Å; Y19-I23 VanDerWaalsContact CE1-CD1 3.44Å; Y19-I23 PolarHBondContact O-N 2.7Å; I23-N25 PolarHBondContact O-N 3.36Å; I23-Q26 PolarHBondContact O-N 3.38Å; I23-S27 PolarHBondContact O-N 2.86Å; I23-S27 PolarHBondContact O-OG 3.35Å
24	N	74.5	Confident	68.9	Low	73 Å²	73	102.7 Å²	102.7	39%	0.39	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-38.4	178.5	-79.2	-8.8	0	0	0	112.7	F20 I22 Q26 S27 I28	F20-N24 WeakPolarHBondContact O-CB 3.37Å; F20-N24 PolarHBondContact O-N 3.36Å; I22-N24 PolarHBondContact O-N 2.85Å; N24-Q26 VanDerWaalsContact C-N 3.35Å; N24-S27 PolarHBondContact O-OG 3.45Å; N24-S27 VanDerWaalsContact O-OG 3.07Å; N24-I28 WeakPolarHBondContact O-CB 3.27Å; N24-I28 WeakPolarHBondContact O-CD1 3.34Å; N24-I28 WeakPolarHBondContact O-CG1 3.41Å; N24-I28 PolarHBondContact O-N 2.83Å
25	N	77.1	Confident	70.1	Confident	58 Å²	58	103.9 Å²	103.9	31%	0.31	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-38.5	173.3	-75.6	-40.5	0	0	0	111.7	Y21 I22 I23 I28 I29	Y21-N25 WeakPolarHBondContact CD1-ND2 3.39Å; Y21-N25 WeakPolarHBondContact CE1-ND2 3.49Å; Y21-N25 VanDerWaalsContact CZ-ND2 3.32Å; Y21-N25 WeakPolarHBondContact O-CB 3.28Å; Y21-N25 PolarHBondContact O-N 3.16Å; Y21-N25 PolarHBondContact O-ND2 2.92Å; I22-N25 PolarHBondContact O-N 2.93Å; I23-N25 PolarHBondContact O-N 3.36Å; N25-I28 PolarHBondContact O-N 3.43Å; N25-I29 WeakPolarHBondContact O-CB 3.48Å; N25-I29 WeakPolarHBondContact O-CD1 3.25Å; N25-I29 VanDerWaalsContact O-CG1 3.23Å; N25-I29 WeakPolarHBondContact O-CG1 3.41Å; N25-I29 PolarHBondContact O-N 2.9Å
26	Q	73.8	Confident	71.2	Confident	133 Å²	133	99.8 Å²	99.8	62%	0.621	50%	0.504	S	S	*	.	H	α-helix	trans	-66.8	-39.7	178.5	-171.4	171.1	-6.9	0	0	112.1	I22 I23 N24 I29 Y30	I22-Q26 WeakPolarHBondContact O-CB 3.17Å; I22-Q26 PolarHBondContact O-N 3.06Å; I23-Q26 PolarHBondContact O-N 3.38Å; N24-Q26 VanDerWaalsContact C-N 3.35Å; Q26-I29 PolarHBondContact O-N 3.36Å; Q26-Y30 WeakPolarHBondContact O-CB 3.39Å; Q26-Y30 PolarHBondContact O-N 3.46Å
27	S	73.5	Confident	72	Confident	48 Å²	48	95.8 Å²	95.8	34%	0.336	48%	0.484	S	S	.	.	H	α-helix	trans	-70.3	-37.5	175.1	66	0	0	0	0	112.5	I23 N24 Y30 N31	I23-S27 PolarHBondContact O-N 2.86Å; I23-S27 PolarHBondContact O-OG 3.35Å; N24-S27 PolarHBondContact O-OG 3.45Å; N24-S27 VanDerWaalsContact O-OG 3.07Å; S27-Y30 PolarHBondContact O-N 3.39Å; S27-N31 WeakPolarHBondContact O-CB 3.4Å; S27-N31 VanDerWaalsContact O-CG 3.22Å; S27-N31 PolarHBondContact O-N 3.47Å
28	I	77.5	Confident	72.5	Confident	99 Å²	99	94.7 Å²	94.7	51%	0.508	48%	0.475	S	S	.	.	H	α-helix	trans	-62.3	-44.3	172.1	-70.4	165	0	0	0	111	N24 N25 T32	N24-I28 WeakPolarHBondContact O-CB 3.27Å; N24-I28 WeakPolarHBondContact O-CD1 3.34Å; N24-I28 WeakPolarHBondContact O-CG1 3.41Å; N24-I28 PolarHBondContact O-N 2.83Å; N25-I28 PolarHBondContact O-N 3.43Å; I28-T32 VanDerWaalsContact O-CB 3.27Å; I28-T32 WeakPolarHBondContact O-CB 3.39Å; I28-T32 PolarHBondContact O-N 3.44Å; I28-T32 PolarHBondContact O-OG1 3.22Å
29	I	76	Confident	73	Confident	117 Å²	117	96.8 Å²	96.8	60%	0.6	48%	0.479	S	S	*	.	H	α-helix	trans	-62.9	-45.8	176.4	-70.9	164.5	0	0	0	110.6	N25 Q26 T32 L33	N25-I29 WeakPolarHBondContact O-CB 3.48Å; N25-I29 WeakPolarHBondContact O-CD1 3.25Å; N25-I29 VanDerWaalsContact O-CG1 3.23Å; N25-I29 WeakPolarHBondContact O-CG1 3.41Å; N25-I29 PolarHBondContact O-N 2.9Å; Q26-I29 PolarHBondContact O-N 3.36Å; I29-T32 PolarHBondContact O-N 3.12Å; I29-L33 VanDerWaalsContact O-CB 3.32Å; I29-L33 WeakPolarHBondContact O-CB 3.33Å; I29-L33 PolarHBondContact O-N 3.26Å
30	Y	70.3	Confident	74.1	Confident	135 Å²	135	94.6 Å²	94.6	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-60.6	-48.5	177.9	-179.2	-107.2	0	0	0	112.1	Q26 S27 T32 L33 N34	Q26-Y30 WeakPolarHBondContact O-CB 3.39Å; Q26-Y30 PolarHBondContact O-N 3.46Å; S27-Y30 PolarHBondContact O-N 3.39Å; Y30-T32 VanDerWaalsContact C-N 3.34Å; Y30-T32 PolarHBondContact O-N 2.87Å; Y30-L33 PolarHBondContact O-N 2.92Å; Y30-N34 WeakPolarHBondContact CE1-ND2 3.43Å; Y30-N34 WeakPolarHBondContact O-CB 3.37Å; Y30-N34 PolarHBondContact O-N 2.87Å; Y30-N34 PolarHBondContact OH-ND2 3.35Å
31	N	77.2	Confident	74.8	Confident	88 Å²	88	91 Å²	91	47%	0.471	46%	0.464	S	S	.	.	H	α-helix	trans	-64.9	-37.2	177.6	-69.6	-11	0	0	0	112.2	S27 N35	S27-N31 WeakPolarHBondContact O-CB 3.4Å; S27-N31 VanDerWaalsContact O-CG 3.22Å; S27-N31 PolarHBondContact O-N 3.47Å; N31-N35 VanDerWaalsContact O-CB 3.29Å; N31-N35 WeakPolarHBondContact O-CB 3.39Å; N31-N35 VanDerWaalsContact O-CG 3.22Å; N31-N35 PolarHBondContact O-N 3.24Å; N31-N35 PolarHBondContact O-ND2 3.22Å
32	T	75	Confident	75.5	Confident	79 Å²	79	88.1 Å²	88.1	49%	0.485	46%	0.456	S	S	.	.	H	α-helix	trans	-67.3	-41.6	175.3	-56	0	0	0	0	111.2	I28 I29 Y30 T36	I28-T32 VanDerWaalsContact O-CB 3.27Å; I28-T32 WeakPolarHBondContact O-CB 3.39Å; I28-T32 PolarHBondContact O-N 3.44Å; I28-T32 PolarHBondContact O-OG1 3.22Å; I29-T32 PolarHBondContact O-N 3.12Å; Y30-T32 VanDerWaalsContact C-N 3.34Å; Y30-T32 PolarHBondContact O-N 2.87Å; T32-T36 WeakPolarHBondContact O-CB 3.39Å; T32-T36 PolarHBondContact O-N 3.15Å; T32-T36 PolarHBondContact O-OG1 3.43Å
33	L	75	Confident	75.9	Confident	97 Å²	97	86.1 Å²	86.1	51%	0.508	45%	0.446	S	S	.	.	H	α-helix	trans	-63.6	-49.3	176.5	-165.6	76.6	0	0	0	110.4	I29 Y30 N35 T36 T37	I29-L33 VanDerWaalsContact O-CB 3.32Å; I29-L33 WeakPolarHBondContact O-CB 3.33Å; I29-L33 PolarHBondContact O-N 3.26Å; Y30-L33 PolarHBondContact O-N 2.92Å; L33-N35 PolarHBondContact O-N 3.3Å; L33-T36 CarbonylContact O-C 3.56Å; L33-T36 WeakPolarHBondContact O-CA 3.46Å; L33-T36 WeakPolarHBondContact O-CB 3.38Å; L33-T36 PolarHBondContact O-N 2.85Å; L33-T36 VanDerWaalsContact O-N 3.09Å; L33-T37 PolarHBondContact O-N 2.91Å; L33-T37 PolarHBondContact O-OG1 2.89Å
34	N	76.2	Confident	76.3	Confident	44 Å²	44	85.5 Å²	85.5	24%	0.235	44%	0.442	C	S	.	.	H	α-helix	trans	-62.5	-41.8	178.5	-75.5	3.8	0	0	0	112.5	Y30 T36 T37 N38	Y30-N34 WeakPolarHBondContact CE1-ND2 3.43Å; Y30-N34 WeakPolarHBondContact O-CB 3.37Å; Y30-N34 PolarHBondContact O-N 2.87Å; Y30-N34 PolarHBondContact OH-ND2 3.35Å; N34-T36 VanDerWaalsContact C-N 3.28Å; N34-T36 PolarHBondContact O-N 3.48Å; N34-T37 WeakPolarHBondContact CA-OG1 3.34Å; N34-T37 PolarHBondContact O-N 2.98Å; N34-T37 PolarHBondContact O-OG1 2.95Å; N34-T37 VanDerWaalsContact O-OG1 3.06Å; N34-N38 WeakPolarHBondContact O-CB 3.44Å; N34-N38 PolarHBondContact O-N 3.11Å; N34-N38 PolarHBondContact O-ND2 3.39Å
35	N	77.7	Confident	76.6	Confident	111 Å²	111	85.4 Å²	85.4	59%	0.594	44%	0.436	S	S	*	.	H	α-helix	trans	-64.6	-35.1	173.8	-74.8	-15.8	0	0	0	111.6	N31 L33 H39	N31-N35 VanDerWaalsContact O-CB 3.29Å; N31-N35 WeakPolarHBondContact O-CB 3.39Å; N31-N35 VanDerWaalsContact O-CG 3.22Å; N31-N35 PolarHBondContact O-N 3.24Å; N31-N35 PolarHBondContact O-ND2 3.22Å; L33-N35 PolarHBondContact O-N 3.3Å; N35-H39 WeakPolarHBondContact O-CB 3.45Å; N35-H39 PolarHBondContact O-N 3.06Å
36	T	76.7	Confident	76.9	Confident	87 Å²	87	90.7 Å²	90.7	53%	0.534	45%	0.451	S	S	.	.	H	α-helix	trans	-71.4	-42.8	177.1	-55.4	0	0	0	0	111.9	T32 L33 N34 L40	T32-T36 WeakPolarHBondContact O-CB 3.39Å; T32-T36 PolarHBondContact O-N 3.15Å; T32-T36 PolarHBondContact O-OG1 3.43Å; L33-T36 CarbonylContact O-C 3.56Å; L33-T36 WeakPolarHBondContact O-CA 3.46Å; L33-T36 WeakPolarHBondContact O-CB 3.38Å; L33-T36 PolarHBondContact O-N 2.85Å; L33-T36 VanDerWaalsContact O-N 3.09Å; N34-T36 VanDerWaalsContact C-N 3.28Å; N34-T36 PolarHBondContact O-N 3.48Å; T36-L40 WeakPolarHBondContact O-CB 3.3Å; T36-L40 PolarHBondContact O-N 3.41Å
37	T	75	Confident	77.5	Confident	33 Å²	33	91.1 Å²	91.1	20%	0.202	45%	0.448	C	S	.	.	H	α-helix	trans	-68.8	-43.4	176.1	52.7	0	0	0	0	111.3	L33 N34 H39 L40 L41	L33-T37 PolarHBondContact O-N 2.91Å; L33-T37 PolarHBondContact O-OG1 2.89Å; N34-T37 WeakPolarHBondContact CA-OG1 3.34Å; N34-T37 PolarHBondContact O-N 2.98Å; N34-T37 PolarHBondContact O-OG1 2.95Å; N34-T37 VanDerWaalsContact O-OG1 3.06Å; T37-H39 PolarHBondContact O-N 2.87Å; T37-L40 PolarHBondContact O-N 2.77Å; T37-L41 WeakPolarHBondContact O-CB 3.36Å; T37-L41 VanDerWaalsContact O-CG 3.28Å; T37-L41 WeakPolarHBondContact O-CG 3.27Å; T37-L41 PolarHBondContact O-N 3.5Å
38	N	76.5	Confident	77.8	Confident	79 Å²	79	91.9 Å²	91.9	42%	0.422	44%	0.444	S	S	.	.	H	α-helix	trans	-59.8	-46.4	174.3	-72.5	-18	0	0	0	111.3	N34 L40 L41 H42	N34-N38 WeakPolarHBondContact O-CB 3.44Å; N34-N38 PolarHBondContact O-N 3.11Å; N34-N38 PolarHBondContact O-ND2 3.39Å; N38-L40 VanDerWaalsContact C-N 3.32Å; N38-L40 PolarHBondContact O-N 3.13Å; N38-L41 PolarHBondContact O-N 2.89Å; N38-H42 WeakPolarHBondContact O-CB 3.34Å; N38-H42 PolarHBondContact O-CD2 2.91Å; N38-H42 PolarHBondContact O-N 3.28Å
39	H	76	Confident	78.4	Confident	121 Å²	121	89.2 Å²	89.2	56%	0.56	43%	0.433	S	S	*	.	H	α-helix	trans	-63.2	-37.5	176.3	-174.2	-92.4	0	0	0	112.3	N35 T37 H42 L43	N35-H39 WeakPolarHBondContact O-CB 3.45Å; N35-H39 PolarHBondContact O-N 3.06Å; T37-H39 PolarHBondContact O-N 2.87Å; H39-H42 PolarHBondContact O-N 3.2Å; H39-L43 WeakPolarHBondContact O-CG 3.31Å; H39-L43 PolarHBondContact O-N 3.42Å
40	L	79.7	Confident	79	Confident	113 Å²	113	88.7 Å²	88.7	59%	0.592	43%	0.432	S	S	*	.	H	α-helix	trans	-65	-47.7	174	-173	64	0	0	0	111.6	T36 T37 N38 H42 L43 E44	T36-L40 WeakPolarHBondContact O-CB 3.3Å; T36-L40 PolarHBondContact O-N 3.41Å; T37-L40 PolarHBondContact O-N 2.77Å; N38-L40 VanDerWaalsContact C-N 3.32Å; N38-L40 PolarHBondContact O-N 3.13Å; L40-H42 VanDerWaalsContact C-N 3.31Å; L40-H42 PolarHBondContact O-N 3.36Å; L40-L43 WeakPolarHBondContact O-CB 3.38Å; L40-L43 PolarHBondContact O-N 2.93Å; L40-L43 VanDerWaalsContact O-N 3.15Å; L40-E44 WeakPolarHBondContact O-CB 3.38Å; L40-E44 PolarHBondContact O-N 3.35Å
41	L	76.5	Confident	79.8	Confident	65 Å²	65	85.3 Å²	85.3	34%	0.34	43%	0.427	S	S	.	.	H	α-helix	trans	-63.9	-32.2	176.5	-70.5	165.6	0	0	0	112.7	T37 N38 R45	T37-L41 WeakPolarHBondContact O-CB 3.36Å; T37-L41 VanDerWaalsContact O-CG 3.28Å; T37-L41 WeakPolarHBondContact O-CG 3.27Å; T37-L41 PolarHBondContact O-N 3.5Å; N38-L41 PolarHBondContact O-N 2.89Å; L41-R45 VanDerWaalsContact O-CB 3.31Å; L41-R45 WeakPolarHBondContact O-CB 3.47Å; L41-R45 VanDerWaalsContact O-CG 3.29Å; L41-R45 WeakPolarHBondContact O-CG 3.41Å; L41-R45 PolarHBondContact O-N 3.12Å; L41-R45 PolarHBondContact O-NE 3.27Å
42	H	78.7	Confident	80.5	Confident	96 Å²	96	82 Å²	82	44%	0.444	41%	0.409	S	S	.	.	H	α-helix	trans	-72.8	-36.6	172	-81.4	-68	0	0	0	112.5	N38 H39 L40 R45 R46	N38-H42 WeakPolarHBondContact O-CB 3.34Å; N38-H42 PolarHBondContact O-CD2 2.91Å; N38-H42 PolarHBondContact O-N 3.28Å; H39-H42 PolarHBondContact O-N 3.2Å; L40-H42 VanDerWaalsContact C-N 3.31Å; L40-H42 PolarHBondContact O-N 3.36Å; H42-R45 PolarHBondContact CE1-NH2 2.93Å; H42-R45 VanDerWaalsContact CE1-NH2 3.31Å; H42-R45 PolarHBondContact ND1-NH2 3.49Å; H42-R46 WeakPolarHBondContact O-CB 3.25Å; H42-R46 WeakPolarHBondContact O-CD 3.42Å; H42-R46 WeakPolarHBondContact O-CG 3.43Å; H42-R46 PolarHBondContact O-N 3.4Å; H42-R46 VanDerWaalsContact O-N 3.16Å
43	L	80.3	Confident	81.2	Confident	57 Å²	57	80.8 Å²	80.8	30%	0.298	40%	0.399	S	S	.	.	H	α-helix	trans	-65.6	-47	171.1	-77.7	172.6	0	0	0	111.2	H39 L40 R46 Y47	H39-L43 WeakPolarHBondContact O-CG 3.31Å; H39-L43 PolarHBondContact O-N 3.42Å; L40-L43 WeakPolarHBondContact O-CB 3.38Å; L40-L43 PolarHBondContact O-N 2.93Å; L40-L43 VanDerWaalsContact O-N 3.15Å; L43-R46 WeakPolarHBondContact O-CB 3.46Å; L43-R46 PolarHBondContact O-N 3Å; L43-Y47 HydrophobicContact CB-CD2 4.46Å; L43-Y47 HydrophobicContact CB-CE2 4.23Å; L43-Y47 HydrophobicContact CD2-CE2 4.35Å; L43-Y47 WeakPolarHBondContact O-CD2 3.47Å; L43-Y47 PolarHBondContact O-N 2.85Å
44	E	80	Confident	81.9	Confident	63 Å²	63	81.5 Å²	81.5	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-58.3	-53.6	-179.6	-157.7	-155.3	141.9	0	0	110.9	L40 R46 Y47 W48	L40-E44 WeakPolarHBondContact O-CB 3.38Å; L40-E44 PolarHBondContact O-N 3.35Å; E44-R46 VanDerWaalsContact C-N 3.28Å; E44-R46 PolarHBondContact O-N 3.32Å; E44-Y47 PolarHBondContact O-N 2.86Å; E44-W48 VanDerWaalsContact O-CD1 3.23Å; E44-W48 PolarHBondContact O-N 3.27Å; E44-W48 PolarHBondContact OE1-NE1 3.28Å
45	R	80	Confident	82.6	Confident	71 Å²	71	84 Å²	84	27%	0.268	41%	0.411	S	S	.	.	H	α-helix	trans	-56.9	-36.7	174.9	-76.4	-178.9	-70.6	-176.7	3.3	113.3	L41 H42 C49 V107	L41-R45 VanDerWaalsContact O-CB 3.31Å; L41-R45 WeakPolarHBondContact O-CB 3.47Å; L41-R45 VanDerWaalsContact O-CG 3.29Å; L41-R45 WeakPolarHBondContact O-CG 3.41Å; L41-R45 PolarHBondContact O-N 3.12Å; L41-R45 PolarHBondContact O-NE 3.27Å; H42-R45 PolarHBondContact CE1-NH2 2.93Å; H42-R45 VanDerWaalsContact CE1-NH2 3.31Å; H42-R45 PolarHBondContact ND1-NH2 3.49Å; R45-C49 VanDerWaalsContact O-CB 3.27Å; R45-C49 WeakPolarHBondContact O-CB 3.27Å; R45-C49 PolarHBondContact O-N 3.47Å; R45-V107 HydrophobicContact CB-CG1 4.22Å; R45-V107 WeakPolarHBondContact CD-O 3.47Å
46	R	84.2	Confident	83.4	Confident	168 Å²	168	79 Å²	79	63%	0.634	38%	0.384	S	S	*	.	H	α-helix	trans	-67.5	-40.5	173.8	-76.7	170	177.9	-177.7	0	112.3	H42 L43 E44 L50	H42-R46 WeakPolarHBondContact O-CB 3.25Å; H42-R46 WeakPolarHBondContact O-CD 3.42Å; H42-R46 WeakPolarHBondContact O-CG 3.43Å; H42-R46 PolarHBondContact O-N 3.4Å; H42-R46 VanDerWaalsContact O-N 3.16Å; L43-R46 WeakPolarHBondContact O-CB 3.46Å; L43-R46 PolarHBondContact O-N 3Å; E44-R46 VanDerWaalsContact C-N 3.28Å; E44-R46 PolarHBondContact O-N 3.32Å; R46-L50 VanDerWaalsContact O-CG 3.3Å; R46-L50 WeakPolarHBondContact O-CG 3.46Å; R46-L50 PolarHBondContact O-N 2.96Å; R46-L50 VanDerWaalsContact O-N 3.08Å
47	Y	84.6	Confident	84.3	Confident	143 Å²	143	80.1 Å²	80.1	56%	0.561	39%	0.386	S	S	*	.	H	α-helix	trans	-68.1	-42.1	175.4	-71.9	-57.9	0	0	0	112	L43 E44 L50 C51	L43-Y47 HydrophobicContact CB-CD2 4.46Å; L43-Y47 HydrophobicContact CB-CE2 4.23Å; L43-Y47 HydrophobicContact CD2-CE2 4.35Å; L43-Y47 WeakPolarHBondContact O-CD2 3.47Å; L43-Y47 PolarHBondContact O-N 2.85Å; E44-Y47 PolarHBondContact O-N 2.86Å; Y47-L50 PolarHBondContact O-N 3.28Å; Y47-C51 WeakPolarHBondContact O-CB 3.36Å; Y47-C51 PolarHBondContact O-N 2.93Å; Y47-C51 PolarHBondContact O-SG 2.97Å
48	W	81.6	Confident	85.2	Confident	63 Å²	63	80.9 Å²	80.9	24%	0.239	40%	0.396	C	S	.	.	H	α-helix	trans	-58.1	-50.7	172.4	-75.9	120.6	0	0	0	111.8	E44 L50 C51 L52 F731	E44-W48 VanDerWaalsContact O-CD1 3.23Å; E44-W48 PolarHBondContact O-N 3.27Å; E44-W48 PolarHBondContact OE1-NE1 3.28Å; W48-L50 VanDerWaalsContact C-N 3.33Å; W48-L50 PolarHBondContact O-N 3.23Å; W48-C51 PolarHBondContact O-N 3.25Å; W48-C51 VanDerWaalsContact O-N 3.12Å; W48-L52 VanDerWaalsContact O-CG 3.32Å; W48-L52 WeakPolarHBondContact O-CG 3.43Å; W48-L52 PolarHBondContact O-N 3.25Å; W48-F731 AromaticContact CH2-CD2 3.92Å; W48-F731 HydrophobicContact CH2-CD2 3.92Å; W48-F731 HydrophobicContact CZ3-CD2 4.05Å
49	C	89	Confident	86.1	Confident	43 Å²	43	77.2 Å²	77.2	29%	0.291	38%	0.376	S	S	.	.	H	α-helix	trans	-52.7	-48.8	175.9	-173.7	0	0	0	0	112.4	R45 L52 M53 V107	R45-C49 VanDerWaalsContact O-CB 3.27Å; R45-C49 WeakPolarHBondContact O-CB 3.27Å; R45-C49 PolarHBondContact O-N 3.47Å; C49-L52 PolarHBondContact O-N 2.92Å; C49-M53 WeakPolarHBondContact O-CB 3.42Å; C49-M53 WeakPolarHBondContact O-CG 3.49Å; C49-M53 PolarHBondContact O-N 2.99Å; C49-V107 HydrophobicContact CB-CB 4.5Å; C49-V107 HydrophobicContact CB-CG1 4.14Å; C49-V107 HydrophobicContact CB-CG2 3.55Å
50	L	88.7	Confident	87.1	Confident	107 Å²	107	74.3 Å²	74.3	56%	0.56	36%	0.364	S	S	*	.	H	α-helix	trans	-63.9	-40.8	177.7	-71.7	170.8	0	0	0	112.6	R46 Y47 W48 I54	R46-L50 VanDerWaalsContact O-CG 3.3Å; R46-L50 WeakPolarHBondContact O-CG 3.46Å; R46-L50 PolarHBondContact O-N 2.96Å; R46-L50 VanDerWaalsContact O-N 3.08Å; Y47-L50 PolarHBondContact O-N 3.28Å; W48-L50 VanDerWaalsContact C-N 3.33Å; W48-L50 PolarHBondContact O-N 3.23Å; L50-I54 WeakPolarHBondContact O-CD1 3.47Å; L50-I54 WeakPolarHBondContact O-CG1 3.3Å; L50-I54 PolarHBondContact O-N 2.82Å
51	C	88.2	Confident	87.9	Confident	64 Å²	64	74.5 Å²	74.5	43%	0.432	36%	0.36	S	S	.	.	H	α-helix	trans	-63.9	-43.5	176.6	-78.2	0	0	0	0	112.2	Y47 W48 I54 F55	Y47-C51 WeakPolarHBondContact O-CB 3.36Å; Y47-C51 PolarHBondContact O-N 2.93Å; Y47-C51 PolarHBondContact O-SG 2.97Å; W48-C51 PolarHBondContact O-N 3.25Å; W48-C51 VanDerWaalsContact O-N 3.12Å; C51-I54 PolarHBondContact O-N 3.34Å; C51-F55 WeakPolarHBondContact O-CD2 3.4Å; C51-F55 PolarHBondContact O-N 3.01Å
52	L	90	Very high	88.9	Confident	18 Å²	18	71.8 Å²	71.8	9%	0.094	35%	0.349	C	S	.	.	H	α-helix	trans	-67.9	-43.4	178.8	-64.6	175	0	0	0	111.7	W48 C49 I54 F55 S56 T103 E106 W869	W48-L52 VanDerWaalsContact O-CG 3.32Å; W48-L52 WeakPolarHBondContact O-CG 3.43Å; W48-L52 PolarHBondContact O-N 3.25Å; C49-L52 PolarHBondContact O-N 2.92Å; L52-I54 VanDerWaalsContact C-N 3.29Å; L52-I54 PolarHBondContact O-N 2.94Å; L52-F55 WeakPolarHBondContact O-CB 3.47Å; L52-F55 PolarHBondContact O-N 2.93Å; L52-S56 PolarHBondContact O-N 3.43Å; L52-S56 VanDerWaalsContact O-N 3.1Å; L52-S56 PolarHBondContact O-OG 3.1Å; L52-T103 HydrophobicContact CB-CG2 3.75Å; L52-T103 HydrophobicContact CD1-CG2 4.21Å; L52-E106 HydrophobicContact CD1-CB 4.18Å; L52-E106 HydrophobicContact CD1-CG 3.84Å; L52-W869 HydrophobicContact CB-CH2 3.9Å; L52-W869 HydrophobicContact CB-CZ2 4.07Å; L52-W869 HydrophobicContact CB-CZ3 4.43Å; L52-W869 HydrophobicContact CD1-CZ2 3.86Å; L52-W869 HydrophobicContact CD2-CD2 3.74Å; L52-W869 HydrophobicContact CD2-CE3 3.88Å; L52-W869 HydrophobicContact CD2-CG 4.36Å; L52-W869 HydrophobicContact CD2-CH2 4.05Å; L52-W869 HydrophobicContact CD2-CZ2 3.91Å; L52-W869 HydrophobicContact CD2-CZ3 4.03Å; L52-W869 HydrophobicContact CG-CH2 4.36Å; L52-W869 HydrophobicContact CG-CZ2 4.14Å
53	M	90.7	Very high	89.7	Confident	54 Å²	54	67.3 Å²	67.3	27%	0.266	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-36.2	172.5	-78	-69	100.9	0	0	113.4	C49 F55 S56 I57 P100 T103	C49-M53 WeakPolarHBondContact O-CB 3.42Å; C49-M53 WeakPolarHBondContact O-CG 3.49Å; C49-M53 PolarHBondContact O-N 2.99Å; M53-F55 VanDerWaalsContact C-N 3.3Å; M53-F55 PolarHBondContact O-N 2.94Å; M53-S56 PolarHBondContact O-N 3.5Å; M53-I57 VanDerWaalsContact O-CG1 3.28Å; M53-I57 WeakPolarHBondContact O-CG1 3.44Å; M53-I57 PolarHBondContact O-N 3.48Å; M53-P100 HydrophobicContact CE-CB 4.23Å; M53-P100 HydrophobicContact CE-CG 4.43Å; M53-T103 HydrophobicContact CE-CG2 3.88Å; M53-T103 VanDerWaalsContact CE-OG1 3.23Å; M53-T103 WeakPolarHBondContact CE-OG1 3.37Å; M53-T103 HydrophobicContact CG-CG2 4.35Å
54	I	90.6	Very high	90.6	Very high	112 Å²	112	66.3 Å²	66.3	57%	0.574	33%	0.326	S	S	*	.	H	α-helix	trans	-63.3	-35.5	174.1	-72.8	163.4	0	0	0	111.3	L50 C51 L52 A58	L50-I54 WeakPolarHBondContact O-CD1 3.47Å; L50-I54 WeakPolarHBondContact O-CG1 3.3Å; L50-I54 PolarHBondContact O-N 2.82Å; C51-I54 PolarHBondContact O-N 3.34Å; L52-I54 VanDerWaalsContact C-N 3.29Å; L52-I54 PolarHBondContact O-N 2.94Å; I54-A58 VanDerWaalsContact O-CB 3.27Å; I54-A58 WeakPolarHBondContact O-CB 3.47Å; I54-A58 PolarHBondContact O-N 3.33Å
55	F	90	Very high	91.4	Very high	96 Å²	96	64 Å²	64	42%	0.421	32%	0.316	S	S	.	.	H	α-helix	trans	-68.3	-40.1	173.1	-73.2	-69.8	0	0	0	112.6	C51 L52 M53 A58 T59	C51-F55 WeakPolarHBondContact O-CD2 3.4Å; C51-F55 PolarHBondContact O-N 3.01Å; L52-F55 WeakPolarHBondContact O-CB 3.47Å; L52-F55 PolarHBondContact O-N 2.93Å; M53-F55 VanDerWaalsContact C-N 3.3Å; M53-F55 PolarHBondContact O-N 2.94Å; F55-A58 PolarHBondContact O-N 2.92Å; F55-T59 WeakPolarHBondContact O-CB 3.33Å; F55-T59 PolarHBondContact O-N 3.5Å; F55-T59 PolarHBondContact O-OG1 3.06Å
56	S	94.3	Very high	92.2	Very high	6 Å²	6	60.7 Å²	60.7	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-47.6	174.7	-46.3	0	0	0	0	111.5	L52 M53 A58 T59 L60 M99	L52-S56 PolarHBondContact O-N 3.43Å; L52-S56 VanDerWaalsContact O-N 3.1Å; L52-S56 PolarHBondContact O-OG 3.1Å; M53-S56 PolarHBondContact O-N 3.5Å; S56-A58 PolarHBondContact O-N 2.89Å; S56-T59 WeakPolarHBondContact O-CB 3.34Å; S56-T59 PolarHBondContact O-N 2.99Å; S56-L60 WeakPolarHBondContact O-CB 3.41Å; S56-L60 PolarHBondContact O-N 2.94Å; S56-M99 WeakPolarHBondContact OG-CB 3.29Å
57	I	95	Very high	92.8	Very high	110 Å²	110	53.9 Å²	53.9	56%	0.564	28%	0.28	S	S	*	.	H	α-helix	trans	-62.6	-43	177.6	-66.6	164.6	0	0	0	111.1	M53 T59 L60 F61	M53-I57 VanDerWaalsContact O-CG1 3.28Å; M53-I57 WeakPolarHBondContact O-CG1 3.44Å; M53-I57 PolarHBondContact O-N 3.48Å; I57-T59 VanDerWaalsContact C-N 3.33Å; I57-T59 PolarHBondContact O-N 3.35Å; I57-L60 PolarHBondContact O-N 3.04Å; I57-F61 VanDerWaalsContact O-CB 3.28Å; I57-F61 WeakPolarHBondContact O-CB 3.42Å; I57-F61 PolarHBondContact O-N 2.82Å
58	A	93.9	Very high	93.4	Very high	50 Å²	50	51.2 Å²	51.2	41%	0.413	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-38.3	176.8	0	0	0	0	0	112.5	I54 F55 S56 G62	I54-A58 VanDerWaalsContact O-CB 3.27Å; I54-A58 WeakPolarHBondContact O-CB 3.47Å; I54-A58 PolarHBondContact O-N 3.33Å; F55-A58 PolarHBondContact O-N 2.92Å; S56-A58 PolarHBondContact O-N 2.89Å; A58-G62 PolarHBondContact O-N 3.27Å
59	T	96.2	Very high	94.1	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-48.5	176.3	-55.7	0	0	0	0	111.3	F55 S56 I57 N63 A95 M99 A876	F55-T59 WeakPolarHBondContact O-CB 3.33Å; F55-T59 PolarHBondContact O-N 3.5Å; F55-T59 PolarHBondContact O-OG1 3.06Å; S56-T59 WeakPolarHBondContact O-CB 3.34Å; S56-T59 PolarHBondContact O-N 2.99Å; I57-T59 VanDerWaalsContact C-N 3.33Å; I57-T59 PolarHBondContact O-N 3.35Å; T59-N63 WeakPolarHBondContact O-CB 3.33Å; T59-N63 PolarHBondContact O-N 2.87Å; T59-N63 VanDerWaalsContact O-N 3.09Å; T59-N63 PolarHBondContact O-ND2 3.16Å; T59-A95 HydrophobicContact CG2-CB 3.97Å; T59-M99 HydrophobicContact CG2-CE 3.97Å; T59-A876 WeakPolarHBondContact OG1-CB 3.32Å
60	L	97.5	Very high	94.4	Very high	60 Å²	60	46.2 Å²	46.2	31%	0.314	25%	0.25	S	C	.	.	H	α-helix	trans	-58.6	-54.4	176.8	175.2	58.4	0	0	0	110.8	S56 I57 S64 I92 A95 I96	S56-L60 WeakPolarHBondContact O-CB 3.41Å; S56-L60 PolarHBondContact O-N 2.94Å; I57-L60 PolarHBondContact O-N 3.04Å; L60-S64 VanDerWaalsContact O-CB 3.3Å; L60-S64 WeakPolarHBondContact O-CB 3.49Å; L60-S64 PolarHBondContact O-N 3.34Å; L60-S64 PolarHBondContact O-OG 3.34Å; L60-I92 HydrophobicContact CD1-CB 4.5Å; L60-I92 HydrophobicContact CD1-CG1 4.3Å; L60-I92 HydrophobicContact CD1-CG2 3.84Å; L60-A95 HydrophobicContact CB-CB 4.16Å; L60-I96 HydrophobicContact CD1-CD1 3.9Å; L60-I96 HydrophobicContact CD1-CG1 4.02Å; L60-I96 HydrophobicContact CD2-CG1 4.38Å
61	F	96.2	Very high	94.7	Very high	117 Å²	117	45.2 Å²	45.2	51%	0.513	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-48.6	-178	177.1	-104.9	0	0	0	112.4	I57 N63 S64 L65 L897	I57-F61 VanDerWaalsContact O-CB 3.28Å; I57-F61 WeakPolarHBondContact O-CB 3.42Å; I57-F61 PolarHBondContact O-N 2.82Å; F61-N63 PolarHBondContact O-N 3.5Å; F61-S64 PolarHBondContact O-N 3.17Å; F61-L65 HydrophobicContact CD1-CD1 4.15Å; F61-L65 HydrophobicContact CE1-CD1 3.62Å; F61-L65 HydrophobicContact CE1-CG 4.49Å; F61-L65 HydrophobicContact CE2-CD1 4.46Å; F61-L65 HydrophobicContact CZ-CD1 3.8Å; F61-L65 HydrophobicContact CZ-CG 4.41Å; F61-L65 PolarHBondContact O-N 3.35Å; F61-L897 HydrophobicContact CZ-CD2 3.96Å
62	G	96.4	Very high	95	Very high	9 Å²	9	49.5 Å²	49.5	9%	0.093	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-44.5	-178.6	0	0	0	0	0	112.7	A58 L65 V66 P879	A58-G62 PolarHBondContact O-N 3.27Å; G62-L65 PolarHBondContact O-N 3.14Å; G62-V66 PolarHBondContact O-N 2.94Å; G62-P879 WeakPolarHBondContact O-CG 3.46Å
63	N	97.5	Very high	95.2	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-75	-29.3	178.7	-72.5	-63.8	0	0	0	112.4	T59 F61 L65 V66 V67 A88 D91 I92 S875 P879	T59-N63 WeakPolarHBondContact O-CB 3.33Å; T59-N63 PolarHBondContact O-N 2.87Å; T59-N63 VanDerWaalsContact O-N 3.09Å; T59-N63 PolarHBondContact O-ND2 3.16Å; F61-N63 PolarHBondContact O-N 3.5Å; N63-L65 VanDerWaalsContact C-N 3.32Å; N63-L65 PolarHBondContact O-N 2.94Å; N63-V66 WeakPolarHBondContact O-CB 3.41Å; N63-V66 PolarHBondContact O-N 3.39Å; N63-V66 VanDerWaalsContact O-N 3.11Å; N63-V67 PolarHBondContact O-N 3.01Å; N63-A88 HydrophobicContact CB-CB 4.04Å; N63-D91 HydrophobicContact CB-CB 4.46Å; N63-I92 HydrophobicContact CB-CD1 4.18Å; N63-I92 HydrophobicContact CB-CG1 3.79Å; N63-S875 PolarHBondContact ND2-O 2.95Å; N63-P879 WeakPolarHBondContact OD1-CG 3.38Å
64	S	97.6	Very high	95.2	Very high	36 Å²	36	58 Å²	58	25%	0.252	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-41.1	170	-60	0	0	0	0	111.5	L60 F61 V66 V67 L68	L60-S64 VanDerWaalsContact O-CB 3.3Å; L60-S64 WeakPolarHBondContact O-CB 3.49Å; L60-S64 PolarHBondContact O-N 3.34Å; L60-S64 PolarHBondContact O-OG 3.34Å; F61-S64 PolarHBondContact O-N 3.17Å; S64-V66 VanDerWaalsContact C-N 3.33Å; S64-V66 PolarHBondContact O-N 3.19Å; S64-V67 PolarHBondContact O-N 3.05Å; S64-L68 WeakPolarHBondContact O-CB 3.43Å; S64-L68 VanDerWaalsContact O-CG 3.28Å; S64-L68 WeakPolarHBondContact O-CG 3.48Å; S64-L68 PolarHBondContact O-N 2.95Å
65	L	96.5	Very high	95.2	Very high	16 Å²	16	55.8 Å²	55.8	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-34.1	173	-69.6	174.9	0	0	0	113.1	F61 G62 N63 S69 F893 L896 L897	F61-L65 HydrophobicContact CD1-CD1 4.15Å; F61-L65 HydrophobicContact CE1-CD1 3.62Å; F61-L65 HydrophobicContact CE1-CG 4.49Å; F61-L65 HydrophobicContact CE2-CD1 4.46Å; F61-L65 HydrophobicContact CZ-CD1 3.8Å; F61-L65 HydrophobicContact CZ-CG 4.41Å; F61-L65 PolarHBondContact O-N 3.35Å; G62-L65 PolarHBondContact O-N 3.14Å; N63-L65 VanDerWaalsContact C-N 3.32Å; N63-L65 PolarHBondContact O-N 2.94Å; L65-S69 VanDerWaalsContact O-CB 3.23Å; L65-S69 WeakPolarHBondContact O-CB 3.46Å; L65-S69 PolarHBondContact O-N 3.22Å; L65-S69 PolarHBondContact O-OG 2.93Å; L65-F893 HydrophobicContact CB-CD2 4.22Å; L65-F893 HydrophobicContact CB-CE1 4.1Å; L65-F893 HydrophobicContact CB-CE2 3.73Å; L65-F893 HydrophobicContact CB-CZ 3.65Å; L65-F893 HydrophobicContact CD1-CD2 4.09Å; L65-F893 HydrophobicContact CD1-CE2 4.07Å; L65-L896 HydrophobicContact CD2-CB 4.4Å; L65-L896 HydrophobicContact CD2-CD1 4.41Å; L65-L897 HydrophobicContact CD1-CD1 4.06Å; L65-L897 HydrophobicContact CD1-CD2 4.18Å; L65-L897 HydrophobicContact CD1-CG 4.4Å; L65-L897 HydrophobicContact CD2-CD2 3.98Å; L65-L897 HydrophobicContact CD2-CG 4.39Å
66	V	96.9	Very high	95.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-49.4	173.4	176.3	0	0	0	0	110.5	G62 N63 S64 S69 V70 I84 A88 P879 Y882 F889 F893	G62-V66 PolarHBondContact O-N 2.94Å; N63-V66 WeakPolarHBondContact O-CB 3.41Å; N63-V66 PolarHBondContact O-N 3.39Å; N63-V66 VanDerWaalsContact O-N 3.11Å; S64-V66 VanDerWaalsContact C-N 3.33Å; S64-V66 PolarHBondContact O-N 3.19Å; V66-S69 WeakPolarHBondContact O-CB 3.48Å; V66-S69 PolarHBondContact O-N 3.23Å; V66-V70 PolarHBondContact O-N 3.24Å; V66-I84 HydrophobicContact CG1-CG2 3.5Å; V66-A88 HydrophobicContact CB-CB 4.14Å; V66-A88 HydrophobicContact CG1-CB 4.01Å; V66-P879 HydrophobicContact CG2-CB 4.25Å; V66-P879 HydrophobicContact CG2-CG 4.11Å; V66-Y882 HydrophobicContact CG1-CD2 4.49Å; V66-Y882 HydrophobicContact CG1-CE2 4.44Å; V66-Y882 HydrophobicContact CG2-CD2 3.86Å; V66-Y882 HydrophobicContact CG2-CE2 4.31Å; V66-F889 HydrophobicContact CG1-CE1 4.12Å; V66-F889 HydrophobicContact CG1-CZ 4.34Å; V66-F893 HydrophobicContact CG2-CE1 4.4Å; V66-F893 HydrophobicContact CG2-CZ 3.81Å
67	V	97.7	Very high	95.3	Very high	25 Å²	25	57 Å²	57	15%	0.152	28%	0.277	C	S	.	.	H	α-helix	trans	-62.2	-51.7	178.8	177.1	0	0	0	0	110.9	N63 S64 S69 V70 I71 V85 A88 I89 I92	N63-V67 PolarHBondContact O-N 3.01Å; S64-V67 PolarHBondContact O-N 3.05Å; V67-S69 VanDerWaalsContact C-N 3.25Å; V67-S69 PolarHBondContact O-N 3.34Å; V67-V70 PolarHBondContact O-N 3.14Å; V67-I71 HydrophobicContact CG1-CD1 3.71Å; V67-I71 HydrophobicContact CG1-CG1 4.45Å; V67-I71 WeakPolarHBondContact O-CG1 3.35Å; V67-I71 PolarHBondContact O-N 2.94Å; V67-V85 HydrophobicContact CG1-CG1 4.41Å; V67-V85 HydrophobicContact CG2-CG1 4.38Å; V67-A88 HydrophobicContact CG2-CB 3.74Å; V67-I89 HydrophobicContact CG2-CG1 4.41Å; V67-I92 HydrophobicContact CG2-CD1 4.12Å
68	L	96.4	Very high	95	Very high	87 Å²	87	54.6 Å²	54.6	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-60	-33.5	178.7	-70.7	171.4	0	0	0	112.7	S64 R72 L896	S64-L68 WeakPolarHBondContact O-CB 3.43Å; S64-L68 VanDerWaalsContact O-CG 3.28Å; S64-L68 WeakPolarHBondContact O-CG 3.48Å; S64-L68 PolarHBondContact O-N 2.95Å; L68-R72 VanDerWaalsContact O-CB 3.25Å; L68-R72 WeakPolarHBondContact O-CB 3.41Å; L68-R72 PolarHBondContact O-N 3.37Å; L68-L896 HydrophobicContact CB-CD1 4.12Å; L68-L896 HydrophobicContact CB-CD2 4.28Å
69	S	95.9	Very high	94.7	Very high	1 Å²	1	53 Å²	53	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-50.1	175.7	-67	0	0	0	0	111.9	L65 V66 V67 I71 E73 F893 L896	L65-S69 VanDerWaalsContact O-CB 3.23Å; L65-S69 WeakPolarHBondContact O-CB 3.46Å; L65-S69 PolarHBondContact O-N 3.22Å; L65-S69 PolarHBondContact O-OG 2.93Å; V66-S69 WeakPolarHBondContact O-CB 3.48Å; V66-S69 PolarHBondContact O-N 3.23Å; V67-S69 VanDerWaalsContact C-N 3.25Å; V67-S69 PolarHBondContact O-N 3.34Å; S69-I71 VanDerWaalsContact C-N 3.32Å; S69-I71 PolarHBondContact O-N 3.21Å; S69-E73 VanDerWaalsContact O-CB 3.32Å; S69-E73 WeakPolarHBondContact O-CB 3.38Å; S69-E73 PolarHBondContact O-N 3.39Å; S69-F893 WeakPolarHBondContact OG-CD1 3.42Å; S69-F893 VanDerWaalsContact OG-CE1 3.23Å; S69-F893 WeakPolarHBondContact OG-CE1 3.26Å; S69-L896 VanDerWaalsContact OG-CD1 3.24Å; S69-L896 WeakPolarHBondContact OG-CD1 3.36Å
70	V	95.7	Very high	94.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-34.7	-179.9	-179	0	0	0	0	111.3	V66 V67 L76 R77 N81 V85 F889	V66-V70 PolarHBondContact O-N 3.24Å; V67-V70 PolarHBondContact O-N 3.14Å; V70-L76 HydrophobicContact CG2-CB 4.44Å; V70-R77 WeakPolarHBondContact O-CG 3.27Å; V70-N81 HydrophobicContact CG1-CB 4.23Å; V70-N81 HydrophobicContact CG2-CB 4.06Å; V70-V85 HydrophobicContact CB-CG2 3.59Å; V70-V85 HydrophobicContact CG1-CG2 3.74Å; V70-V85 HydrophobicContact CG2-CG2 3.76Å; V70-F889 HydrophobicContact CG2-CE1 3.7Å; V70-F889 HydrophobicContact CG2-CZ 3.69Å
71	I	95	Very high	94.2	Very high	87 Å²	87	51.2 Å²	51.2	45%	0.446	24%	0.243	S	C	.	.	H	α-helix	trans	-68.2	-52.6	175.5	-65.8	174.3	0	0	0	111	V67 S69 R77	V67-I71 HydrophobicContact CG1-CD1 3.71Å; V67-I71 HydrophobicContact CG1-CG1 4.45Å; V67-I71 WeakPolarHBondContact O-CG1 3.35Å; V67-I71 PolarHBondContact O-N 2.94Å; S69-I71 VanDerWaalsContact C-N 3.32Å; S69-I71 PolarHBondContact O-N 3.21Å; I71-R77 VanDerWaalsContact O-CZ 3.28Å; I71-R77 PolarHBondContact O-NE 3.3Å; I71-R77 PolarHBondContact O-NH2 3.16Å
72	R	94.2	Very high	94.1	Very high	154 Å²	154	49.3 Å²	49.3	58%	0.581	23%	0.232	S	C	*	.	H	α-helix	trans	-72.9	-44.6	-173.2	-170.7	176.3	-179.9	-172.4	-1.4	113.2	L68 R74	L68-R72 VanDerWaalsContact O-CB 3.25Å; L68-R72 WeakPolarHBondContact O-CB 3.41Å; L68-R72 PolarHBondContact O-N 3.37Å; R72-R74 PolarHBondContact O-N 3.48Å
73	E	94.4	Very high	94.1	Very high	39 Å²	39	49 Å²	49	18%	0.182	23%	0.228	C	C	.	.			trans	-89.6	107.4	-171.9	175.9	51.9	-104.1	0	0	111.2	S69 S75 L76 A892 K895	S69-E73 VanDerWaalsContact O-CB 3.32Å; S69-E73 WeakPolarHBondContact O-CB 3.38Å; S69-E73 PolarHBondContact O-N 3.39Å; E73-S75 VanDerWaalsContact CG-OG 3.27Å; E73-S75 WeakPolarHBondContact CG-OG 3.35Å; E73-S75 PolarHBondContact O-N 3.26Å; E73-S75 VanDerWaalsContact O-N 3.15Å; E73-S75 WeakPolarHBondContact OE1-CB 3.36Å; E73-S75 PolarHBondContact OE1-N 3.3Å; E73-S75 PolarHBondContact OE1-OG 3.15Å; E73-L76 HydrophobicContact CB-CB 4.36Å; E73-L76 HydrophobicContact CB-CD1 4.08Å; E73-L76 HydrophobicContact CB-CG 4.23Å; E73-L76 HydrophobicContact CG-CB 4.3Å; E73-L76 HydrophobicContact CG-CD1 4.1Å; E73-L76 HydrophobicContact CG-CG 3.88Å; E73-L76 PolarHBondContact O-N 2.92Å; E73-A892 HydrophobicContact CB-CB 4.37Å; E73-K895 IonicContact OE2-NZ 3.77Å; E73-K895 PolarHBondContact OE2-NZ 2.95Å
74	R	91.3	Very high	93.9	Very high	210 Å²	210	49.5 Å²	49.5	79%	0.792	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-57	-32.6	-177	-68.3	-174.7	-177.3	-175.6	1.4	112.7	R72 L76 R77	R72-R74 PolarHBondContact O-N 3.48Å; R74-L76 VanDerWaalsContact C-N 3.26Å; R74-L76 PolarHBondContact O-N 3.15Å; R74-R77 PolarHBondContact O-N 3.21Å
75	S	91.2	Very high	93.9	Very high	66 Å²	66	48.3 Å²	48.3	46%	0.462	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-68.6	-21.8	177.4	59.4	0	0	0	0	113.9	E73	E73-S75 VanDerWaalsContact CG-OG 3.27Å; E73-S75 WeakPolarHBondContact CG-OG 3.35Å; E73-S75 PolarHBondContact O-N 3.26Å; E73-S75 VanDerWaalsContact O-N 3.15Å; E73-S75 WeakPolarHBondContact OE1-CB 3.36Å; E73-S75 PolarHBondContact OE1-N 3.3Å; E73-S75 PolarHBondContact OE1-OG 3.15Å
76	L	92.3	Very high	94	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-85.2	-8.3	175.5	-72	178.7	0	0	0	114	V70 E73 R74 N78 N81 E888 F889 A892	V70-L76 HydrophobicContact CG2-CB 4.44Å; E73-L76 HydrophobicContact CB-CB 4.36Å; E73-L76 HydrophobicContact CB-CD1 4.08Å; E73-L76 HydrophobicContact CB-CG 4.23Å; E73-L76 HydrophobicContact CG-CB 4.3Å; E73-L76 HydrophobicContact CG-CD1 4.1Å; E73-L76 HydrophobicContact CG-CG 3.88Å; E73-L76 PolarHBondContact O-N 2.92Å; R74-L76 VanDerWaalsContact C-N 3.26Å; R74-L76 PolarHBondContact O-N 3.15Å; L76-N78 PolarHBondContact O-N 3.21Å; L76-N81 WeakPolarHBondContact CD2-ND2 3.5Å; L76-N81 WeakPolarHBondContact O-CB 3.31Å; L76-N81 PolarHBondContact O-ND2 3.07Å; L76-E888 HydrophobicContact CD2-CB 3.7Å; L76-F889 HydrophobicContact CD1-CD1 3.9Å; L76-F889 HydrophobicContact CD1-CE1 4.01Å; L76-F889 HydrophobicContact CD1-CG 4.48Å; L76-A892 HydrophobicContact CD1-CB 3.6Å
77	R	92.6	Very high	94	Very high	129 Å²	129	47.8 Å²	47.8	49%	0.487	22%	0.22	S	C	.	.			trans	-75.6	43.6	-175.8	-64.8	-178.7	-177.8	-172.8	1.2	114.5	V70 I71 R74	V70-R77 WeakPolarHBondContact O-CG 3.27Å; I71-R77 VanDerWaalsContact O-CZ 3.28Å; I71-R77 PolarHBondContact O-NE 3.3Å; I71-R77 PolarHBondContact O-NH2 3.16Å; R74-R77 PolarHBondContact O-N 3.21Å
78	N	88.8	Confident	94	Very high	59 Å²	59	46.7 Å²	46.7	32%	0.316	21%	0.213	S	C	.	.	S	Bend	trans	-97.7	164.9	-177.9	75.9	61.6	0	0	0	113.4	L76 T80 N81 W82	L76-N78 PolarHBondContact O-N 3.21Å; N78-T80 VanDerWaalsContact C-N 3.32Å; N78-T80 PolarHBondContact O-N 3.46Å; N78-T80 PolarHBondContact OD1-N 3.41Å; N78-N81 PolarHBondContact ND2-ND2 2.78Å; N78-N81 PolarHBondContact O-N 3.4Å; N78-N81 VanDerWaalsContact O-N 3.12Å; N78-N81 PolarHBondContact OD1-N 3.1Å; N78-N81 VanDerWaalsContact OD1-N 3.09Å; N78-W82 PolarHBondContact O-N 3.04Å
79	A	88.7	Confident	94.1	Very high	17 Å²	17	46.1 Å²	46.1	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-54.1	-38.8	-175.2	0	0	0	0	0	115	N159 V163	A79-N159 HydrophobicContact CB-CB 3.73Å; A79-V163 HydrophobicContact CB-CG2 3.89Å; A79-V163 WeakPolarHBondContact O-CG2 3.05Å
80	T	89.7	Confident	94.2	Very high	14 Å²	14	46 Å²	46	9%	0.086	21%	0.209	C	C	.	.	H	α-helix	trans	-76.9	-35.8	-179.9	-49.3	0	0	0	0	111.4	N78 W82 F83 I84 I140 D143 R144	N78-T80 VanDerWaalsContact C-N 3.32Å; N78-T80 PolarHBondContact O-N 3.46Å; N78-T80 PolarHBondContact OD1-N 3.41Å; T80-W82 VanDerWaalsContact C-N 3.28Å; T80-W82 PolarHBondContact O-N 3.28Å; T80-F83 WeakPolarHBondContact O-CB 3.22Å; T80-F83 PolarHBondContact O-N 3.04Å; T80-F83 VanDerWaalsContact O-N 3.14Å; T80-I84 PolarHBondContact O-N 3.12Å; T80-I140 HydrophobicContact CG2-CG2 4.37Å; T80-D143 PolarHBondContact OG1-OD2 2.68Å; T80-R144 PolarHBondContact OG1-NE 3.36Å; T80-R144 PolarHBondContact OG1-NH1 3.29Å; T80-R144 PolarHBondContact OG1-NH2 2.83Å
81	N	92.9	Very high	94.3	Very high	8 Å²	8	46 Å²	46	4%	0.043	21%	0.209	C	C	.	.	H	α-helix	trans	-69.2	-25.3	-179.8	-71.7	4.3	0	0	0	112.8	V70 L76 N78 F83 I84 V85	V70-N81 HydrophobicContact CG1-CB 4.23Å; V70-N81 HydrophobicContact CG2-CB 4.06Å; L76-N81 WeakPolarHBondContact CD2-ND2 3.5Å; L76-N81 WeakPolarHBondContact O-CB 3.31Å; L76-N81 PolarHBondContact O-ND2 3.07Å; N78-N81 PolarHBondContact ND2-ND2 2.78Å; N78-N81 PolarHBondContact O-N 3.4Å; N78-N81 VanDerWaalsContact O-N 3.12Å; N78-N81 PolarHBondContact OD1-N 3.1Å; N78-N81 VanDerWaalsContact OD1-N 3.09Å; N81-F83 VanDerWaalsContact C-N 3.34Å; N81-I84 CarbonylContact O-C 3.55Å; N81-I84 WeakPolarHBondContact O-CA 3.42Å; N81-I84 WeakPolarHBondContact O-CB 3.41Å; N81-I84 PolarHBondContact O-N 2.98Å; N81-I84 VanDerWaalsContact O-N 3.12Å; N81-V85 WeakPolarHBondContact O-CG2 3.46Å; N81-V85 PolarHBondContact O-N 3.35Å
82	W	95.1	Very high	94.4	Very high	77 Å²	77	43.3 Å²	43.3	29%	0.292	20%	0.195	S	C	.	.	H	α-helix	trans	-65.6	-32.4	170	-73.6	112.6	0	0	0	113.4	N78 T80 I84 V85 S86 M160 V163	N78-W82 PolarHBondContact O-N 3.04Å; T80-W82 VanDerWaalsContact C-N 3.28Å; T80-W82 PolarHBondContact O-N 3.28Å; W82-I84 VanDerWaalsContact C-N 3.35Å; W82-V85 PolarHBondContact O-N 3.2Å; W82-S86 PolarHBondContact O-N 3.5Å; W82-M160 VanDerWaalsContact CD1-SD 3.56Å; W82-M160 HydrophobicContact CD2-CE 3.88Å; W82-M160 HydrophobicContact CG-CE 3.92Å; W82-M160 HydrophobicContact CG-SD 4.15Å; W82-M160 HydrophobicContact CZ2-CE 4.33Å; W82-V163 HydrophobicContact CB-CG1 3.85Å
83	F	95	Very high	94.6	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-68.5	-35.2	168.1	-68.4	-66.5	0	0	0	112.1	T80 N81 V85 S86 L87 A139 I140 D143 V163 I167	T80-F83 WeakPolarHBondContact O-CB 3.22Å; T80-F83 PolarHBondContact O-N 3.04Å; T80-F83 VanDerWaalsContact O-N 3.14Å; N81-F83 VanDerWaalsContact C-N 3.34Å; F83-V85 VanDerWaalsContact C-N 3.31Å; F83-V85 PolarHBondContact O-N 3.38Å; F83-S86 PolarHBondContact O-N 3.12Å; F83-L87 WeakPolarHBondContact O-CB 3.35Å; F83-L87 PolarHBondContact O-N 2.96Å; F83-A139 HydrophobicContact CD1-CB 3.76Å; F83-A139 HydrophobicContact CE1-CB 3.6Å; F83-A139 HydrophobicContact CG-CB 4.5Å; F83-A139 HydrophobicContact CZ-CB 4.2Å; F83-I140 HydrophobicContact CB-CD1 4.15Å; F83-I140 HydrophobicContact CB-CG1 3.49Å; F83-I140 VanDerWaalsContact CB-CG1 3.49Å; F83-I140 HydrophobicContact CG-CG1 4.25Å; F83-D143 HydrophobicContact CD2-CB 4.36Å; F83-D143 HydrophobicContact CE2-CB 3.8Å; F83-V163 HydrophobicContact CD1-CG1 4.24Å; F83-V163 HydrophobicContact CD2-CG1 4.1Å; F83-V163 HydrophobicContact CD2-CG2 4.44Å; F83-V163 HydrophobicContact CE1-CG1 4.04Å; F83-V163 HydrophobicContact CE2-CB 4.24Å; F83-V163 HydrophobicContact CE2-CG1 3.91Å; F83-V163 HydrophobicContact CE2-CG2 3.73Å; F83-V163 HydrophobicContact CG-CG1 4.27Å; F83-V163 HydrophobicContact CZ-CB 4.14Å; F83-V163 HydrophobicContact CZ-CG1 3.88Å; F83-V163 HydrophobicContact CZ-CG2 4.03Å; F83-I167 HydrophobicContact CD1-CD1 4.15Å; F83-I167 HydrophobicContact CD1-CG1 3.61Å; F83-I167 HydrophobicContact CE1-CG1 3.8Å
84	I	95	Very high	94.7	Very high	13 Å²	13	35.5 Å²	35.5	7%	0.067	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-34.5	175.1	-64.5	173.8	0	0	0	111	V66 T80 N81 W82 A88 I140 Y882 F889	V66-I84 HydrophobicContact CG1-CG2 3.5Å; T80-I84 PolarHBondContact O-N 3.12Å; N81-I84 CarbonylContact O-C 3.55Å; N81-I84 WeakPolarHBondContact O-CA 3.42Å; N81-I84 WeakPolarHBondContact O-CB 3.41Å; N81-I84 PolarHBondContact O-N 2.98Å; N81-I84 VanDerWaalsContact O-N 3.12Å; W82-I84 VanDerWaalsContact C-N 3.35Å; I84-A88 WeakPolarHBondContact O-CB 3.47Å; I84-A88 PolarHBondContact O-N 3.04Å; I84-I140 HydrophobicContact CG1-CD1 3.98Å; I84-Y882 HydrophobicContact CD1-CE1 4.02Å; I84-Y882 HydrophobicContact CG1-CE1 4.5Å; I84-Y882 HydrophobicContact CG2-CD2 4.43Å; I84-Y882 HydrophobicContact CG2-CE1 4.33Å; I84-Y882 HydrophobicContact CG2-CE2 3.7Å; I84-F889 HydrophobicContact CD1-CE2 4.09Å; I84-F889 HydrophobicContact CG2-CE2 4.4Å; I84-F889 HydrophobicContact CG2-CZ 4.04Å
85	V	97.2	Very high	95	Very high	10 Å²	10	25.8 Å²	25.8	6%	0.061	13%	0.133	C	C	.	.	H	α-helix	trans	-65.5	-45.4	170.3	170.6	0	0	0	0	111.2	V67 V70 N81 W82 F83 L87 A88 I89	V67-V85 HydrophobicContact CG1-CG1 4.41Å; V67-V85 HydrophobicContact CG2-CG1 4.38Å; V70-V85 HydrophobicContact CB-CG2 3.59Å; V70-V85 HydrophobicContact CG1-CG2 3.74Å; V70-V85 HydrophobicContact CG2-CG2 3.76Å; N81-V85 WeakPolarHBondContact O-CG2 3.46Å; N81-V85 PolarHBondContact O-N 3.35Å; W82-V85 PolarHBondContact O-N 3.2Å; F83-V85 VanDerWaalsContact C-N 3.31Å; F83-V85 PolarHBondContact O-N 3.38Å; V85-L87 VanDerWaalsContact C-N 3.34Å; V85-L87 PolarHBondContact O-N 3.24Å; V85-A88 PolarHBondContact O-N 3.01Å; V85-I89 HydrophobicContact CG1-CD1 3.83Å; V85-I89 HydrophobicContact CG1-CG1 4.46Å; V85-I89 VanDerWaalsContact O-CG1 3.31Å; V85-I89 WeakPolarHBondContact O-CG1 3.45Å; V85-I89 PolarHBondContact O-N 3.21Å
86	S	97.8	Very high	95.3	Very high	5 Å²	5	27 Å²	27	4%	0.035	13%	0.133	C	C	.	.	H	α-helix	trans	-60.8	-40.4	176.5	175.3	0	0	0	0	112.8	W82 F83 I89 A90 N136 W171	W82-S86 PolarHBondContact O-N 3.5Å; F83-S86 PolarHBondContact O-N 3.12Å; S86-I89 PolarHBondContact O-N 2.91Å; S86-A90 PolarHBondContact O-N 2.68Å; S86-N136 WeakPolarHBondContact CB-OD1 3.43Å; S86-N136 PolarHBondContact OG-ND2 2.99Å; S86-N136 PolarHBondContact OG-OD1 3.18Å; S86-W171 PolarHBondContact OG-NE1 3.39Å
87	L	96.5	Very high	95.5	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-49.7	170.9	176.6	59.4	0	0	0	111.9	F83 V85 I89 A90 D91 S133 N136 L137 I140	F83-L87 WeakPolarHBondContact O-CB 3.35Å; F83-L87 PolarHBondContact O-N 2.96Å; V85-L87 VanDerWaalsContact C-N 3.34Å; V85-L87 PolarHBondContact O-N 3.24Å; L87-I89 VanDerWaalsContact C-N 3.28Å; L87-I89 PolarHBondContact O-N 3.14Å; L87-A90 PolarHBondContact O-N 3.3Å; L87-A90 VanDerWaalsContact O-N 3.15Å; L87-D91 PolarHBondContact O-N 3.17Å; L87-S133 WeakPolarHBondContact CD1-O 3.46Å; L87-S133 WeakPolarHBondContact CD1-OG 3.25Å; L87-N136 HydrophobicContact CB-CB 3.97Å; L87-N136 HydrophobicContact CD1-CB 4.21Å; L87-L137 HydrophobicContact CD2-CD2 3.8Å; L87-L137 HydrophobicContact CD2-CG 4.41Å; L87-I140 HydrophobicContact CD2-CD1 4.24Å
88	A	97.8	Very high	95.7	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-33.1	179.1	0	0	0	0	0	112.6	N63 V66 V67 I84 V85 D91 I92	N63-A88 HydrophobicContact CB-CB 4.04Å; V66-A88 HydrophobicContact CB-CB 4.14Å; V66-A88 HydrophobicContact CG1-CB 4.01Å; V67-A88 HydrophobicContact CG2-CB 3.74Å; I84-A88 WeakPolarHBondContact O-CB 3.47Å; I84-A88 PolarHBondContact O-N 3.04Å; V85-A88 PolarHBondContact O-N 3.01Å; A88-D91 PolarHBondContact O-N 3.04Å; A88-I92 WeakPolarHBondContact O-CB 3.14Å; A88-I92 WeakPolarHBondContact O-CD1 3.41Å; A88-I92 WeakPolarHBondContact O-CG1 3.43Å; A88-I92 PolarHBondContact O-N 3.41Å
89	I	98.2	Very high	96	Very high	75 Å²	75	21.4 Å²	21.4	39%	0.385	11%	0.113	S	C	.	.	H	α-helix	trans	-66.2	-43.8	173.4	-70.8	164.6	0	0	0	111	V67 V85 S86 L87 I92 S93 W171	V67-I89 HydrophobicContact CG2-CG1 4.41Å; V85-I89 HydrophobicContact CG1-CD1 3.83Å; V85-I89 HydrophobicContact CG1-CG1 4.46Å; V85-I89 VanDerWaalsContact O-CG1 3.31Å; V85-I89 WeakPolarHBondContact O-CG1 3.45Å; V85-I89 PolarHBondContact O-N 3.21Å; S86-I89 PolarHBondContact O-N 2.91Å; L87-I89 VanDerWaalsContact C-N 3.28Å; L87-I89 PolarHBondContact O-N 3.14Å; I89-I92 PolarHBondContact O-N 3.39Å; I89-S93 PolarHBondContact O-N 3.39Å; I89-S93 PolarHBondContact O-OG 3.13Å; I89-W171 HydrophobicContact CG2-CH2 4.46Å; I89-W171 HydrophobicContact CG2-CZ2 4.14Å
90	A	98	Very high	96.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.7	-43.9	174.9	0	0	0	0	0	111.9	S86 L87 I92 S93 L94 A132 W171	S86-A90 PolarHBondContact O-N 2.68Å; L87-A90 PolarHBondContact O-N 3.3Å; L87-A90 VanDerWaalsContact O-N 3.15Å; A90-I92 VanDerWaalsContact C-N 3.34Å; A90-I92 PolarHBondContact O-N 2.97Å; A90-S93 PolarHBondContact O-N 3.21Å; A90-L94 WeakPolarHBondContact O-CB 3.4Å; A90-L94 PolarHBondContact O-N 3.29Å; A90-A132 HydrophobicContact CB-CB 3.97Å; A90-W171 HydrophobicContact CB-CH2 3.86Å; A90-W171 HydrophobicContact CB-CZ2 3.98Å
91	D	97.6	Very high	96.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.5	-32.4	176.6	-72	-18.7	0	0	0	112.8	N63 L87 A88 A95 S133 S875 N878	N63-D91 HydrophobicContact CB-CB 4.46Å; L87-D91 PolarHBondContact O-N 3.17Å; A88-D91 PolarHBondContact O-N 3.04Å; D91-A95 WeakPolarHBondContact O-CB 3.43Å; D91-A95 PolarHBondContact O-N 3.33Å; D91-A95 VanDerWaalsContact O-N 3.13Å; D91-S133 PolarHBondContact OD1-OG 2.97Å; D91-S875 VanDerWaalsContact CG-CB 3.42Å; D91-S875 VanDerWaalsContact CG-OG 3.27Å; D91-S875 VanDerWaalsContact OD1-CB 3.31Å; D91-S875 WeakPolarHBondContact OD1-CB 3.4Å; D91-S875 PolarHBondContact OD1-OG 2.79Å; D91-N878 PolarHBondContact OD2-ND2 2.86Å
92	I	98.3	Very high	96.4	Very high	30 Å²	30	24.6 Å²	24.6	15%	0.154	13%	0.13	C	C	.	.	H	α-helix	trans	-68.4	-48	172.2	-75.4	163.7	0	0	0	110.9	L60 N63 V67 A88 I89 A90 L94 A95 I96	L60-I92 HydrophobicContact CD1-CB 4.5Å; L60-I92 HydrophobicContact CD1-CG1 4.3Å; L60-I92 HydrophobicContact CD1-CG2 3.84Å; N63-I92 HydrophobicContact CB-CD1 4.18Å; N63-I92 HydrophobicContact CB-CG1 3.79Å; V67-I92 HydrophobicContact CG2-CD1 4.12Å; A88-I92 WeakPolarHBondContact O-CB 3.14Å; A88-I92 WeakPolarHBondContact O-CD1 3.41Å; A88-I92 WeakPolarHBondContact O-CG1 3.43Å; A88-I92 PolarHBondContact O-N 3.41Å; I89-I92 PolarHBondContact O-N 3.39Å; A90-I92 VanDerWaalsContact C-N 3.34Å; A90-I92 PolarHBondContact O-N 2.97Å; I92-L94 VanDerWaalsContact C-N 3.3Å; I92-L94 PolarHBondContact O-N 2.81Å; I92-A95 PolarHBondContact O-N 3.39Å; I92-A95 VanDerWaalsContact O-N 3.14Å; I92-I96 HydrophobicContact CG2-CD1 3.74Å; I92-I96 WeakPolarHBondContact O-CG1 3.32Å; I92-I96 PolarHBondContact O-N 3.43Å
93	S	98.1	Very high	96.3	Very high	28 Å²	28	21 Å²	21	20%	0.196	12%	0.117	C	C	.	.	H	α-helix	trans	-60.9	-39.8	177.9	-64.3	0	0	0	0	111.9	I89 A90 I96 L97 F129	I89-S93 PolarHBondContact O-N 3.39Å; I89-S93 PolarHBondContact O-OG 3.13Å; A90-S93 PolarHBondContact O-N 3.21Å; S93-I96 PolarHBondContact O-N 3.18Å; S93-L97 WeakPolarHBondContact O-CB 3.27Å; S93-L97 PolarHBondContact O-N 3.3Å; S93-F129 VanDerWaalsContact CB-CE1 3.41Å
94	L	97.3	Very high	96.1	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-46.8	172.6	-170.9	73.2	0	0	0	111.6	A90 I92 I96 V98 M99 F129 C130 Y872	A90-L94 WeakPolarHBondContact O-CB 3.4Å; A90-L94 PolarHBondContact O-N 3.29Å; I92-L94 VanDerWaalsContact C-N 3.3Å; I92-L94 PolarHBondContact O-N 2.81Å; L94-I96 VanDerWaalsContact C-N 3.29Å; L94-I96 PolarHBondContact O-N 2.86Å; L94-V98 HydrophobicContact CD1-CB 3.82Å; L94-V98 HydrophobicContact CD1-CG1 3.99Å; L94-V98 HydrophobicContact CD1-CG2 3.98Å; L94-V98 HydrophobicContact CG-CB 4.49Å; L94-V98 WeakPolarHBondContact O-CB 3.45Å; L94-V98 PolarHBondContact O-N 2.94Å; L94-V98 VanDerWaalsContact O-N 3.09Å; L94-M99 HydrophobicContact CD2-CE 3.7Å; L94-M99 HydrophobicContact CG-CE 3.92Å; L94-M99 PolarHBondContact O-N 3.3Å; L94-F129 HydrophobicContact CB-CB 4.15Å; L94-F129 HydrophobicContact CD1-CB 4.17Å; L94-C130 VanDerWaalsContact CD1-SG 3.58Å; L94-Y872 HydrophobicContact CD1-CD1 4.46Å; L94-Y872 HydrophobicContact CD1-CE1 4.07Å; L94-Y872 HydrophobicContact CD2-CD1 3.94Å; L94-Y872 HydrophobicContact CD2-CE1 4.37Å; L94-Y872 HydrophobicContact CG-CD1 4.47Å
95	A	97.3	Very high	95.9	Very high	5 Å²	5	27.3 Å²	27.3	4%	0.041	14%	0.143	C	C	.	.	H	α-helix	trans	-66.9	-25.2	-179.9	0	0	0	0	0	114.3	T59 L60 D91 I92 M99	T59-A95 HydrophobicContact CG2-CB 3.97Å; L60-A95 HydrophobicContact CB-CB 4.16Å; D91-A95 WeakPolarHBondContact O-CB 3.43Å; D91-A95 PolarHBondContact O-N 3.33Å; D91-A95 VanDerWaalsContact O-N 3.13Å; I92-A95 PolarHBondContact O-N 3.39Å; I92-A95 VanDerWaalsContact O-N 3.14Å; A95-M99 HydrophobicContact CB-CE 4.46Å; A95-M99 HydrophobicContact CB-SD 4.21Å
96	I	97.2	Very high	95.5	Very high	91 Å²	91	29.7 Å²	29.7	47%	0.467	15%	0.153	S	C	.	.	H	α-helix	trans	-91.9	-47.6	179.3	-65.9	170.9	0	0	0	112	L60 I92 S93 L94 P100	L60-I96 HydrophobicContact CD1-CD1 3.9Å; L60-I96 HydrophobicContact CD1-CG1 4.02Å; L60-I96 HydrophobicContact CD2-CG1 4.38Å; I92-I96 HydrophobicContact CG2-CD1 3.74Å; I92-I96 WeakPolarHBondContact O-CG1 3.32Å; I92-I96 PolarHBondContact O-N 3.43Å; S93-I96 PolarHBondContact O-N 3.18Å; L94-I96 VanDerWaalsContact C-N 3.29Å; L94-I96 PolarHBondContact O-N 2.86Å; I96-P100 WeakPolarHBondContact O-CG 3.32Å
97	L	96.3	Very high	95	Very high	70 Å²	70	30.7 Å²	30.7	37%	0.366	16%	0.159	S	C	.	.	H	α-helix	trans	-96.5	-25.8	-167.7	-62.8	172.2	0	0	0	113.7	S93 F125 F129	S93-L97 WeakPolarHBondContact O-CB 3.27Å; S93-L97 PolarHBondContact O-N 3.3Å; L97-F125 HydrophobicContact CB-CD2 4.43Å; L97-F129 HydrophobicContact CB-CE2 4.34Å; L97-F129 HydrophobicContact CD1-CE2 3.63Å; L97-F129 HydrophobicContact CD1-CZ 3.83Å
98	V	96.6	Very high	94.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-53.3	-170.8	-177.6	0	0	0	0	111.2	L94 P100 L101 A102 F122 F125 D126 F129 Y872	L94-V98 HydrophobicContact CD1-CB 3.82Å; L94-V98 HydrophobicContact CD1-CG1 3.99Å; L94-V98 HydrophobicContact CD1-CG2 3.98Å; L94-V98 HydrophobicContact CG-CB 4.49Å; L94-V98 WeakPolarHBondContact O-CB 3.45Å; L94-V98 PolarHBondContact O-N 2.94Å; L94-V98 VanDerWaalsContact O-N 3.09Å; V98-P100 VanDerWaalsContact C-CD 3.47Å; V98-P100 VanDerWaalsContact C-N 3.33Å; V98-L101 PolarHBondContact O-N 3.16Å; V98-L101 VanDerWaalsContact O-N 3.11Å; V98-A102 PolarHBondContact O-N 3.41Å; V98-F122 HydrophobicContact CB-CE2 4.48Å; V98-F122 HydrophobicContact CG1-CD2 4.29Å; V98-F122 HydrophobicContact CG1-CE2 3.71Å; V98-F125 HydrophobicContact CG2-CB 3.84Å; V98-D126 HydrophobicContact CG1-CB 3.8Å; V98-D126 HydrophobicContact CG2-CB 4.48Å; V98-F129 HydrophobicContact CG2-CD2 4.18Å; V98-Y872 WeakPolarHBondContact CG1-OH 3.3Å
99	M	95.2	Very high	93.8	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-34.1	-175.6	-63.3	-171.1	-168.3	0	0	114.9	S56 T59 L94 A95 T103 Y872	S56-M99 WeakPolarHBondContact OG-CB 3.29Å; T59-M99 HydrophobicContact CG2-CE 3.97Å; L94-M99 HydrophobicContact CD2-CE 3.7Å; L94-M99 HydrophobicContact CG-CE 3.92Å; L94-M99 PolarHBondContact O-N 3.3Å; A95-M99 HydrophobicContact CB-CE 4.46Å; A95-M99 HydrophobicContact CB-SD 4.21Å; M99-T103 WeakPolarHBondContact O-CB 3.46Å; M99-T103 PolarHBondContact O-N 3.5Å; M99-T103 PolarHBondContact O-OG1 3.12Å; M99-Y872 HydrophobicContact CE-CG 4.26Å; M99-Y872 HydrophobicContact CG-CD2 4.26Å
100	P	93.9	Very high	93.1	Very high	52 Å²	52	36.5 Å²	36.5	34%	0.338	20%	0.201	S	C	.	.	H	α-helix	trans	-66.9	-41.6	174.8	-24.3	37.3	0	0	0	113.6	M53 I96 V98 T103 W104	M53-P100 HydrophobicContact CE-CB 4.23Å; M53-P100 HydrophobicContact CE-CG 4.43Å; I96-P100 WeakPolarHBondContact O-CG 3.32Å; V98-P100 VanDerWaalsContact C-CD 3.47Å; V98-P100 VanDerWaalsContact C-N 3.33Å; P100-T103 PolarHBondContact O-N 2.98Å; P100-W104 PolarHBondContact O-N 2.89Å
101	L	93.7	Very high	92.6	Very high	45 Å²	45	42 Å²	42	24%	0.236	22%	0.223	C	C	.	.	H	α-helix	trans	-71.4	-37.3	177.2	-68	174.8	0	0	0	111.7	V98 T103 W104 L105 W112 F114 F122	V98-L101 PolarHBondContact O-N 3.16Å; V98-L101 VanDerWaalsContact O-N 3.11Å; L101-T103 VanDerWaalsContact C-N 3.34Å; L101-W104 WeakPolarHBondContact O-CB 3.36Å; L101-W104 PolarHBondContact O-N 3.03Å; L101-L105 WeakPolarHBondContact O-CB 3.38Å; L101-L105 PolarHBondContact O-N 2.94Å; L101-W112 HydrophobicContact CB-CH2 4.33Å; L101-W112 HydrophobicContact CD1-CH2 4.42Å; L101-W112 HydrophobicContact CD2-CH2 4.31Å; L101-F114 HydrophobicContact CD2-CD2 4.27Å; L101-F114 HydrophobicContact CD2-CE2 3.97Å; L101-F122 HydrophobicContact CB-CD2 3.57Å; L101-F122 HydrophobicContact CB-CE2 3.65Å; L101-F122 HydrophobicContact CB-CG 4.29Å; L101-F122 HydrophobicContact CB-CZ 4.42Å; L101-F122 HydrophobicContact CD1-CB 4.06Å; L101-F122 HydrophobicContact CD1-CD2 3.83Å; L101-F122 HydrophobicContact CD1-CG 4.21Å; L101-F122 HydrophobicContact CG-CD2 4.35Å
102	A	93.5	Very high	92.2	Very high	8 Å²	8	42.1 Å²	42.1	7%	0.066	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-36.9	170.7	0	0	0	0	0	112.3	V98 L105 E106 F122 W869 Y872	V98-A102 PolarHBondContact O-N 3.41Å; A102-L105 PolarHBondContact O-N 3.09Å; A102-E106 WeakPolarHBondContact O-CB 3.48Å; A102-E106 PolarHBondContact O-N 3.45Å; A102-F122 HydrophobicContact CB-CE2 4.29Å; A102-F122 HydrophobicContact CB-CZ 4.13Å; A102-W869 HydrophobicContact CB-CZ2 4.37Å; A102-Y872 HydrophobicContact CB-CE2 3.83Å
103	T	92.8	Very high	91.8	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-40.6	174	-57.4	0	0	0	0	111.5	L52 M53 M99 P100 L101 V107 W869	L52-T103 HydrophobicContact CB-CG2 3.75Å; L52-T103 HydrophobicContact CD1-CG2 4.21Å; M53-T103 HydrophobicContact CE-CG2 3.88Å; M53-T103 VanDerWaalsContact CE-OG1 3.23Å; M53-T103 WeakPolarHBondContact CE-OG1 3.37Å; M53-T103 HydrophobicContact CG-CG2 4.35Å; M99-T103 WeakPolarHBondContact O-CB 3.46Å; M99-T103 PolarHBondContact O-N 3.5Å; M99-T103 PolarHBondContact O-OG1 3.12Å; P100-T103 PolarHBondContact O-N 2.98Å; L101-T103 VanDerWaalsContact C-N 3.34Å; T103-V107 HydrophobicContact CG2-CG2 4.17Å; T103-V107 VanDerWaalsContact O-CB 3.29Å; T103-V107 WeakPolarHBondContact O-CB 3.36Å; T103-V107 WeakPolarHBondContact O-CG2 3.47Å; T103-V107 PolarHBondContact O-N 2.84Å; T103-W869 VanDerWaalsContact OG1-CH2 3.31Å; T103-W869 WeakPolarHBondContact OG1-CH2 3Å; T103-W869 WeakPolarHBondContact OG1-CZ2 3.41Å
104	W	91	Very high	91.5	Very high	108 Å²	108	46.7 Å²	46.7	41%	0.409	25%	0.245	S	C	.	.	H	α-helix	trans	-56.7	-56.7	171.9	173.8	-89.1	0	0	0	110.4	P100 L101 E106 V107 V108 V113 F114	P100-W104 PolarHBondContact O-N 2.89Å; L101-W104 WeakPolarHBondContact O-CB 3.36Å; L101-W104 PolarHBondContact O-N 3.03Å; W104-E106 VanDerWaalsContact C-N 3.31Å; W104-E106 PolarHBondContact O-N 3.31Å; W104-V107 PolarHBondContact O-N 3.34Å; W104-V108 HydrophobicContact CD2-CG1 4.27Å; W104-V108 HydrophobicContact CH2-CG1 4.35Å; W104-V108 HydrophobicContact CZ2-CG1 3.95Å; W104-V108 WeakPolarHBondContact O-CG2 3.38Å; W104-V108 PolarHBondContact O-N 2.93Å; W104-V113 HydrophobicContact CZ2-CG1 4.41Å; W104-V113 HydrophobicContact CZ2-CG2 3.79Å; W104-F114 AromaticContact CD1-CE2 3.72Å; W104-F114 HydrophobicContact CD2-CE2 4.4Å; W104-F114 HydrophobicContact CD2-CZ 4.37Å; W104-F114 HydrophobicContact CG-CE2 4.07Å; W104-F114 HydrophobicContact CG-CZ 4.46Å; W104-F114 AromaticContact NE1-CE2 3.85Å
105	L	89.7	Confident	91	Very high	38 Å²	38	47.9 Å²	47.9	20%	0.199	26%	0.257	C	S	.	.	H	α-helix	trans	-53.7	-44.4	-177.9	-172.5	70.8	0	0	0	112.3	L101 A102 N109 G110 W112	L101-L105 WeakPolarHBondContact O-CB 3.38Å; L101-L105 PolarHBondContact O-N 2.94Å; A102-L105 PolarHBondContact O-N 3.09Å; L105-N109 PolarHBondContact O-N 2.95Å; L105-G110 WeakPolarHBondContact CD1-O 3.28Å; L105-G110 PolarHBondContact O-N 3.36Å; L105-W112 HydrophobicContact CD1-CE3 4.07Å
106	E	88.4	Confident	90.4	Very high	60 Å²	60	50.9 Å²	50.9	28%	0.28	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-50.6	175.3	-171.6	68.2	-158.9	0	0	112	L52 A102 W104 V108 N109 S865	L52-E106 HydrophobicContact CD1-CB 4.18Å; L52-E106 HydrophobicContact CD1-CG 3.84Å; A102-E106 WeakPolarHBondContact O-CB 3.48Å; A102-E106 PolarHBondContact O-N 3.45Å; W104-E106 VanDerWaalsContact C-N 3.31Å; W104-E106 PolarHBondContact O-N 3.31Å; E106-V108 VanDerWaalsContact C-N 3.26Å; E106-V108 PolarHBondContact O-N 3.37Å; E106-N109 PolarHBondContact O-N 3.39Å; E106-S865 PolarHBondContact OE1-OG 2.96Å; E106-S865 WeakPolarHBondContact OE2-CB 3.44Å; E106-S865 PolarHBondContact OE2-OG 3.07Å
107	V	87.3	Confident	89.9	Confident	26 Å²	26	52.9 Å²	52.9	16%	0.158	28%	0.284	C	S	.	.	H	α-helix	trans	-69	-24.6	-173.3	170.5	0	0	0	0	112.3	R45 C49 T103 W104	R45-V107 HydrophobicContact CB-CG1 4.22Å; R45-V107 WeakPolarHBondContact CD-O 3.47Å; C49-V107 HydrophobicContact CB-CB 4.5Å; C49-V107 HydrophobicContact CB-CG1 4.14Å; C49-V107 HydrophobicContact CB-CG2 3.55Å; T103-V107 HydrophobicContact CG2-CG2 4.17Å; T103-V107 VanDerWaalsContact O-CB 3.29Å; T103-V107 WeakPolarHBondContact O-CB 3.36Å; T103-V107 WeakPolarHBondContact O-CG2 3.47Å; T103-V107 PolarHBondContact O-N 2.84Å; W104-V107 PolarHBondContact O-N 3.34Å
108	V	86.3	Confident	89.7	Confident	37 Å²	37	53.6 Å²	53.6	22%	0.224	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	17.4	173.2	-51.4	0	0	0	0	113.4	W104 E106 G110 Y111	W104-V108 HydrophobicContact CD2-CG1 4.27Å; W104-V108 HydrophobicContact CH2-CG1 4.35Å; W104-V108 HydrophobicContact CZ2-CG1 3.95Å; W104-V108 WeakPolarHBondContact O-CG2 3.38Å; W104-V108 PolarHBondContact O-N 2.93Å; E106-V108 VanDerWaalsContact C-N 3.26Å; E106-V108 PolarHBondContact O-N 3.37Å; V108-G110 VanDerWaalsContact C-N 3.35Å; V108-G110 PolarHBondContact O-N 3.48Å; V108-Y111 WeakPolarHBondContact CG2-O 3.41Å; V108-Y111 PolarHBondContact O-N 2.98Å
109	N	83.1	Confident	89.4	Confident	123 Å²	123	53.8 Å²	53.8	66%	0.658	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	38	172.9	-59	105.8	0	0	0	114.6	L105 E106	L105-N109 PolarHBondContact O-N 2.95Å; E106-N109 PolarHBondContact O-N 3.39Å
110	G	83.4	Confident	89.1	Confident	39 Å²	39	54.8 Å²	54.8	40%	0.402	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.9	-5.8	175.9	0	0	0	0	0	115.5	L105 V108	L105-G110 WeakPolarHBondContact CD1-O 3.28Å; L105-G110 PolarHBondContact O-N 3.36Å; V108-G110 VanDerWaalsContact C-N 3.35Å; V108-G110 PolarHBondContact O-N 3.48Å
111	Y	87.1	Confident	89	Confident	117 Å²	117	54.7 Å²	54.7	46%	0.459	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-75.6	123.3	-177.7	-169.8	-103.7	0	0	0	112.9	V108 V113 T194	V108-Y111 WeakPolarHBondContact CG2-O 3.41Å; V108-Y111 PolarHBondContact O-N 2.98Å; Y111-V113 HydrophobicContact CD1-CG1 3.76Å; Y111-V113 HydrophobicContact CE1-CG1 3.57Å; Y111-T194 HydrophobicContact CD2-CG2 4.43Å; Y111-T194 VanDerWaalsContact CE2-CB 3.44Å; Y111-T194 HydrophobicContact CE2-CG2 3.56Å
112	W	89.7	Confident	89	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.008	29%	0.285	C	S	.	.			trans	-99.2	141	178.6	-165.7	-112.7	0	0	0	111.8	L101 L105 F114 G115 I118 C119 F122 T194 C196	L101-W112 HydrophobicContact CB-CH2 4.33Å; L101-W112 HydrophobicContact CD1-CH2 4.42Å; L101-W112 HydrophobicContact CD2-CH2 4.31Å; L105-W112 HydrophobicContact CD1-CE3 4.07Å; W112-F114 HydrophobicContact CD2-CD2 4.08Å; W112-F114 AromaticContact CE2-CD2 3.91Å; W112-F114 HydrophobicContact CE3-CD2 4.08Å; W112-F114 AromaticContact CH2-CD2 3.86Å; W112-F114 HydrophobicContact CH2-CD2 3.86Å; W112-F114 HydrophobicContact CZ2-CB 3.9Å; W112-F114 AromaticContact CZ2-CD2 3.81Å; W112-F114 HydrophobicContact CZ2-CD2 3.81Å; W112-F114 HydrophobicContact CZ2-CG 4.33Å; W112-F114 AromaticContact CZ3-CD2 3.99Å; W112-F114 HydrophobicContact CZ3-CD2 3.99Å; W112-F114 HydrophobicContact CZ3-CE2 4.46Å; W112-G115 PolarHBondContact NE1-O 3.41Å; W112-I118 HydrophobicContact CZ2-CB 4.4Å; W112-I118 HydrophobicContact CZ2-CG2 4.09Å; W112-C119 HydrophobicContact CZ2-CB 4.11Å; W112-F122 HydrophobicContact CH2-CB 4.14Å; W112-F122 AromaticContact CH2-CD1 3.94Å; W112-F122 HydrophobicContact CH2-CD1 3.94Å; W112-F122 HydrophobicContact CH2-CG 4.05Å; W112-F122 HydrophobicContact CZ2-CB 4.5Å; W112-F122 HydrophobicContact CZ3-CD1 4.31Å; W112-T194 WeakPolarHBondContact CB-O 3.46Å; W112-T194 PolarHBondContact N-O 3.32Å; W112-T194 WeakPolarHBondContact O-CA 3.08Å; W112-C196 HydrophobicContact CB-CB 3.84Å; W112-C196 HydrophobicContact CD2-CB 3.59Å; W112-C196 HydrophobicContact CE3-CB 3.88Å; W112-C196 HydrophobicContact CG-CB 3.61Å
113	V	91.2	Very high	89	Confident	74 Å²	74	53.9 Å²	53.9	45%	0.448	29%	0.287	S	S	.	.			trans	-124.4	-6.4	-178.3	-64	0	0	0	0	113.7	W104 Y111	W104-V113 HydrophobicContact CZ2-CG1 4.41Å; W104-V113 HydrophobicContact CZ2-CG2 3.79Å; Y111-V113 HydrophobicContact CD1-CG1 3.76Å; Y111-V113 HydrophobicContact CE1-CG1 3.57Å
114	F	90.1	Very high	89	Confident	80 Å²	80	54.5 Å²	54.5	35%	0.351	29%	0.29	S	S	.	.	S	Bend	trans	-97.9	6.5	-170.5	-52.5	-69.3	0	0	0	113.4	L101 W104 W112 I118	L101-F114 HydrophobicContact CD2-CD2 4.27Å; L101-F114 HydrophobicContact CD2-CE2 3.97Å; W104-F114 AromaticContact CD1-CE2 3.72Å; W104-F114 HydrophobicContact CD2-CE2 4.4Å; W104-F114 HydrophobicContact CD2-CZ 4.37Å; W104-F114 HydrophobicContact CG-CE2 4.07Å; W104-F114 HydrophobicContact CG-CZ 4.46Å; W104-F114 AromaticContact NE1-CE2 3.85Å; W112-F114 HydrophobicContact CD2-CD2 4.08Å; W112-F114 AromaticContact CE2-CD2 3.91Å; W112-F114 HydrophobicContact CE3-CD2 4.08Å; W112-F114 AromaticContact CH2-CD2 3.86Å; W112-F114 HydrophobicContact CH2-CD2 3.86Å; W112-F114 HydrophobicContact CZ2-CB 3.9Å; W112-F114 AromaticContact CZ2-CD2 3.81Å; W112-F114 HydrophobicContact CZ2-CD2 3.81Å; W112-F114 HydrophobicContact CZ2-CG 4.33Å; W112-F114 AromaticContact CZ3-CD2 3.99Å; W112-F114 HydrophobicContact CZ3-CD2 3.99Å; W112-F114 HydrophobicContact CZ3-CE2 4.46Å; F114-I118 HydrophobicContact CB-CB 3.82Å; F114-I118 HydrophobicContact CB-CD1 4.08Å; F114-I118 HydrophobicContact CB-CG1 4.44Å; F114-I118 HydrophobicContact CB-CG2 3.83Å; F114-I118 WeakPolarHBondContact O-CB 3.41Å; F114-I118 WeakPolarHBondContact O-CD1 3.45Å; F114-I118 WeakPolarHBondContact O-CG1 3.47Å
115	G	87.3	Confident	89.2	Confident	26 Å²	26	52.1 Å²	52.1	27%	0.268	28%	0.283	S	S	.	.	H	α-helix	trans	72.7	170	-178.2	0	0	0	0	0	114.3	W112 I118 C119	W112-G115 PolarHBondContact NE1-O 3.41Å; G115-I118 PolarHBondContact O-N 3.17Å; G115-C119 PolarHBondContact O-N 3.02Å
116	T	85.6	Confident	89.5	Confident	68 Å²	68	51.2 Å²	51.2	42%	0.417	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-50.4	-174.8	47.7	0	0	0	0	112.6	I118 C119 D120	T116-I118 VanDerWaalsContact C-N 3.29Å; T116-I118 PolarHBondContact O-N 2.84Å; T116-C119 CarbonylContact O-C 3.56Å; T116-C119 WeakPolarHBondContact O-CA 3.38Å; T116-C119 VanDerWaalsContact O-CB 3.22Å; T116-C119 WeakPolarHBondContact O-CB 3.24Å; T116-C119 PolarHBondContact O-N 2.94Å; T116-D120 PolarHBondContact O-N 2.96Å
117	M	86.5	Confident	89.8	Confident	132 Å²	132	49.5 Å²	49.5	65%	0.65	27%	0.272	S	S	*	.	H	α-helix	trans	-54.6	-40.4	-178.1	-64.2	-57	-59.9	0	0	113.6	V121	M117-V121 VanDerWaalsContact O-CG2 3.3Å; M117-V121 WeakPolarHBondContact O-CG2 3.5Å; M117-V121 PolarHBondContact O-N 3.36Å; M117-V121 VanDerWaalsContact O-N 3.16Å
118	I	90.8	Very high	90.2	Very high	85 Å²	85	49 Å²	49	44%	0.436	27%	0.268	S	S	.	.	H	α-helix	trans	-76.7	-28.7	178.4	-55.7	-175.1	0	0	0	110.6	W112 F114 G115 T116 F122	W112-I118 HydrophobicContact CZ2-CB 4.4Å; W112-I118 HydrophobicContact CZ2-CG2 4.09Å; F114-I118 HydrophobicContact CB-CB 3.82Å; F114-I118 HydrophobicContact CB-CD1 4.08Å; F114-I118 HydrophobicContact CB-CG1 4.44Å; F114-I118 HydrophobicContact CB-CG2 3.83Å; F114-I118 WeakPolarHBondContact O-CB 3.41Å; F114-I118 WeakPolarHBondContact O-CD1 3.45Å; F114-I118 WeakPolarHBondContact O-CG1 3.47Å; G115-I118 PolarHBondContact O-N 3.17Å; T116-I118 VanDerWaalsContact C-N 3.29Å; T116-I118 PolarHBondContact O-N 2.84Å; I118-F122 WeakPolarHBondContact O-CB 3.46Å; I118-F122 PolarHBondContact O-N 3.49Å
119	C	90.7	Very high	90.8	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.027	26%	0.26	C	S	.	.	H	α-helix	trans	-63.6	-49.5	169.2	-180	0	0	0	0	111.5	W112 G115 T116 V121 F122 V123 C196	W112-C119 HydrophobicContact CZ2-CB 4.11Å; G115-C119 PolarHBondContact O-N 3.02Å; T116-C119 CarbonylContact O-C 3.56Å; T116-C119 WeakPolarHBondContact O-CA 3.38Å; T116-C119 VanDerWaalsContact O-CB 3.22Å; T116-C119 WeakPolarHBondContact O-CB 3.24Å; T116-C119 PolarHBondContact O-N 2.94Å; C119-V121 VanDerWaalsContact C-N 3.3Å; C119-V121 PolarHBondContact O-N 3.22Å; C119-F122 WeakPolarHBondContact O-CB 3.28Å; C119-F122 PolarHBondContact O-N 3.47Å; C119-F122 VanDerWaalsContact O-N 3.08Å; C119-V123 WeakPolarHBondContact O-CG2 3.45Å; C119-V123 PolarHBondContact O-N 3.37Å; C119-C196 VanDerWaalsContact CA-SG 3.56Å; C119-C196 HydrophobicContact CB-CB 3.81Å; C119-C196 WeakPolarHBondContact CB-SG 3.46Å; C119-C196 WeakPolarHBondContact SG-CA 3.17Å; C119-C196 WeakPolarHBondContact SG-CB 3.42Å; C119-C196 CovalentContact SG-SG 2.04Å; C119-C196 PolarHBondContact SG-SG 2.87Å
120	D	89.1	Confident	91.4	Very high	24 Å²	24	42.2 Å²	42.2	13%	0.128	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-37.7	-177.8	-65.2	-45.6	0	0	0	111.9	T116 M124 N186	T116-D120 PolarHBondContact O-N 2.96Å; D120-M124 WeakPolarHBondContact O-CB 3.35Å; D120-M124 PolarHBondContact O-N 2.64Å; D120-N186 WeakPolarHBondContact OD1-CB 3.45Å; D120-N186 PolarHBondContact OD1-ND2 3.02Å
121	V	92.3	Very high	92	Very high	50 Å²	50	40.4 Å²	40.4	30%	0.303	21%	0.211	S	C	.	.	H	α-helix	trans	-65.7	-42.5	171.4	171.1	0	0	0	0	112	M117 C119 M124 F125 I182	M117-V121 VanDerWaalsContact O-CG2 3.3Å; M117-V121 WeakPolarHBondContact O-CG2 3.5Å; M117-V121 PolarHBondContact O-N 3.36Å; M117-V121 VanDerWaalsContact O-N 3.16Å; C119-V121 VanDerWaalsContact C-N 3.3Å; C119-V121 PolarHBondContact O-N 3.22Å; V121-M124 PolarHBondContact O-N 3.06Å; V121-F125 HydrophobicContact CG1-CD2 3.71Å; V121-F125 HydrophobicContact CG1-CE2 3.39Å; V121-F125 HydrophobicContact CG1-CZ 4.13Å; V121-F125 WeakPolarHBondContact O-CB 3.17Å; V121-F125 WeakPolarHBondContact O-CD2 3.39Å; V121-F125 WeakPolarHBondContact O-CG 3.5Å; V121-F125 PolarHBondContact O-N 3.15Å; V121-I182 HydrophobicContact CG2-CD1 3.85Å
122	F	93.9	Very high	92.5	Very high	15 Å²	15	34.8 Å²	34.8	7%	0.066	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-49.1	176.6	161.3	-111.8	0	0	0	112.1	V98 L101 A102 W112 I118 C119 F125 D126	V98-F122 HydrophobicContact CB-CE2 4.48Å; V98-F122 HydrophobicContact CG1-CD2 4.29Å; V98-F122 HydrophobicContact CG1-CE2 3.71Å; L101-F122 HydrophobicContact CB-CD2 3.57Å; L101-F122 HydrophobicContact CB-CE2 3.65Å; L101-F122 HydrophobicContact CB-CG 4.29Å; L101-F122 HydrophobicContact CB-CZ 4.42Å; L101-F122 HydrophobicContact CD1-CB 4.06Å; L101-F122 HydrophobicContact CD1-CD2 3.83Å; L101-F122 HydrophobicContact CD1-CG 4.21Å; L101-F122 HydrophobicContact CG-CD2 4.35Å; A102-F122 HydrophobicContact CB-CE2 4.29Å; A102-F122 HydrophobicContact CB-CZ 4.13Å; W112-F122 HydrophobicContact CH2-CB 4.14Å; W112-F122 AromaticContact CH2-CD1 3.94Å; W112-F122 HydrophobicContact CH2-CD1 3.94Å; W112-F122 HydrophobicContact CH2-CG 4.05Å; W112-F122 HydrophobicContact CZ2-CB 4.5Å; W112-F122 HydrophobicContact CZ3-CD1 4.31Å; I118-F122 WeakPolarHBondContact O-CB 3.46Å; I118-F122 PolarHBondContact O-N 3.49Å; C119-F122 WeakPolarHBondContact O-CB 3.28Å; C119-F122 PolarHBondContact O-N 3.47Å; C119-F122 VanDerWaalsContact O-N 3.08Å; F122-F125 PolarHBondContact O-N 3.47Å; F122-D126 PolarHBondContact O-N 2.99Å
123	V	92	Very high	92.8	Very high	21 Å²	21	34.7 Å²	34.7	13%	0.127	19%	0.189	C	C	.	.	H	α-helix	trans	-67.2	-36.6	178.2	-177.2	0	0	0	0	110.7	C119 D126 V127 L181	C119-V123 WeakPolarHBondContact O-CG2 3.45Å; C119-V123 PolarHBondContact O-N 3.37Å; V123-D126 PolarHBondContact O-N 2.89Å; V123-V127 WeakPolarHBondContact O-CG2 3.24Å; V123-V127 PolarHBondContact O-N 3.29Å; V123-L181 HydrophobicContact CB-CD1 4.24Å; V123-L181 HydrophobicContact CG1-CD1 3.74Å; V123-L181 HydrophobicContact CG1-CD2 4.31Å
124	M	93.8	Very high	92.9	Very high	15 Å²	15	31.2 Å²	31.2	7%	0.074	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-45.4	171.7	-174.1	-154.5	66.3	0	0	111.4	D120 V121 V127 L128 A178 L181 I182	D120-M124 WeakPolarHBondContact O-CB 3.35Å; D120-M124 PolarHBondContact O-N 2.64Å; V121-M124 PolarHBondContact O-N 3.06Å; M124-V127 PolarHBondContact O-N 2.86Å; M124-L128 WeakPolarHBondContact O-CB 3.23Å; M124-L128 PolarHBondContact O-N 3.35Å; M124-A178 HydrophobicContact CG-CB 3.69Å; M124-L181 HydrophobicContact CB-CB 4.47Å; M124-L181 HydrophobicContact CB-CD1 4.25Å; M124-I182 HydrophobicContact CB-CD1 4.29Å; M124-I182 HydrophobicContact CB-CG1 4.2Å; M124-I182 HydrophobicContact CE-CD1 3.89Å; M124-I182 HydrophobicContact CG-CD1 4.34Å; M124-I182 HydrophobicContact CG-CG1 4.39Å; M124-I182 HydrophobicContact SD-CD1 3.35Å; M124-I182 WeakPolarHBondContact SD-CD1 3.23Å; M124-I182 HydrophobicContact SD-CG1 3.86Å
125	F	96	Very high	93.2	Very high	59 Å²	59	28.5 Å²	28.5	26%	0.259	16%	0.157	S	C	.	.	H	α-helix	trans	-65.9	-37.8	178.2	-75.7	-36.3	0	0	0	112.8	L97 V98 V121 F122 L128 F129	L97-F125 HydrophobicContact CB-CD2 4.43Å; V98-F125 HydrophobicContact CG2-CB 3.84Å; V121-F125 HydrophobicContact CG1-CD2 3.71Å; V121-F125 HydrophobicContact CG1-CE2 3.39Å; V121-F125 HydrophobicContact CG1-CZ 4.13Å; V121-F125 WeakPolarHBondContact O-CB 3.17Å; V121-F125 WeakPolarHBondContact O-CD2 3.39Å; V121-F125 WeakPolarHBondContact O-CG 3.5Å; V121-F125 PolarHBondContact O-N 3.15Å; F122-F125 PolarHBondContact O-N 3.47Å; F125-L128 HydrophobicContact CD1-CD2 4.23Å; F125-L128 PolarHBondContact O-N 2.92Å; F125-F129 HydrophobicContact CB-CD2 4.03Å; F125-F129 HydrophobicContact CB-CE2 3.74Å; F125-F129 AromaticContact CD1-CE2 3.61Å; F125-F129 HydrophobicContact CD1-CE2 3.61Å; F125-F129 AromaticContact CD1-CZ 3.92Å; F125-F129 HydrophobicContact CD1-CZ 3.92Å; F125-F129 HydrophobicContact CE1-CE2 4.43Å; F125-F129 HydrophobicContact CE1-CZ 4.39Å; F125-F129 AromaticContact CG-CE2 3.82Å; F125-F129 HydrophobicContact CG-CE2 3.82Å; F125-F129 WeakPolarHBondContact O-CD2 3.16Å; F125-F129 PolarHBondContact O-N 3.39Å
126	D	94.9	Very high	93.6	Very high	19 Å²	19	27.2 Å²	27.2	10%	0.102	14%	0.144	C	C	.	.	H	α-helix	trans	-58.4	-54.5	172.4	-175.6	55.2	0	0	0	111.1	V98 F122 V123 L128 C130 Y872	V98-D126 HydrophobicContact CG1-CB 3.8Å; V98-D126 HydrophobicContact CG2-CB 4.48Å; F122-D126 PolarHBondContact O-N 2.99Å; V123-D126 PolarHBondContact O-N 2.89Å; D126-L128 VanDerWaalsContact C-N 3.33Å; D126-L128 PolarHBondContact O-N 2.92Å; D126-C130 WeakPolarHBondContact O-CB 3.25Å; D126-C130 PolarHBondContact O-N 3.26Å; D126-C130 PolarHBondContact O-SG 3.05Å; D126-Y872 VanDerWaalsContact OD1-CE1 3.22Å; D126-Y872 WeakPolarHBondContact OD1-CE1 3.31Å; D126-Y872 PolarHBondContact OD1-OH 3.26Å
127	V	94.6	Very high	93.9	Very high	23 Å²	23	24.3 Å²	24.3	14%	0.139	13%	0.126	C	C	.	.	H	α-helix	trans	-60.2	-42.7	177.9	175.7	0	0	0	0	111.4	V123 M124 T131 I177 A178 L181	V123-V127 WeakPolarHBondContact O-CG2 3.24Å; V123-V127 PolarHBondContact O-N 3.29Å; M124-V127 PolarHBondContact O-N 2.86Å; V127-T131 WeakPolarHBondContact O-CB 3.39Å; V127-T131 PolarHBondContact O-N 3.28Å; V127-T131 PolarHBondContact O-OG1 3.42Å; V127-I177 HydrophobicContact CG1-CG2 3.98Å; V127-A178 HydrophobicContact CB-CB 4.22Å; V127-A178 HydrophobicContact CG1-CB 4.03Å; V127-L181 HydrophobicContact CG2-CD1 4.29Å
128	L	97	Very high	94.3	Very high	15 Å²	15	18.6 Å²	18.6	8%	0.079	10%	0.098	C	C	.	.	H	α-helix	trans	-61.4	-57.3	-179.5	173.3	58.7	0	0	0	112	M124 F125 D126 T131 A132 F175 A178	M124-L128 WeakPolarHBondContact O-CB 3.23Å; M124-L128 PolarHBondContact O-N 3.35Å; F125-L128 HydrophobicContact CD1-CD2 4.23Å; F125-L128 PolarHBondContact O-N 2.92Å; D126-L128 VanDerWaalsContact C-N 3.33Å; D126-L128 PolarHBondContact O-N 2.92Å; L128-T131 PolarHBondContact O-N 3.44Å; L128-A132 WeakPolarHBondContact O-CB 3.5Å; L128-A132 PolarHBondContact O-N 3.19Å; L128-F175 HydrophobicContact CD1-CB 4.22Å; L128-A178 HydrophobicContact CB-CB 3.86Å
129	F	97.5	Very high	94.5	Very high	14 Å²	14	15 Å²	15	6%	0.061	8%	0.081	C	C	.	.	H	α-helix	trans	-74.3	-33.9	-172.7	-60.7	-53.2	0	0	0	111.9	S93 L94 L97 V98 F125 A132 S133 W171	S93-F129 VanDerWaalsContact CB-CE1 3.41Å; L94-F129 HydrophobicContact CB-CB 4.15Å; L94-F129 HydrophobicContact CD1-CB 4.17Å; L97-F129 HydrophobicContact CB-CE2 4.34Å; L97-F129 HydrophobicContact CD1-CE2 3.63Å; L97-F129 HydrophobicContact CD1-CZ 3.83Å; V98-F129 HydrophobicContact CG2-CD2 4.18Å; F125-F129 HydrophobicContact CB-CD2 4.03Å; F125-F129 HydrophobicContact CB-CE2 3.74Å; F125-F129 AromaticContact CD1-CE2 3.61Å; F125-F129 HydrophobicContact CD1-CE2 3.61Å; F125-F129 AromaticContact CD1-CZ 3.92Å; F125-F129 HydrophobicContact CD1-CZ 3.92Å; F125-F129 HydrophobicContact CE1-CE2 4.43Å; F125-F129 HydrophobicContact CE1-CZ 4.39Å; F125-F129 AromaticContact CG-CE2 3.82Å; F125-F129 HydrophobicContact CG-CE2 3.82Å; F125-F129 WeakPolarHBondContact O-CD2 3.16Å; F125-F129 PolarHBondContact O-N 3.39Å; F129-A132 PolarHBondContact O-N 3.03Å; F129-S133 WeakPolarHBondContact O-CB 3.42Å; F129-S133 PolarHBondContact O-N 3.37Å; F129-W171 AromaticContact CD1-CH2 3.99Å; F129-W171 HydrophobicContact CD1-CH2 3.99Å; F129-W171 AromaticContact CD1-CZ3 3.81Å; F129-W171 HydrophobicContact CD1-CZ3 3.81Å; F129-W171 HydrophobicContact CE1-CH2 4.18Å; F129-W171 AromaticContact CE1-CZ3 3.83Å; F129-W171 HydrophobicContact CE1-CZ3 3.83Å
130	C	95.4	Very high	94.6	Very high	4 Å²	4	15.2 Å²	15.2	3%	0.027	8%	0.082	C	C	.	.	H	α-helix	trans	-64.7	-46.9	171.3	-64.3	0	0	0	0	111.2	L94 D126 A132 S133 I134 W833	L94-C130 VanDerWaalsContact CD1-SG 3.58Å; D126-C130 WeakPolarHBondContact O-CB 3.25Å; D126-C130 PolarHBondContact O-N 3.26Å; D126-C130 PolarHBondContact O-SG 3.05Å; C130-A132 VanDerWaalsContact C-N 3.33Å; C130-A132 PolarHBondContact O-N 3.03Å; C130-S133 PolarHBondContact O-N 3.19Å; C130-I134 WeakPolarHBondContact O-CD1 3.45Å; C130-I134 WeakPolarHBondContact O-CG1 3.46Å; C130-I134 PolarHBondContact O-N 3.47Å; C130-W833 HydrophobicContact CB-CH2 3.94Å; C130-W833 HydrophobicContact CB-CZ2 4.37Å; C130-W833 HydrophobicContact CB-CZ3 4.49Å; C130-W833 WeakPolarHBondContact SG-CH2 3.29Å
131	T	96.6	Very high	94.7	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.006	8%	0.076	C	C	.	.	H	α-helix	trans	-61.7	-40.4	175.9	-57.1	0	0	0	0	111.7	V127 L128 I134 L135 I177 S211	V127-T131 WeakPolarHBondContact O-CB 3.39Å; V127-T131 PolarHBondContact O-N 3.28Å; V127-T131 PolarHBondContact O-OG1 3.42Å; L128-T131 PolarHBondContact O-N 3.44Å; T131-I134 PolarHBondContact O-N 3.46Å; T131-L135 HydrophobicContact CG2-CD1 3.77Å; T131-L135 HydrophobicContact CG2-CG 4.12Å; T131-L135 WeakPolarHBondContact O-CB 3.31Å; T131-L135 WeakPolarHBondContact O-CG 3.31Å; T131-L135 PolarHBondContact O-N 2.81Å; T131-I177 HydrophobicContact CG2-CD1 3.96Å; T131-S211 WeakPolarHBondContact OG1-CB 3.38Å
132	A	97.6	Very high	94.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.9	-41.2	175.7	0	0	0	0	0	112.1	A90 L128 F129 C130 N136 W171 S174	A90-A132 HydrophobicContact CB-CB 3.97Å; L128-A132 WeakPolarHBondContact O-CB 3.5Å; L128-A132 PolarHBondContact O-N 3.19Å; F129-A132 PolarHBondContact O-N 3.03Å; C130-A132 VanDerWaalsContact C-N 3.33Å; C130-A132 PolarHBondContact O-N 3.03Å; A132-N136 WeakPolarHBondContact O-CB 3.46Å; A132-N136 PolarHBondContact O-N 2.73Å; A132-N136 PolarHBondContact O-ND2 2.93Å; A132-W171 HydrophobicContact CB-CD2 4.37Å; A132-W171 HydrophobicContact CB-CE3 4.09Å; A132-W171 HydrophobicContact CB-CH2 4.13Å; A132-W171 HydrophobicContact CB-CZ2 4.38Å; A132-W171 HydrophobicContact CB-CZ3 3.97Å; A132-S174 VanDerWaalsContact CA-OG 3.23Å; A132-S174 WeakPolarHBondContact CA-OG 3.38Å; A132-S174 PolarHBondContact N-OG 3.38Å
133	S	95.7	Very high	94.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.6	-46.8	174.6	-167.1	0	0	0	0	110.9	L87 D91 F129 C130 N136 L137	L87-S133 WeakPolarHBondContact CD1-O 3.46Å; L87-S133 WeakPolarHBondContact CD1-OG 3.25Å; D91-S133 PolarHBondContact OD1-OG 2.97Å; F129-S133 WeakPolarHBondContact O-CB 3.42Å; F129-S133 PolarHBondContact O-N 3.37Å; C130-S133 PolarHBondContact O-N 3.19Å; S133-N136 PolarHBondContact O-N 3.06Å; S133-L137 PolarHBondContact O-N 3.02Å
134	I	94.2	Very high	94.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.8	-49.9	176.5	-60.5	159.8	0	0	0	111.8	C130 T131 N136 L137 V138 S211 P215 F829 F837	C130-I134 WeakPolarHBondContact O-CD1 3.45Å; C130-I134 WeakPolarHBondContact O-CG1 3.46Å; C130-I134 PolarHBondContact O-N 3.47Å; T131-I134 PolarHBondContact O-N 3.46Å; I134-N136 PolarHBondContact O-N 2.94Å; I134-L137 WeakPolarHBondContact O-CB 3.32Å; I134-L137 PolarHBondContact O-N 3.11Å; I134-L137 VanDerWaalsContact O-N 3.15Å; I134-V138 PolarHBondContact O-N 3.21Å; I134-S211 VanDerWaalsContact CD1-O 3.26Å; I134-S211 WeakPolarHBondContact CD1-O 3.25Å; I134-S211 WeakPolarHBondContact CG2-O 3.38Å; I134-P215 HydrophobicContact CG2-CB 3.56Å; I134-P215 HydrophobicContact CG2-CG 4.1Å; I134-F829 HydrophobicContact CB-CE2 4.28Å; I134-F829 HydrophobicContact CB-CZ 4.17Å; I134-F829 HydrophobicContact CG1-CE2 3.67Å; I134-F829 HydrophobicContact CG1-CZ 3.77Å; I134-F829 HydrophobicContact CG2-CE2 4.26Å; I134-F829 HydrophobicContact CG2-CZ 3.66Å; I134-F837 HydrophobicContact CD1-CE2 3.98Å; I134-F837 HydrophobicContact CD1-CZ 4.05Å
135	L	95.8	Very high	94.4	Very high	23 Å²	23	18.5 Å²	18.5	12%	0.12	9%	0.089	C	C	.	.	H	α-helix	trans	-72.2	-27.7	-176.2	-70.7	-178.2	0	0	0	113	T131 L137 V138 A139 V170 V173 P215	T131-L135 HydrophobicContact CG2-CD1 3.77Å; T131-L135 HydrophobicContact CG2-CG 4.12Å; T131-L135 WeakPolarHBondContact O-CB 3.31Å; T131-L135 WeakPolarHBondContact O-CG 3.31Å; T131-L135 PolarHBondContact O-N 2.81Å; L135-L137 VanDerWaalsContact C-N 3.33Å; L135-V138 HydrophobicContact CD2-CG2 4.3Å; L135-V138 WeakPolarHBondContact O-CB 3.33Å; L135-V138 PolarHBondContact O-N 3.07Å; L135-A139 PolarHBondContact O-N 3.11Å; L135-V170 HydrophobicContact CB-CB 4.38Å; L135-V170 HydrophobicContact CB-CG1 3.78Å; L135-V170 HydrophobicContact CB-CG2 4.1Å; L135-V173 HydrophobicContact CD1-CB 4.04Å; L135-V173 HydrophobicContact CD1-CG1 3.69Å; L135-P215 HydrophobicContact CD2-CB 4.38Å; L135-P215 HydrophobicContact CD2-CG 3.64Å
136	N	95.6	Very high	94.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.7	-37.3	168.3	-85.4	-68.6	0	0	0	111.8	S86 L87 A132 S133 I134 V138 A139 I140	S86-N136 WeakPolarHBondContact CB-OD1 3.43Å; S86-N136 PolarHBondContact OG-ND2 2.99Å; S86-N136 PolarHBondContact OG-OD1 3.18Å; L87-N136 HydrophobicContact CB-CB 3.97Å; L87-N136 HydrophobicContact CD1-CB 4.21Å; A132-N136 WeakPolarHBondContact O-CB 3.46Å; A132-N136 PolarHBondContact O-N 2.73Å; A132-N136 PolarHBondContact O-ND2 2.93Å; S133-N136 PolarHBondContact O-N 3.06Å; I134-N136 PolarHBondContact O-N 2.94Å; N136-V138 VanDerWaalsContact C-N 3.32Å; N136-V138 PolarHBondContact O-N 2.99Å; N136-A139 PolarHBondContact O-N 3.47Å; N136-I140 WeakPolarHBondContact O-CG1 3.33Å; N136-I140 PolarHBondContact O-N 2.99Å
137	L	92.7	Very high	93.8	Very high	7 Å²	7	18.8 Å²	18.8	4%	0.037	10%	0.096	C	C	.	.	H	α-helix	trans	-64.8	-35.8	173.2	-66.5	172	0	0	0	112	L87 S133 I134 L135 C141 V825 F829	L87-L137 HydrophobicContact CD2-CD2 3.8Å; L87-L137 HydrophobicContact CD2-CG 4.41Å; S133-L137 PolarHBondContact O-N 3.02Å; I134-L137 WeakPolarHBondContact O-CB 3.32Å; I134-L137 PolarHBondContact O-N 3.11Å; I134-L137 VanDerWaalsContact O-N 3.15Å; L135-L137 VanDerWaalsContact C-N 3.33Å; L137-C141 VanDerWaalsContact O-CB 3.29Å; L137-C141 WeakPolarHBondContact O-CB 3.24Å; L137-C141 PolarHBondContact O-N 3.4Å; L137-V825 HydrophobicContact CD2-CG1 3.7Å; L137-F829 HydrophobicContact CD1-CB 4.21Å; L137-F829 HydrophobicContact CD1-CD2 3.39Å; L137-F829 HydrophobicContact CD1-CE2 3.92Å; L137-F829 HydrophobicContact CD1-CG 3.77Å
138	V	94.4	Very high	93.5	Very high	12 Å²	12	18.9 Å²	18.9	7%	0.073	10%	0.097	C	C	.	.	H	α-helix	trans	-63.1	-44.3	170.3	-176.3	0	0	0	0	111.1	I134 L135 N136 C141 L142 P215 I218 L219	I134-V138 PolarHBondContact O-N 3.21Å; L135-V138 HydrophobicContact CD2-CG2 4.3Å; L135-V138 WeakPolarHBondContact O-CB 3.33Å; L135-V138 PolarHBondContact O-N 3.07Å; N136-V138 VanDerWaalsContact C-N 3.32Å; N136-V138 PolarHBondContact O-N 2.99Å; V138-C141 VanDerWaalsContact O-CB 3.31Å; V138-C141 WeakPolarHBondContact O-CB 3.33Å; V138-C141 PolarHBondContact O-N 3.1Å; V138-L142 HydrophobicContact CG1-CD1 3.91Å; V138-L142 HydrophobicContact CG1-CG 4.32Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.24Å; V138-P215 HydrophobicContact CG2-CB 3.72Å; V138-I218 HydrophobicContact CG1-CG2 3.89Å; V138-L219 HydrophobicContact CB-CD2 4.46Å; V138-L219 HydrophobicContact CG2-CD1 4.28Å; V138-L219 HydrophobicContact CG2-CD2 4.17Å; V138-L219 HydrophobicContact CG2-CG 4.03Å
139	A	94.8	Very high	93.1	Very high	10 Å²	10	19.9 Å²	19.9	8%	0.083	10%	0.104	C	C	.	.	H	α-helix	trans	-63.9	-42.5	178.9	0	0	0	0	0	112.4	F83 L135 N136 L142 D143 V170	F83-A139 HydrophobicContact CD1-CB 3.76Å; F83-A139 HydrophobicContact CE1-CB 3.6Å; F83-A139 HydrophobicContact CG-CB 4.5Å; F83-A139 HydrophobicContact CZ-CB 4.2Å; L135-A139 PolarHBondContact O-N 3.11Å; N136-A139 PolarHBondContact O-N 3.47Å; A139-L142 PolarHBondContact O-N 2.89Å; A139-D143 WeakPolarHBondContact O-CB 3.22Å; A139-D143 PolarHBondContact O-N 2.94Å; A139-V170 HydrophobicContact CB-CG2 4.05Å
140	I	92.6	Very high	92.6	Very high	8 Å²	8	25 Å²	25	4%	0.041	13%	0.126	C	C	.	.	H	α-helix	trans	-58.5	-50.1	171.4	-67.8	165.7	0	0	0	109.9	T80 F83 I84 L87 N136 L142 D143 R144 L822	T80-I140 HydrophobicContact CG2-CG2 4.37Å; F83-I140 HydrophobicContact CB-CD1 4.15Å; F83-I140 HydrophobicContact CB-CG1 3.49Å; F83-I140 VanDerWaalsContact CB-CG1 3.49Å; F83-I140 HydrophobicContact CG-CG1 4.25Å; I84-I140 HydrophobicContact CG1-CD1 3.98Å; L87-I140 HydrophobicContact CD2-CD1 4.24Å; N136-I140 WeakPolarHBondContact O-CG1 3.33Å; N136-I140 PolarHBondContact O-N 2.99Å; I140-L142 VanDerWaalsContact C-N 3.34Å; I140-L142 PolarHBondContact O-N 3.23Å; I140-D143 PolarHBondContact O-N 3.1Å; I140-R144 HydrophobicContact CG2-CG 4.31Å; I140-R144 VanDerWaalsContact O-CG 3.22Å; I140-R144 WeakPolarHBondContact O-CG 3.45Å; I140-R144 PolarHBondContact O-N 3.22Å; I140-L822 HydrophobicContact CG2-CD2 3.88Å
141	C	92.3	Very high	92.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-53.4	-48.5	177.7	175.6	0	0	0	0	112.6	L137 V138 R144 Y145 L219 V222 Y223	L137-C141 VanDerWaalsContact O-CB 3.29Å; L137-C141 WeakPolarHBondContact O-CB 3.24Å; L137-C141 PolarHBondContact O-N 3.4Å; V138-C141 VanDerWaalsContact O-CB 3.31Å; V138-C141 WeakPolarHBondContact O-CB 3.33Å; V138-C141 PolarHBondContact O-N 3.1Å; C141-R144 PolarHBondContact O-N 3.26Å; C141-Y145 PolarHBondContact O-N 3.38Å; C141-L219 HydrophobicContact CB-CD2 3.43Å; C141-L219 VanDerWaalsContact CB-CD2 3.43Å; C141-V222 WeakPolarHBondContact SG-CG1 3.33Å; C141-Y223 HydrophobicContact CB-CD2 4.39Å; C141-Y223 HydrophobicContact CB-CE2 3.73Å; C141-Y223 WeakPolarHBondContact SG-CD2 3.44Å; C141-Y223 WeakPolarHBondContact SG-CE2 3.32Å
142	L	92.6	Very high	91.7	Very high	71 Å²	71	34.5 Å²	34.5	37%	0.372	18%	0.178	S	C	.	.	H	α-helix	trans	-68.4	-39.2	-179.5	-69.2	172.4	0	0	0	112.4	V138 A139 I140 R144 Y145 L146 V222	V138-L142 HydrophobicContact CG1-CD1 3.91Å; V138-L142 HydrophobicContact CG1-CG 4.32Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.24Å; A139-L142 PolarHBondContact O-N 2.89Å; I140-L142 VanDerWaalsContact C-N 3.34Å; I140-L142 PolarHBondContact O-N 3.23Å; L142-R144 VanDerWaalsContact C-N 3.33Å; L142-R144 PolarHBondContact O-N 3.46Å; L142-Y145 PolarHBondContact O-N 2.87Å; L142-L146 WeakPolarHBondContact O-CG 3.47Å; L142-L146 PolarHBondContact O-N 3.1Å; L142-V222 HydrophobicContact CD2-CG1 4.46Å; L142-V222 HydrophobicContact CD2-CG2 4Å
143	D	91.2	Very high	91.1	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-62	-40.8	172.9	177	79.7	0	0	0	111.9	T80 F83 A139 I140 L146 A147 Y154 R162	T80-D143 PolarHBondContact OG1-OD2 2.68Å; F83-D143 HydrophobicContact CD2-CB 4.36Å; F83-D143 HydrophobicContact CE2-CB 3.8Å; A139-D143 WeakPolarHBondContact O-CB 3.22Å; A139-D143 PolarHBondContact O-N 2.94Å; I140-D143 PolarHBondContact O-N 3.1Å; D143-L146 PolarHBondContact O-N 2.82Å; D143-A147 WeakPolarHBondContact O-CB 3.45Å; D143-A147 PolarHBondContact O-N 3.03Å; D143-Y154 VanDerWaalsContact OD1-CE2 3.24Å; D143-Y154 WeakPolarHBondContact OD1-CE2 3.41Å; D143-Y154 PolarHBondContact OD1-OH 3.25Å; D143-Y154 PolarHBondContact OD2-OH 2.93Å; D143-R162 IonicContact OD1-CZ 2.78Å; D143-R162 IonicContact OD1-NH2 3.44Å; D143-R162 PolarHBondContact OD1-NH2 3.09Å
144	R	89.2	Confident	90.6	Very high	61 Å²	61	41.6 Å²	41.6	23%	0.23	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-37.5	174.6	-61	-64.2	77.6	-171.2	-7.8	112.1	T80 I140 C141 L142 A147 V148 Y154 L822	T80-R144 PolarHBondContact OG1-NE 3.36Å; T80-R144 PolarHBondContact OG1-NH1 3.29Å; T80-R144 PolarHBondContact OG1-NH2 2.83Å; I140-R144 HydrophobicContact CG2-CG 4.31Å; I140-R144 VanDerWaalsContact O-CG 3.22Å; I140-R144 WeakPolarHBondContact O-CG 3.45Å; I140-R144 PolarHBondContact O-N 3.22Å; C141-R144 PolarHBondContact O-N 3.26Å; L142-R144 VanDerWaalsContact C-N 3.33Å; L142-R144 PolarHBondContact O-N 3.46Å; R144-A147 PolarHBondContact O-N 2.98Å; R144-V148 WeakPolarHBondContact O-CB 3.5Å; R144-V148 WeakPolarHBondContact O-CG2 3.08Å; R144-V148 PolarHBondContact O-N 3.27Å; R144-Y154 PolarHBondContact NH2-OH 2.94Å; R144-L822 HydrophobicContact CB-CD1 4.26Å; R144-L822 HydrophobicContact CG-CD1 3.67Å; R144-L822 HydrophobicContact CG-CD2 4.35Å
145	Y	91	Very high	90	Very high	58 Å²	58	45.2 Å²	45.2	23%	0.227	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-42.8	171.9	179.3	-110.2	0	0	0	112.1	C141 L142 V148 T149 V222 R225 I226 L229	C141-Y145 PolarHBondContact O-N 3.38Å; L142-Y145 PolarHBondContact O-N 2.87Å; Y145-V148 PolarHBondContact O-N 2.71Å; Y145-T149 HydrophobicContact CD1-CG2 4.39Å; Y145-T149 HydrophobicContact CD2-CG2 3.86Å; Y145-T149 HydrophobicContact CE1-CG2 4.09Å; Y145-T149 HydrophobicContact CE2-CG2 3.51Å; Y145-T149 HydrophobicContact CG-CG2 4.3Å; Y145-T149 WeakPolarHBondContact O-CB 3.24Å; Y145-T149 WeakPolarHBondContact O-CG2 3.47Å; Y145-T149 PolarHBondContact O-N 2.89Å; Y145-T149 PolarHBondContact O-OG1 3.06Å; Y145-V222 HydrophobicContact CD1-CG1 4.47Å; Y145-V222 HydrophobicContact CD2-CG1 3.91Å; Y145-V222 HydrophobicContact CG-CG1 3.74Å; Y145-R225 HydrophobicContact CE2-CB 3.83Å; Y145-I226 HydrophobicContact CD2-CG1 3.87Å; Y145-L229 HydrophobicContact CE2-CD1 4.28Å
146	L	90.8	Very high	89.1	Confident	61 Å²	61	53.2 Å²	53.2	32%	0.319	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-43.2	175.7	-71.6	171.4	0	0	0	112	L142 D143 T149 K150 Y154	L142-L146 WeakPolarHBondContact O-CG 3.47Å; L142-L146 PolarHBondContact O-N 3.1Å; D143-L146 PolarHBondContact O-N 2.82Å; L146-T149 PolarHBondContact O-OG1 3.08Å; L146-K150 PolarHBondContact O-N 3.5Å; L146-Y154 HydrophobicContact CB-CD2 4.14Å; L146-Y154 HydrophobicContact CB-CE2 4.45Å
147	A	88.3	Confident	87.8	Confident	22 Å²	22	58.8 Å²	58.8	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-44.3	175.8	0	0	0	0	0	112.2	D143 R144 P151 Y154	D143-A147 WeakPolarHBondContact O-CB 3.45Å; D143-A147 PolarHBondContact O-N 3.03Å; R144-A147 PolarHBondContact O-N 2.98Å; A147-P151 WeakPolarHBondContact O-CA 3.48Å; A147-Y154 VanDerWaalsContact CA-CD2 3.48Å; A147-Y154 HydrophobicContact CB-CD1 4.11Å; A147-Y154 HydrophobicContact CB-CD2 3.78Å; A147-Y154 HydrophobicContact CB-CE1 4.1Å; A147-Y154 HydrophobicContact CB-CE2 3.73Å; A147-Y154 HydrophobicContact CB-CG 3.99Å
148	V	87.3	Confident	86.7	Confident	25 Å²	25	64.3 Å²	64.3	15%	0.152	33%	0.332	C	S	.	.	H	α-helix	trans	-69.8	-46.3	178.3	171.5	0	0	0	0	111.2	R144 Y145 I226 L229 I230 R233	R144-V148 WeakPolarHBondContact O-CB 3.5Å; R144-V148 WeakPolarHBondContact O-CG2 3.08Å; R144-V148 PolarHBondContact O-N 3.27Å; Y145-V148 PolarHBondContact O-N 2.71Å; V148-I226 HydrophobicContact CG2-CG2 4.41Å; V148-L229 HydrophobicContact CG1-CB 4.44Å; V148-I230 HydrophobicContact CG1-CG1 4.37Å; V148-R233 PolarHBondContact O-NH1 3.44Å; V148-R233 PolarHBondContact O-NH2 2.98Å
149	T	89.8	Confident	86	Confident	37 Å²	37	64.9 Å²	64.9	23%	0.227	33%	0.334	C	S	.	.	H	α-helix	trans	-71.8	-47.7	-175.9	50.6	0	0	0	0	113.4	Y145 L146 P151 L229	Y145-T149 HydrophobicContact CD1-CG2 4.39Å; Y145-T149 HydrophobicContact CD2-CG2 3.86Å; Y145-T149 HydrophobicContact CE1-CG2 4.09Å; Y145-T149 HydrophobicContact CE2-CG2 3.51Å; Y145-T149 HydrophobicContact CG-CG2 4.3Å; Y145-T149 WeakPolarHBondContact O-CB 3.24Å; Y145-T149 WeakPolarHBondContact O-CG2 3.47Å; Y145-T149 PolarHBondContact O-N 2.89Å; Y145-T149 PolarHBondContact O-OG1 3.06Å; L146-T149 PolarHBondContact O-OG1 3.08Å; T149-P151 VanDerWaalsContact O-CD 3.24Å; T149-P151 WeakPolarHBondContact O-CD 3.27Å; T149-L229 HydrophobicContact CG2-CD1 3.55Å
150	K	87.4	Confident	85.6	Confident	121 Å²	121	67.1 Å²	67.1	53%	0.526	34%	0.344	S	S	.	.			trans	-120.9	54.8	-169	-63	-178.3	178.8	-177	0	112.4	L146 I152 I153 Y154	L146-K150 PolarHBondContact O-N 3.5Å; K150-I152 VanDerWaalsContact C-N 3.33Å; K150-I152 PolarHBondContact O-N 2.88Å; K150-I153 HydrophobicContact CB-CB 4.36Å; K150-I153 HydrophobicContact CB-CD1 4.47Å; K150-I153 HydrophobicContact CD-CD1 4.39Å; K150-I153 PolarHBondContact O-N 3.39Å; K150-I153 VanDerWaalsContact O-N 3.1Å; K150-Y154 WeakPolarHBondContact O-CB 3.41Å; K150-Y154 PolarHBondContact O-N 2.93Å
151	P	86.2	Confident	85.5	Confident	62 Å²	62	75.7 Å²	75.7	40%	0.403	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-36.5	-166.9	22.9	-34.6	0	0	0	114.3	A147 T149 A155	A147-P151 WeakPolarHBondContact O-CA 3.48Å; T149-P151 VanDerWaalsContact O-CD 3.24Å; T149-P151 WeakPolarHBondContact O-CD 3.27Å; P151-A155 VanDerWaalsContact O-CB 3.28Å; P151-A155 WeakPolarHBondContact O-CB 3.48Å; P151-A155 PolarHBondContact O-N 3.45Å
152	I	85.9	Confident	85.4	Confident	142 Å²	142	78.8 Å²	78.8	73%	0.728	39%	0.387	S	S	*	.	H	α-helix	trans	-67.6	-41.9	179.5	-58.8	175	0	0	0	111.2	K150 K156	K150-I152 VanDerWaalsContact C-N 3.33Å; K150-I152 PolarHBondContact O-N 2.88Å; I152-K156 WeakPolarHBondContact O-CB 3.37Å; I152-K156 PolarHBondContact O-N 2.99Å; I152-K156 VanDerWaalsContact O-N 3.1Å
153	I	85	Confident	85.4	Confident	113 Å²	113	75.4 Å²	75.4	58%	0.579	37%	0.369	S	S	*	.	H	α-helix	trans	-71.5	-42.2	178.9	-59.6	172.5	0	0	0	109.6	K150 A155 K156 H157	K150-I153 HydrophobicContact CB-CB 4.36Å; K150-I153 HydrophobicContact CB-CD1 4.47Å; K150-I153 HydrophobicContact CD-CD1 4.39Å; K150-I153 PolarHBondContact O-N 3.39Å; K150-I153 VanDerWaalsContact O-N 3.1Å; I153-A155 VanDerWaalsContact C-N 3.3Å; I153-A155 PolarHBondContact O-N 2.9Å; I153-K156 PolarHBondContact O-N 3.4Å; I153-H157 PolarHBondContact O-N 3.46Å; I153-H157 VanDerWaalsContact O-N 3.16Å
154	Y	85.3	Confident	85.5	Confident	36 Å²	36	80.3 Å²	80.3	14%	0.141	39%	0.392	C	S	.	.	H	α-helix	trans	-59.6	-38.6	176	-168.3	-79.4	0	0	0	112.3	D143 R144 L146 A147 K150 N159	D143-Y154 VanDerWaalsContact OD1-CE2 3.24Å; D143-Y154 WeakPolarHBondContact OD1-CE2 3.41Å; D143-Y154 PolarHBondContact OD1-OH 3.25Å; D143-Y154 PolarHBondContact OD2-OH 2.93Å; R144-Y154 PolarHBondContact NH2-OH 2.94Å; L146-Y154 HydrophobicContact CB-CD2 4.14Å; L146-Y154 HydrophobicContact CB-CE2 4.45Å; A147-Y154 VanDerWaalsContact CA-CD2 3.48Å; A147-Y154 HydrophobicContact CB-CD1 4.11Å; A147-Y154 HydrophobicContact CB-CD2 3.78Å; A147-Y154 HydrophobicContact CB-CE1 4.1Å; A147-Y154 HydrophobicContact CB-CE2 3.73Å; A147-Y154 HydrophobicContact CB-CG 3.99Å; K150-Y154 WeakPolarHBondContact O-CB 3.41Å; K150-Y154 PolarHBondContact O-N 2.93Å; Y154-N159 PolarHBondContact O-ND2 3.37Å
155	A	81.6	Confident	85.8	Confident	76 Å²	76	81.4 Å²	81.4	63%	0.628	40%	0.402	S	S	*	.	H	α-helix	trans	-77	-27.4	177.5	0	0	0	0	0	113.8	P151 I153	P151-A155 VanDerWaalsContact O-CB 3.28Å; P151-A155 WeakPolarHBondContact O-CB 3.48Å; P151-A155 PolarHBondContact O-N 3.45Å; I153-A155 VanDerWaalsContact C-N 3.3Å; I153-A155 PolarHBondContact O-N 2.9Å
156	K	76.5	Confident	86	Confident	192 Å²	192	80.4 Å²	80.4	84%	0.835	40%	0.403	S	S	*	.	H	α-helix	trans	-81.3	-32.2	-179.1	-173.3	177.2	178.9	-175.4	0	113.5	I152 I153	I152-K156 WeakPolarHBondContact O-CB 3.37Å; I152-K156 PolarHBondContact O-N 2.99Å; I152-K156 VanDerWaalsContact O-N 3.1Å; I153-K156 PolarHBondContact O-N 3.4Å
157	H	69.7	Low	86.3	Confident	117 Å²	117	79.2 Å²	79.2	54%	0.542	40%	0.397	S	S	.	.	S	Bend	trans	-85.1	139.3	-174.8	-158.5	-79.3	0	0	0	111.9	I153 N159	I153-H157 PolarHBondContact O-N 3.46Å; I153-H157 VanDerWaalsContact O-N 3.16Å; H157-N159 PolarHBondContact O-N 3.36Å; H157-N159 PolarHBondContact O-ND2 3.37Å
158	N	69.9	Low	86.8	Confident	123 Å²	123	80.4 Å²	80.4	66%	0.658	41%	0.407	S	S	*	.			trans	-64.8	103.4	164	179.7	-8.9	0	0	0	108.3	M160	N158-M160 PolarHBondContact O-N 3.47Å; N158-M160 WeakPolarHBondContact OD1-CB 3.48Å; N158-M160 PolarHBondContact OD1-N 3.01Å; N158-M160 VanDerWaalsContact OD1-N 3.11Å
159	N	79.2	Confident	87.2	Confident	23 Å²	23	83.9 Å²	83.9	12%	0.123	42%	0.424	C	S	.	.			trans	-71.4	-15	-171.4	-68.5	-61.3	0	0	0	113.2	A79 Y154 H157 R161 R162 V163	A79-N159 HydrophobicContact CB-CB 3.73Å; Y154-N159 PolarHBondContact O-ND2 3.37Å; H157-N159 PolarHBondContact O-N 3.36Å; H157-N159 PolarHBondContact O-ND2 3.37Å; N159-R161 PolarHBondContact O-N 2.94Å; N159-R162 WeakPolarHBondContact O-CB 3.43Å; N159-R162 PolarHBondContact O-N 3.12Å; N159-R162 VanDerWaalsContact O-N 3.15Å; N159-R162 VanDerWaalsContact OD1-CZ 3.31Å; N159-R162 PolarHBondContact OD1-NH1 3.08Å; N159-R162 PolarHBondContact OD1-NH2 3.08Å; N159-R162 VanDerWaalsContact OD1-NH2 3.1Å; N159-V163 WeakPolarHBondContact O-CG2 3.28Å; N159-V163 PolarHBondContact O-N 3.42Å; N159-V163 VanDerWaalsContact O-N 3.1Å
160	M	86.1	Confident	87.6	Confident	57 Å²	57	82.8 Å²	82.8	28%	0.281	42%	0.417	S	S	.	.	H	α-helix	trans	-61	-46.9	-169.1	-167	61	-178.1	0	0	113.5	W82 N158 R162 V163 Q164	W82-M160 VanDerWaalsContact CD1-SD 3.56Å; W82-M160 HydrophobicContact CD2-CE 3.88Å; W82-M160 HydrophobicContact CG-CE 3.92Å; W82-M160 HydrophobicContact CG-SD 4.15Å; W82-M160 HydrophobicContact CZ2-CE 4.33Å; N158-M160 PolarHBondContact O-N 3.47Å; N158-M160 WeakPolarHBondContact OD1-CB 3.48Å; N158-M160 PolarHBondContact OD1-N 3.01Å; N158-M160 VanDerWaalsContact OD1-N 3.11Å; M160-R162 VanDerWaalsContact C-N 3.27Å; M160-R162 PolarHBondContact O-N 3.39Å; M160-V163 PolarHBondContact O-N 3.1Å; M160-Q164 HydrophobicContact CE-CG 4.12Å; M160-Q164 HydrophobicContact CG-CG 4.42Å; M160-Q164 WeakPolarHBondContact O-CG 3.14Å; M160-Q164 PolarHBondContact O-N 2.96Å; M160-Q164 PolarHBondContact O-OE1 3.27Å
161	R	89.4	Confident	88.2	Confident	188 Å²	188	80.2 Å²	80.2	71%	0.709	40%	0.404	S	S	*	.	H	α-helix	trans	-61.6	-34.1	178.5	-172.5	176.5	178.9	-176.1	0.8	112.5	N159 I165	N159-R161 PolarHBondContact O-N 2.94Å; R161-I165 HydrophobicContact CG-CD1 4.01Å; R161-I165 WeakPolarHBondContact O-CD1 3.28Å; R161-I165 VanDerWaalsContact O-CG1 3.28Å; R161-I165 WeakPolarHBondContact O-CG1 3.45Å; R161-I165 PolarHBondContact O-N 2.84Å; R161-I165 VanDerWaalsContact O-N 3.16Å
162	R	90.7	Very high	88.7	Confident	65 Å²	65	81.7 Å²	81.7	25%	0.245	41%	0.408	C	S	.	.	H	α-helix	trans	-64	-48.8	172.6	-177.5	-174.9	68.8	-117.1	-0.8	110.2	D143 N159 M160 Q164 I165 S166	D143-R162 IonicContact OD1-CZ 2.78Å; D143-R162 IonicContact OD1-NH2 3.44Å; D143-R162 PolarHBondContact OD1-NH2 3.09Å; N159-R162 WeakPolarHBondContact O-CB 3.43Å; N159-R162 PolarHBondContact O-N 3.12Å; N159-R162 VanDerWaalsContact O-N 3.15Å; N159-R162 VanDerWaalsContact OD1-CZ 3.31Å; N159-R162 PolarHBondContact OD1-NH1 3.08Å; N159-R162 PolarHBondContact OD1-NH2 3.08Å; N159-R162 VanDerWaalsContact OD1-NH2 3.1Å; M160-R162 VanDerWaalsContact C-N 3.27Å; M160-R162 PolarHBondContact O-N 3.39Å; R162-Q164 PolarHBondContact O-N 3.48Å; R162-I165 PolarHBondContact O-N 2.69Å; R162-S166 WeakPolarHBondContact O-CB 3.38Å; R162-S166 PolarHBondContact O-N 3.11Å; R162-S166 PolarHBondContact O-OG 3.37Å; R162-S166 VanDerWaalsContact O-OG 3.09Å
163	V	93.5	Very high	89.2	Confident	0 Å²	0	78 Å²	78	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-60.5	-45.9	-178.7	175.8	0	0	0	0	111.2	A79 W82 F83 N159 M160 I165 S166 I167	A79-V163 HydrophobicContact CB-CG2 3.89Å; A79-V163 WeakPolarHBondContact O-CG2 3.05Å; W82-V163 HydrophobicContact CB-CG1 3.85Å; F83-V163 HydrophobicContact CD1-CG1 4.24Å; F83-V163 HydrophobicContact CD2-CG1 4.1Å; F83-V163 HydrophobicContact CD2-CG2 4.44Å; F83-V163 HydrophobicContact CE1-CG1 4.04Å; F83-V163 HydrophobicContact CE2-CB 4.24Å; F83-V163 HydrophobicContact CE2-CG1 3.91Å; F83-V163 HydrophobicContact CE2-CG2 3.73Å; F83-V163 HydrophobicContact CG-CG1 4.27Å; F83-V163 HydrophobicContact CZ-CB 4.14Å; F83-V163 HydrophobicContact CZ-CG1 3.88Å; F83-V163 HydrophobicContact CZ-CG2 4.03Å; N159-V163 WeakPolarHBondContact O-CG2 3.28Å; N159-V163 PolarHBondContact O-N 3.42Å; N159-V163 VanDerWaalsContact O-N 3.1Å; M160-V163 PolarHBondContact O-N 3.1Å; V163-I165 PolarHBondContact O-N 3.45Å; V163-S166 PolarHBondContact O-N 2.95Å; V163-I167 HydrophobicContact CG1-CD1 3.68Å; V163-I167 HydrophobicContact CG1-CG1 4.32Å; V163-I167 WeakPolarHBondContact O-CB 3.39Å; V163-I167 WeakPolarHBondContact O-CG1 3.39Å; V163-I167 PolarHBondContact O-N 2.93Å
164	Q	93.6	Very high	89.9	Confident	107 Å²	107	72.6 Å²	72.6	50%	0.5	36%	0.364	S	S	.	.	H	α-helix	trans	-58.7	-46.8	176.9	-70.4	168.6	-52.6	0	0	112.2	M160 R162 I167 A168	M160-Q164 HydrophobicContact CE-CG 4.12Å; M160-Q164 HydrophobicContact CG-CG 4.42Å; M160-Q164 WeakPolarHBondContact O-CG 3.14Å; M160-Q164 PolarHBondContact O-N 2.96Å; M160-Q164 PolarHBondContact O-OE1 3.27Å; R162-Q164 PolarHBondContact O-N 3.48Å; Q164-I167 PolarHBondContact O-N 2.93Å; Q164-A168 WeakPolarHBondContact O-CB 3.3Å; Q164-A168 PolarHBondContact O-N 3.1Å
165	I	95.1	Very high	90.4	Very high	85 Å²	85	76 Å²	76	44%	0.436	38%	0.38	S	S	.	.	H	α-helix	trans	-63.9	-42.8	176.2	-67.4	167.4	0	0	0	110.9	R161 R162 V163 I167 A168 L169	R161-I165 HydrophobicContact CG-CD1 4.01Å; R161-I165 WeakPolarHBondContact O-CD1 3.28Å; R161-I165 VanDerWaalsContact O-CG1 3.28Å; R161-I165 WeakPolarHBondContact O-CG1 3.45Å; R161-I165 PolarHBondContact O-N 2.84Å; R161-I165 VanDerWaalsContact O-N 3.16Å; R162-I165 PolarHBondContact O-N 2.69Å; V163-I165 PolarHBondContact O-N 3.45Å; I165-I167 PolarHBondContact O-N 2.92Å; I165-A168 PolarHBondContact O-N 3.3Å; I165-L169 HydrophobicContact CG2-CD1 3.96Å; I165-L169 HydrophobicContact CG2-CG 4.42Å; I165-L169 WeakPolarHBondContact O-CB 3.13Å; I165-L169 VanDerWaalsContact O-CG 3.3Å; I165-L169 WeakPolarHBondContact O-CG 3.45Å; I165-L169 PolarHBondContact O-N 2.89Å
166	S	94.8	Very high	91	Very high	37 Å²	37	77.9 Å²	77.9	26%	0.259	38%	0.379	S	S	.	.	H	α-helix	trans	-64.1	-38.3	177.2	-65.5	0	0	0	0	112.9	R162 V163 V170	R162-S166 WeakPolarHBondContact O-CB 3.38Å; R162-S166 PolarHBondContact O-N 3.11Å; R162-S166 PolarHBondContact O-OG 3.37Å; R162-S166 VanDerWaalsContact O-OG 3.09Å; V163-S166 PolarHBondContact O-N 2.95Å; S166-V170 WeakPolarHBondContact O-CG2 3.39Å; S166-V170 PolarHBondContact O-N 3.43Å
167	I	97.6	Very high	91.9	Very high	35 Å²	35	70.2 Å²	70.2	18%	0.179	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-48.2	173.8	-71.8	168.7	0	0	0	110.1	F83 V163 Q164 I165 L169 V170 W171	F83-I167 HydrophobicContact CD1-CD1 4.15Å; F83-I167 HydrophobicContact CD1-CG1 3.61Å; F83-I167 HydrophobicContact CE1-CG1 3.8Å; V163-I167 HydrophobicContact CG1-CD1 3.68Å; V163-I167 HydrophobicContact CG1-CG1 4.32Å; V163-I167 WeakPolarHBondContact O-CB 3.39Å; V163-I167 WeakPolarHBondContact O-CG1 3.39Å; V163-I167 PolarHBondContact O-N 2.93Å; Q164-I167 PolarHBondContact O-N 2.93Å; I165-I167 PolarHBondContact O-N 2.92Å; I167-L169 VanDerWaalsContact C-N 3.32Å; I167-L169 PolarHBondContact O-N 3.1Å; I167-V170 WeakPolarHBondContact O-CB 3.38Å; I167-V170 PolarHBondContact O-N 3.44Å; I167-V170 VanDerWaalsContact O-N 3.12Å; I167-W171 VanDerWaalsContact O-CD1 3.28Å; I167-W171 PolarHBondContact O-N 2.89Å; I167-W171 VanDerWaalsContact O-N 3.08Å
168	A	97.7	Very high	93.1	Very high	47 Å²	47	64.6 Å²	64.6	39%	0.388	32%	0.321	S	S	.	.	H	α-helix	trans	-57.7	-44.1	177.5	0	0	0	0	0	112	Q164 I165 V170 W171 I172	Q164-A168 WeakPolarHBondContact O-CB 3.3Å; Q164-A168 PolarHBondContact O-N 3.1Å; I165-A168 PolarHBondContact O-N 3.3Å; A168-V170 PolarHBondContact O-N 2.94Å; A168-W171 PolarHBondContact O-N 2.74Å; A168-I172 WeakPolarHBondContact O-CB 3.26Å; A168-I172 WeakPolarHBondContact O-CD1 3.17Å; A168-I172 VanDerWaalsContact O-CG1 3.23Å; A168-I172 WeakPolarHBondContact O-CG1 3.48Å; A168-I172 PolarHBondContact O-N 3.19Å
169	L	97.3	Very high	94.1	Very high	98 Å²	98	60.5 Å²	60.5	51%	0.513	30%	0.3	S	S	.	.	H	α-helix	trans	-62.5	-39.3	175.4	-71.8	170.3	0	0	0	112.9	I165 I167 I172 V173	I165-L169 HydrophobicContact CG2-CD1 3.96Å; I165-L169 HydrophobicContact CG2-CG 4.42Å; I165-L169 WeakPolarHBondContact O-CB 3.13Å; I165-L169 VanDerWaalsContact O-CG 3.3Å; I165-L169 WeakPolarHBondContact O-CG 3.45Å; I165-L169 PolarHBondContact O-N 2.89Å; I167-L169 VanDerWaalsContact C-N 3.32Å; I167-L169 PolarHBondContact O-N 3.1Å; L169-I172 PolarHBondContact O-N 2.97Å; L169-V173 WeakPolarHBondContact O-CB 3.19Å; L169-V173 VanDerWaalsContact O-CG2 3.29Å; L169-V173 WeakPolarHBondContact O-CG2 3.37Å; L169-V173 PolarHBondContact O-N 3.5Å
170	V	97.9	Very high	94.6	Very high	14 Å²	14	61 Å²	61	9%	0.085	31%	0.305	C	S	.	.	H	α-helix	trans	-58.8	-49	174.5	161.4	0	0	0	0	111	L135 A139 S166 I167 A168 S174	L135-V170 HydrophobicContact CB-CB 4.38Å; L135-V170 HydrophobicContact CB-CG1 3.78Å; L135-V170 HydrophobicContact CB-CG2 4.1Å; A139-V170 HydrophobicContact CB-CG2 4.05Å; S166-V170 WeakPolarHBondContact O-CG2 3.39Å; S166-V170 PolarHBondContact O-N 3.43Å; I167-V170 WeakPolarHBondContact O-CB 3.38Å; I167-V170 PolarHBondContact O-N 3.44Å; I167-V170 VanDerWaalsContact O-N 3.12Å; A168-V170 PolarHBondContact O-N 2.94Å; V170-S174 WeakPolarHBondContact O-CB 3.48Å; V170-S174 PolarHBondContact O-N 3.09Å; V170-S174 PolarHBondContact O-OG 3.38Å
171	W	98.4	Very high	94.5	Very high	67 Å²	67	58.4 Å²	58.4	25%	0.254	29%	0.292	S	S	.	.	H	α-helix	trans	-67.7	-41.1	-180	-76	98.3	0	0	0	112.6	S86 I89 A90 F129 A132 I167 A168 S174 F175	S86-W171 PolarHBondContact OG-NE1 3.39Å; I89-W171 HydrophobicContact CG2-CH2 4.46Å; I89-W171 HydrophobicContact CG2-CZ2 4.14Å; A90-W171 HydrophobicContact CB-CH2 3.86Å; A90-W171 HydrophobicContact CB-CZ2 3.98Å; F129-W171 AromaticContact CD1-CH2 3.99Å; F129-W171 HydrophobicContact CD1-CH2 3.99Å; F129-W171 AromaticContact CD1-CZ3 3.81Å; F129-W171 HydrophobicContact CD1-CZ3 3.81Å; F129-W171 HydrophobicContact CE1-CH2 4.18Å; F129-W171 AromaticContact CE1-CZ3 3.83Å; F129-W171 HydrophobicContact CE1-CZ3 3.83Å; A132-W171 HydrophobicContact CB-CD2 4.37Å; A132-W171 HydrophobicContact CB-CE3 4.09Å; A132-W171 HydrophobicContact CB-CH2 4.13Å; A132-W171 HydrophobicContact CB-CZ2 4.38Å; A132-W171 HydrophobicContact CB-CZ3 3.97Å; I167-W171 VanDerWaalsContact O-CD1 3.28Å; I167-W171 PolarHBondContact O-N 2.89Å; I167-W171 VanDerWaalsContact O-N 3.08Å; A168-W171 PolarHBondContact O-N 2.74Å; W171-S174 PolarHBondContact O-N 3.47Å; W171-F175 WeakPolarHBondContact O-CB 3.46Å; W171-F175 PolarHBondContact O-N 3.23Å
172	I	98	Very high	94.2	Very high	94 Å²	94	53.5 Å²	53.5	48%	0.482	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-47.6	176.5	-69.4	163.6	0	0	0	111.4	A168 L169 S174 F175 L176	A168-I172 WeakPolarHBondContact O-CB 3.26Å; A168-I172 WeakPolarHBondContact O-CD1 3.17Å; A168-I172 VanDerWaalsContact O-CG1 3.23Å; A168-I172 WeakPolarHBondContact O-CG1 3.48Å; A168-I172 PolarHBondContact O-N 3.19Å; L169-I172 PolarHBondContact O-N 2.97Å; I172-S174 VanDerWaalsContact C-N 3.32Å; I172-S174 PolarHBondContact O-N 3.25Å; I172-F175 PolarHBondContact O-N 3.12Å; I172-L176 HydrophobicContact CG2-CD1 3.92Å; I172-L176 HydrophobicContact CG2-CG 4.46Å; I172-L176 WeakPolarHBondContact O-CG 3.49Å; I172-L176 PolarHBondContact O-N 2.86Å
173	V	97	Very high	93.9	Very high	64 Å²	64	54.8 Å²	54.8	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-65.5	-37.4	179.1	173.6	0	0	0	0	111.3	L135 L169 L176 I177	L135-V173 HydrophobicContact CD1-CB 4.04Å; L135-V173 HydrophobicContact CD1-CG1 3.69Å; L169-V173 WeakPolarHBondContact O-CB 3.19Å; L169-V173 VanDerWaalsContact O-CG2 3.29Å; L169-V173 WeakPolarHBondContact O-CG2 3.37Å; L169-V173 PolarHBondContact O-N 3.5Å; V173-L176 PolarHBondContact O-N 3.16Å; V173-I177 HydrophobicContact CG1-CD1 4Å; V173-I177 WeakPolarHBondContact O-CG1 3.25Å; V173-I177 PolarHBondContact O-N 2.92Å
174	S	97.8	Very high	92.9	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-40.9	175.8	-52.2	0	0	0	0	111.9	A132 V170 W171 I172 I177 A178	A132-S174 VanDerWaalsContact CA-OG 3.23Å; A132-S174 WeakPolarHBondContact CA-OG 3.38Å; A132-S174 PolarHBondContact N-OG 3.38Å; V170-S174 WeakPolarHBondContact O-CB 3.48Å; V170-S174 PolarHBondContact O-N 3.09Å; V170-S174 PolarHBondContact O-OG 3.38Å; W171-S174 PolarHBondContact O-N 3.47Å; I172-S174 VanDerWaalsContact C-N 3.32Å; I172-S174 PolarHBondContact O-N 3.25Å; S174-I177 PolarHBondContact O-N 2.9Å; S174-A178 PolarHBondContact O-N 3.28Å
175	F	96.4	Very high	91.9	Very high	106 Å²	106	55.7 Å²	55.7	47%	0.465	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-47	175	-174.2	-112.6	0	0	0	111.9	L128 W171 I172 I177 A178 V179	L128-F175 HydrophobicContact CD1-CB 4.22Å; W171-F175 WeakPolarHBondContact O-CB 3.46Å; W171-F175 PolarHBondContact O-N 3.23Å; I172-F175 PolarHBondContact O-N 3.12Å; F175-I177 PolarHBondContact O-N 3.12Å; F175-A178 PolarHBondContact O-N 3.14Å; F175-V179 HydrophobicContact CD1-CG2 3.66Å; F175-V179 HydrophobicContact CD2-CG2 3.79Å; F175-V179 HydrophobicContact CE1-CG2 3.4Å; F175-V179 VanDerWaalsContact CE1-CG2 3.4Å; F175-V179 HydrophobicContact CE2-CG2 3.53Å; F175-V179 HydrophobicContact CG-CG2 3.85Å; F175-V179 HydrophobicContact CZ-CG2 3.33Å; F175-V179 WeakPolarHBondContact O-CB 3.33Å; F175-V179 VanDerWaalsContact O-CG2 3.24Å; F175-V179 WeakPolarHBondContact O-CG2 3.3Å; F175-V179 PolarHBondContact O-N 3.27Å
176	L	95.4	Very high	90.9	Very high	116 Å²	116	52.4 Å²	52.4	61%	0.607	30%	0.299	S	S	*	.	H	α-helix	trans	-61.4	-26.6	178.1	-69.5	170	0	0	0	113.8	I172 V173	I172-L176 HydrophobicContact CG2-CD1 3.92Å; I172-L176 HydrophobicContact CG2-CG 4.46Å; I172-L176 WeakPolarHBondContact O-CG 3.49Å; I172-L176 PolarHBondContact O-N 2.86Å; V173-L176 PolarHBondContact O-N 3.16Å
177	I	94.9	Very high	89.7	Confident	31 Å²	31	56.9 Å²	56.9	16%	0.159	32%	0.319	C	S	.	.	H	α-helix	trans	-79.6	-31.1	174.3	-69.7	166.7	0	0	0	111.8	V127 T131 V173 S174 F175 Y203	V127-I177 HydrophobicContact CG1-CG2 3.98Å; T131-I177 HydrophobicContact CG2-CD1 3.96Å; V173-I177 HydrophobicContact CG1-CD1 4Å; V173-I177 WeakPolarHBondContact O-CG1 3.25Å; V173-I177 PolarHBondContact O-N 2.92Å; S174-I177 PolarHBondContact O-N 2.9Å; F175-I177 PolarHBondContact O-N 3.12Å; I177-Y203 WeakPolarHBondContact O-CE2 3.18Å; I177-Y203 PolarHBondContact O-OH 2.95Å
178	A	94.3	Very high	88.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-87.7	-40.8	-176.6	0	0	0	0	0	113.7	M124 V127 L128 S174 F175 P180 L181	M124-A178 HydrophobicContact CG-CB 3.69Å; V127-A178 HydrophobicContact CB-CB 4.22Å; V127-A178 HydrophobicContact CG1-CB 4.03Å; L128-A178 HydrophobicContact CB-CB 3.86Å; S174-A178 PolarHBondContact O-N 3.28Å; F175-A178 PolarHBondContact O-N 3.14Å; A178-P180 VanDerWaalsContact C-N 3.33Å; A178-P180 WeakPolarHBondContact O-CD 3.36Å; A178-P180 VanDerWaalsContact O-N 3.11Å; A178-L181 PolarHBondContact O-N 3.23Å
179	V	91.1	Very high	87	Confident	37 Å²	37	62.7 Å²	62.7	22%	0.224	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-44.2	-41.5	-177	159	0	0	0	0	115.8	F175 L181 I182 C183	F175-V179 HydrophobicContact CD1-CG2 3.66Å; F175-V179 HydrophobicContact CD2-CG2 3.79Å; F175-V179 HydrophobicContact CE1-CG2 3.4Å; F175-V179 VanDerWaalsContact CE1-CG2 3.4Å; F175-V179 HydrophobicContact CE2-CG2 3.53Å; F175-V179 HydrophobicContact CG-CG2 3.85Å; F175-V179 HydrophobicContact CZ-CG2 3.33Å; F175-V179 WeakPolarHBondContact O-CB 3.33Å; F175-V179 VanDerWaalsContact O-CG2 3.24Å; F175-V179 WeakPolarHBondContact O-CG2 3.3Å; F175-V179 PolarHBondContact O-N 3.27Å; V179-L181 PolarHBondContact O-N 2.92Å; V179-I182 PolarHBondContact O-N 2.89Å; V179-C183 VanDerWaalsContact CG1-SG 3.6Å; V179-C183 PolarHBondContact O-N 3.31Å
180	P	89.2	Confident	85.6	Confident	34 Å²	34	65.9 Å²	65.9	22%	0.221	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-59.6	-19.4	-173.4	-25.8	35.1	0	0	0	115.3	A178 C183 L185 Y203	A178-P180 VanDerWaalsContact C-N 3.33Å; A178-P180 WeakPolarHBondContact O-CD 3.36Å; A178-P180 VanDerWaalsContact O-N 3.11Å; P180-C183 PolarHBondContact O-N 2.94Å; P180-L185 HydrophobicContact CB-CD1 3.58Å; P180-L185 HydrophobicContact CB-CG 4.21Å; P180-L185 VanDerWaalsContact O-CB 3.27Å; P180-L185 WeakPolarHBondContact O-CB 3.3Å; P180-L185 WeakPolarHBondContact O-CG 3.37Å; P180-L185 PolarHBondContact O-N 3.3Å; P180-Y203 HydrophobicContact CB-CD2 4.06Å; P180-Y203 HydrophobicContact CB-CE2 3.94Å; P180-Y203 HydrophobicContact CG-CE2 4.19Å
181	L	83.8	Confident	84.2	Confident	2 Å²	2	71.8 Å²	71.8	1%	0.01	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-62	-50.8	171.8	-71.5	162.3	0	0	0	112.1	V123 M124 V127 A178 V179 C183 G184 N186 Y203	V123-L181 HydrophobicContact CB-CD1 4.24Å; V123-L181 HydrophobicContact CG1-CD1 3.74Å; V123-L181 HydrophobicContact CG1-CD2 4.31Å; M124-L181 HydrophobicContact CB-CB 4.47Å; M124-L181 HydrophobicContact CB-CD1 4.25Å; V127-L181 HydrophobicContact CG2-CD1 4.29Å; A178-L181 PolarHBondContact O-N 3.23Å; V179-L181 PolarHBondContact O-N 2.92Å; L181-C183 VanDerWaalsContact C-N 3.28Å; L181-C183 PolarHBondContact O-N 3.05Å; L181-G184 PolarHBondContact O-N 3.04Å; L181-N186 HydrophobicContact CD2-CB 4.14Å; L181-Y203 HydrophobicContact CD1-CE1 3.81Å; L181-Y203 HydrophobicContact CD2-CD1 3.86Å; L181-Y203 HydrophobicContact CD2-CE1 3.59Å; L181-Y203 HydrophobicContact CG-CD1 4.28Å; L181-Y203 HydrophobicContact CG-CE1 3.61Å; L181-Y203 HydrophobicContact CG-CE2 4.33Å
182	I	82.7	Confident	83.2	Confident	84 Å²	84	70.2 Å²	70.2	43%	0.431	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.8	179.3	-63.6	-168.5	0	0	0	111.4	V121 M124 V179 G184	V121-I182 HydrophobicContact CG2-CD1 3.85Å; M124-I182 HydrophobicContact CB-CD1 4.29Å; M124-I182 HydrophobicContact CB-CG1 4.2Å; M124-I182 HydrophobicContact CE-CD1 3.89Å; M124-I182 HydrophobicContact CG-CD1 4.34Å; M124-I182 HydrophobicContact CG-CG1 4.39Å; M124-I182 HydrophobicContact SD-CD1 3.35Å; M124-I182 WeakPolarHBondContact SD-CD1 3.23Å; M124-I182 HydrophobicContact SD-CG1 3.86Å; V179-I182 PolarHBondContact O-N 2.89Å; I182-G184 PolarHBondContact O-N 3.44Å
183	C	85.3	Confident	82.3	Confident	92 Å²	92	69 Å²	69	62%	0.622	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	22.7	172.5	-60.2	0	0	0	0	114.2	V179 P180 L181 L185	V179-C183 VanDerWaalsContact CG1-SG 3.6Å; V179-C183 PolarHBondContact O-N 3.31Å; P180-C183 PolarHBondContact O-N 2.94Å; L181-C183 VanDerWaalsContact C-N 3.28Å; L181-C183 PolarHBondContact O-N 3.05Å; C183-L185 PolarHBondContact O-N 3.11Å
184	G	72.3	Confident	81.7	Confident	47 Å²	47	67.6 Å²	67.6	49%	0.485	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	8.6	171.6	0	0	0	0	0	115.9	L181 I182 N186	L181-G184 PolarHBondContact O-N 3.04Å; I182-G184 PolarHBondContact O-N 3.44Å; G184-N186 PolarHBondContact O-N 3.44Å
185	L	73.3	Confident	81	Confident	79 Å²	79	70.5 Å²	70.5	41%	0.414	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.7	175.1	-66	-166.5	0	0	0	113.3	P180 C183 I187 N200	P180-L185 HydrophobicContact CB-CD1 3.58Å; P180-L185 HydrophobicContact CB-CG 4.21Å; P180-L185 VanDerWaalsContact O-CB 3.27Å; P180-L185 WeakPolarHBondContact O-CB 3.3Å; P180-L185 WeakPolarHBondContact O-CG 3.37Å; P180-L185 PolarHBondContact O-N 3.3Å; C183-L185 PolarHBondContact O-N 3.11Å; L185-I187 PolarHBondContact O-N 3.11Å; L185-N200 WeakPolarHBondContact O-CB 3.39Å; L185-N200 PolarHBondContact O-ND2 3.44Å
186	N	73	Confident	80.6	Confident	16 Å²	16	66.2 Å²	66.2	9%	0.086	35%	0.351	C	S	.	.			trans	-92.5	57.3	-179	-163.3	32.2	0	0	0	113.6	D120 L181 G184 N188 Q197 S198 F199	D120-N186 WeakPolarHBondContact OD1-CB 3.45Å; D120-N186 PolarHBondContact OD1-ND2 3.02Å; L181-N186 HydrophobicContact CD2-CB 4.14Å; G184-N186 PolarHBondContact O-N 3.44Å; N186-N188 PolarHBondContact O-N 2.82Å; N186-N188 VanDerWaalsContact O-N 3.13Å; N186-Q197 PolarHBondContact ND2-O 2.88Å; N186-Q197 PolarHBondContact OD1-O 3.08Å; N186-S198 VanDerWaalsContact OD1-CA 3.23Å; N186-S198 WeakPolarHBondContact OD1-CA 3.34Å; N186-F199 PolarHBondContact OD1-N 3.35Å
187	I	70.5	Confident	79.9	Confident	132 Å²	132	64.3 Å²	64.3	68%	0.677	34%	0.339	S	S	*	.			trans	-66.1	114.5	174.3	-54.8	176	0	0	0	108.9	L185 R189	L185-I187 PolarHBondContact O-N 3.11Å; I187-R189 PolarHBondContact O-N 3.5Å; I187-R189 VanDerWaalsContact O-N 3.12Å
188	N	70.1	Confident	79.3	Confident	14 Å²	14	63.5 Å²	63.5	8%	0.075	34%	0.336	C	S	.	.			trans	-68	107.9	175.6	-179	-23	0	0	0	109.8	N186 Y190 N191 D192 F199	N186-N188 PolarHBondContact O-N 2.82Å; N186-N188 VanDerWaalsContact O-N 3.13Å; N188-Y190 PolarHBondContact O-N 3.44Å; N188-Y190 PolarHBondContact OD1-N 2.99Å; N188-N191 PolarHBondContact O-N 2.96Å; N188-N191 PolarHBondContact O-OD1 3.48Å; N188-N191 PolarHBondContact OD1-N 2.97Å; N188-D192 PolarHBondContact ND2-O 3.14Å; N188-F199 HydrophobicContact CB-CD2 4.21Å; N188-F199 HydrophobicContact CB-CE2 3.94Å
189	R	67.4	Low	78.7	Confident	189 Å²	189	65.3 Å²	65.3	71%	0.713	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.9	-173	-165	176.3	-171.5	175.3	4.6	114.3	I187 F199	I187-R189 PolarHBondContact O-N 3.5Å; I187-R189 VanDerWaalsContact O-N 3.12Å; R189-F199 HydrophobicContact CB-CD1 4.42Å
190	Y	68.3	Low	78.5	Confident	165 Å²	165	65.7 Å²	65.7	65%	0.647	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-2.5	-178.8	-59.8	-77.8	0	0	0	113	N188 D192 F199	N188-Y190 PolarHBondContact O-N 3.44Å; N188-Y190 PolarHBondContact OD1-N 2.99Å; Y190-D192 PolarHBondContact O-N 3.22Å; Y190-F199 HydrophobicContact CD2-CE1 4.1Å; Y190-F199 HydrophobicContact CE2-CE1 4.37Å
191	N	69.5	Low	78.4	Confident	138 Å²	138	64.5 Å²	64.5	74%	0.738	34%	0.338	S	S	*	.			trans	51.6	17.1	-170.1	-67.7	-32.8	0	0	0	114.8	N188 P193	N188-N191 PolarHBondContact O-N 2.96Å; N188-N191 PolarHBondContact O-OD1 3.48Å; N188-N191 PolarHBondContact OD1-N 2.97Å; N191-P193 VanDerWaalsContact O-CD 3.25Å; N191-P193 WeakPolarHBondContact O-CD 3.34Å
192	D	76.6	Confident	78.7	Confident	35 Å²	35	70.2 Å²	70.2	19%	0.187	37%	0.368	C	S	.	.			trans	-84.9	106.4	-177.5	-177.9	-10.4	0	0	0	110.6	N188 Y190 T194 I195	N188-D192 PolarHBondContact ND2-O 3.14Å; Y190-D192 PolarHBondContact O-N 3.22Å; D192-T194 VanDerWaalsContact CG-OG1 3.28Å; D192-T194 PolarHBondContact O-N 3.26Å; D192-T194 VanDerWaalsContact O-N 3.07Å; D192-T194 WeakPolarHBondContact OD1-CA 3.27Å; D192-T194 VanDerWaalsContact OD1-CB 3.26Å; D192-T194 WeakPolarHBondContact OD1-CB 3.29Å; D192-T194 WeakPolarHBondContact OD1-CG2 3.31Å; D192-T194 PolarHBondContact OD1-N 2.96Å; D192-T194 PolarHBondContact OD1-OG1 3.22Å; D192-T194 PolarHBondContact OD2-OG1 3.17Å; D192-I195 HydrophobicContact CB-CD1 4.33Å; D192-I195 HydrophobicContact CB-CG1 4.46Å; D192-I195 PolarHBondContact O-N 2.93Å
193	P	79.7	Confident	79.1	Confident	69 Å²	69	67.1 Å²	67.1	45%	0.448	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-6.7	-177.7	32.2	-37.3	0	0	0	113.4	N191	N191-P193 VanDerWaalsContact O-CD 3.25Å; N191-P193 WeakPolarHBondContact O-CD 3.34Å
194	T	84.1	Confident	79.4	Confident	33 Å²	33	63.4 Å²	63.4	20%	0.202	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6	179.5	77.3	0	0	0	0	113.8	Y111 W112 D192	Y111-T194 HydrophobicContact CD2-CG2 4.43Å; Y111-T194 VanDerWaalsContact CE2-CB 3.44Å; Y111-T194 HydrophobicContact CE2-CG2 3.56Å; W112-T194 WeakPolarHBondContact CB-O 3.46Å; W112-T194 PolarHBondContact N-O 3.32Å; W112-T194 WeakPolarHBondContact O-CA 3.08Å; D192-T194 VanDerWaalsContact CG-OG1 3.28Å; D192-T194 PolarHBondContact O-N 3.26Å; D192-T194 VanDerWaalsContact O-N 3.07Å; D192-T194 WeakPolarHBondContact OD1-CA 3.27Å; D192-T194 VanDerWaalsContact OD1-CB 3.26Å; D192-T194 WeakPolarHBondContact OD1-CB 3.29Å; D192-T194 WeakPolarHBondContact OD1-CG2 3.31Å; D192-T194 PolarHBondContact OD1-N 2.96Å; D192-T194 PolarHBondContact OD1-OG1 3.22Å; D192-T194 PolarHBondContact OD2-OG1 3.17Å
195	I	83.6	Confident	80.4	Confident	62 Å²	62	62.7 Å²	62.7	32%	0.318	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-107.5	117.1	175.5	-56.1	176.1	0	0	0	109.5	D192 F199	D192-I195 HydrophobicContact CB-CD1 4.33Å; D192-I195 HydrophobicContact CB-CG1 4.46Å; D192-I195 PolarHBondContact O-N 2.93Å; I195-F199 HydrophobicContact CB-CZ 4.42Å; I195-F199 HydrophobicContact CG2-CZ 3.86Å
196	C	87	Confident	81.3	Confident	16 Å²	16	62.3 Å²	62.3	11%	0.108	31%	0.312	C	S	.	.			trans	-105.4	99.4	173.9	-179.5	0	0	0	0	111.8	W112 C119	W112-C196 HydrophobicContact CB-CB 3.84Å; W112-C196 HydrophobicContact CD2-CB 3.59Å; W112-C196 HydrophobicContact CE3-CB 3.88Å; W112-C196 HydrophobicContact CG-CB 3.61Å; C119-C196 VanDerWaalsContact CA-SG 3.56Å; C119-C196 HydrophobicContact CB-CB 3.81Å; C119-C196 WeakPolarHBondContact CB-SG 3.46Å; C119-C196 WeakPolarHBondContact SG-CA 3.17Å; C119-C196 WeakPolarHBondContact SG-CB 3.42Å; C119-C196 CovalentContact SG-SG 2.04Å; C119-C196 PolarHBondContact SG-SG 2.87Å
197	Q	81.7	Confident	82.3	Confident	76 Å²	76	62.2 Å²	62.2	36%	0.355	31%	0.313	S	S	.	.	S	Bend	trans	-152.4	161.2	176.4	-165.5	171.8	-6.3	0	0	110	N186 F199	N186-Q197 PolarHBondContact ND2-O 2.88Å; N186-Q197 PolarHBondContact OD1-O 3.08Å; Q197-F199 WeakPolarHBondContact O-CD2 3.47Å; Q197-F199 WeakPolarHBondContact O-CE2 3.3Å
198	S	82.4	Confident	83.5	Confident	14 Å²	14	56 Å²	56	10%	0.098	28%	0.281	C	S	.	.			trans	-81	126.2	163	-168.2	0	0	0	0	110.4	N186 I204	N186-S198 VanDerWaalsContact OD1-CA 3.23Å; N186-S198 WeakPolarHBondContact OD1-CA 3.34Å; S198-I204 WeakPolarHBondContact O-CD1 3.48Å
199	F	81.7	Confident	84.7	Confident	37 Å²	37	59 Å²	59	16%	0.162	30%	0.297	C	S	.	.			trans	-97.4	-13.7	-179.2	-67	-87.3	0	0	0	113.6	N186 N188 R189 Y190 I195 Q197 A201	N186-F199 PolarHBondContact OD1-N 3.35Å; N188-F199 HydrophobicContact CB-CD2 4.21Å; N188-F199 HydrophobicContact CB-CE2 3.94Å; R189-F199 HydrophobicContact CB-CD1 4.42Å; Y190-F199 HydrophobicContact CD2-CE1 4.1Å; Y190-F199 HydrophobicContact CE2-CE1 4.37Å; I195-F199 HydrophobicContact CB-CZ 4.42Å; I195-F199 HydrophobicContact CG2-CZ 3.86Å; Q197-F199 WeakPolarHBondContact O-CD2 3.47Å; Q197-F199 WeakPolarHBondContact O-CE2 3.3Å; F199-A201 PolarHBondContact O-N 3.2Å
200	N	86.4	Confident	85.9	Confident	45 Å²	45	51 Å²	51	24%	0.241	27%	0.273	C	S	.	.			trans	-85.1	101	-172.9	-173.3	-40.3	0	0	0	111.7	L185 L202 Y203 I204	L185-N200 WeakPolarHBondContact O-CB 3.39Å; L185-N200 PolarHBondContact O-ND2 3.44Å; N200-L202 VanDerWaalsContact C-N 3.3Å; N200-L202 PolarHBondContact O-N 2.94Å; N200-L202 PolarHBondContact OD1-N 3.39Å; N200-Y203 WeakPolarHBondContact O-CB 3.22Å; N200-Y203 PolarHBondContact O-N 3.41Å; N200-Y203 PolarHBondContact OD1-N 3.2Å; N200-I204 WeakPolarHBondContact O-CG1 3.48Å; N200-I204 PolarHBondContact O-N 2.88Å
201	A	87.6	Confident	87.1	Confident	10 Å²	10	43.2 Å²	43.2	8%	0.083	24%	0.243	C	C	.	.	H	α-helix	trans	-52.6	-42.2	-178	0	0	0	0	0	114.3	F199 I204 I205 G844 I847	F199-A201 PolarHBondContact O-N 3.2Å; A201-I204 PolarHBondContact O-N 3.47Å; A201-I205 VanDerWaalsContact O-CG1 3.3Å; A201-I205 WeakPolarHBondContact O-CG1 3.42Å; A201-I205 PolarHBondContact O-N 2.87Å; A201-G844 WeakPolarHBondContact CB-O 3.24Å; A201-I847 HydrophobicContact CB-CB 3.93Å; A201-I847 HydrophobicContact CB-CG2 3.84Å
202	L	88.8	Confident	88.4	Confident	121 Å²	121	36.8 Å²	36.8	63%	0.634	21%	0.209	S	C	*	.	H	α-helix	trans	-67.3	-42	179.4	-178.5	62.7	0	0	0	110.7	N200 I205 C206	N200-L202 VanDerWaalsContact C-N 3.3Å; N200-L202 PolarHBondContact O-N 2.94Å; N200-L202 PolarHBondContact OD1-N 3.39Å; L202-I205 PolarHBondContact O-N 3.48Å; L202-C206 VanDerWaalsContact O-CB 3.28Å; L202-C206 WeakPolarHBondContact O-CB 3.28Å; L202-C206 PolarHBondContact O-N 3.29Å; L202-C206 PolarHBondContact O-SG 2.97Å; L202-C206 VanDerWaalsContact O-SG 3.36Å
203	Y	91.4	Very high	89.3	Confident	19 Å²	19	37.7 Å²	37.7	8%	0.075	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-48.3	173.7	-179.6	-96.6	0	0	0	111.8	I177 P180 L181 N200 I205 C206 S207	I177-Y203 WeakPolarHBondContact O-CE2 3.18Å; I177-Y203 PolarHBondContact O-OH 2.95Å; P180-Y203 HydrophobicContact CB-CD2 4.06Å; P180-Y203 HydrophobicContact CB-CE2 3.94Å; P180-Y203 HydrophobicContact CG-CE2 4.19Å; L181-Y203 HydrophobicContact CD1-CE1 3.81Å; L181-Y203 HydrophobicContact CD2-CD1 3.86Å; L181-Y203 HydrophobicContact CD2-CE1 3.59Å; L181-Y203 HydrophobicContact CG-CD1 4.28Å; L181-Y203 HydrophobicContact CG-CE1 3.61Å; L181-Y203 HydrophobicContact CG-CE2 4.33Å; N200-Y203 WeakPolarHBondContact O-CB 3.22Å; N200-Y203 PolarHBondContact O-N 3.41Å; N200-Y203 PolarHBondContact OD1-N 3.2Å; Y203-I205 VanDerWaalsContact C-N 3.3Å; Y203-I205 PolarHBondContact O-N 3.32Å; Y203-C206 PolarHBondContact O-N 2.95Å; Y203-S207 WeakPolarHBondContact O-CB 3.33Å; Y203-S207 PolarHBondContact O-N 3.35Å; Y203-S207 PolarHBondContact O-OG 2.89Å
204	I	91.5	Very high	90	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.072	21%	0.214	C	C	.	.	H	α-helix	trans	-57.6	-43.1	179.5	-62.6	162.3	0	0	0	111	S198 N200 A201 S207 S208 N840 I847	S198-I204 WeakPolarHBondContact O-CD1 3.48Å; N200-I204 WeakPolarHBondContact O-CG1 3.48Å; N200-I204 PolarHBondContact O-N 2.88Å; A201-I204 PolarHBondContact O-N 3.47Å; I204-S207 PolarHBondContact O-OG 3.24Å; I204-S208 WeakPolarHBondContact O-CB 3.44Å; I204-S208 PolarHBondContact O-N 3.27Å; I204-S208 VanDerWaalsContact O-N 3.11Å; I204-S208 PolarHBondContact O-OG 2.91Å; I204-N840 HydrophobicContact CG2-CB 4.13Å; I204-N840 WeakPolarHBondContact CG2-O 3.47Å; I204-I847 HydrophobicContact CD1-CD1 3.94Å
205	I	92.9	Very high	90.5	Very high	32 Å²	32	37.9 Å²	37.9	16%	0.164	21%	0.206	C	C	.	.	H	α-helix	trans	-69.2	-52.1	179.3	-67.8	167.1	0	0	0	110.9	A201 L202 Y203 S208 L209 I841 L845	A201-I205 VanDerWaalsContact O-CG1 3.3Å; A201-I205 WeakPolarHBondContact O-CG1 3.42Å; A201-I205 PolarHBondContact O-N 2.87Å; L202-I205 PolarHBondContact O-N 3.48Å; Y203-I205 VanDerWaalsContact C-N 3.3Å; Y203-I205 PolarHBondContact O-N 3.32Å; I205-S208 PolarHBondContact O-N 2.95Å; I205-L209 HydrophobicContact CG2-CD1 3.89Å; I205-L209 HydrophobicContact CG2-CG 4.48Å; I205-L209 WeakPolarHBondContact O-CB 3.5Å; I205-L209 VanDerWaalsContact O-CG 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.45Å; I205-L209 PolarHBondContact O-N 3.44Å; I205-I841 HydrophobicContact CB-CD1 4.47Å; I205-I841 HydrophobicContact CG2-CD1 4.2Å; I205-L845 HydrophobicContact CD1-CD2 4.22Å; I205-L845 HydrophobicContact CD1-CG 4.43Å
206	C	93.3	Very high	91	Very high	71 Å²	71	35.3 Å²	35.3	48%	0.48	19%	0.194	S	C	.	.	H	α-helix	trans	-65.1	-42.4	-177.2	-72.1	0	0	0	0	112.8	L202 Y203 L209 G210	L202-C206 VanDerWaalsContact O-CB 3.28Å; L202-C206 WeakPolarHBondContact O-CB 3.28Å; L202-C206 PolarHBondContact O-N 3.29Å; L202-C206 PolarHBondContact O-SG 2.97Å; L202-C206 VanDerWaalsContact O-SG 3.36Å; Y203-C206 PolarHBondContact O-N 2.95Å; C206-L209 PolarHBondContact O-N 3.33Å; C206-G210 PolarHBondContact O-N 3.12Å
207	S	94.2	Very high	91.3	Very high	14 Å²	14	39.3 Å²	39.3	10%	0.098	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-43.6	174.9	60.6	0	0	0	0	111.4	Y203 I204 L209 G210 S211	Y203-S207 WeakPolarHBondContact O-CB 3.33Å; Y203-S207 PolarHBondContact O-N 3.35Å; Y203-S207 PolarHBondContact O-OG 2.89Å; I204-S207 PolarHBondContact O-OG 3.24Å; S207-L209 PolarHBondContact O-N 3.36Å; S207-G210 PolarHBondContact O-N 3Å; S207-S211 WeakPolarHBondContact O-CB 3.16Å; S207-S211 PolarHBondContact O-N 3.43Å; S207-S211 PolarHBondContact O-OG 3.16Å
208	S	94.9	Very high	91.9	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-42.3	175.2	-64.8	0	0	0	0	112.5	I204 I205 F212 Y213 N840	I204-S208 WeakPolarHBondContact O-CB 3.44Å; I204-S208 PolarHBondContact O-N 3.27Å; I204-S208 VanDerWaalsContact O-N 3.11Å; I204-S208 PolarHBondContact O-OG 2.91Å; I205-S208 PolarHBondContact O-N 2.95Å; S208-F212 PolarHBondContact O-N 3.37Å; S208-F212 VanDerWaalsContact O-N 3.13Å; S208-Y213 WeakPolarHBondContact O-CD2 3.31Å; S208-Y213 PolarHBondContact O-N 3.38Å; S208-N840 WeakPolarHBondContact OG-CB 3.21Å
209	L	95	Very high	92.4	Very high	76 Å²	76	38.7 Å²	38.7	40%	0.398	21%	0.21	S	C	.	.	I	π-helix	trans	-65.5	-45.8	177.8	-71.9	172.7	0	0	0	112.3	I205 C206 S207 Y213 L214 I841	I205-L209 HydrophobicContact CG2-CD1 3.89Å; I205-L209 HydrophobicContact CG2-CG 4.48Å; I205-L209 WeakPolarHBondContact O-CB 3.5Å; I205-L209 VanDerWaalsContact O-CG 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.45Å; I205-L209 PolarHBondContact O-N 3.44Å; C206-L209 PolarHBondContact O-N 3.33Å; S207-L209 PolarHBondContact O-N 3.36Å; L209-Y213 HydrophobicContact CD2-CD2 4.13Å; L209-Y213 HydrophobicContact CD2-CG 4.27Å; L209-Y213 PolarHBondContact O-N 3.36Å; L209-L214 WeakPolarHBondContact O-CB 3.44Å; L209-L214 WeakPolarHBondContact O-CG 3.44Å; L209-L214 PolarHBondContact O-N 2.75Å; L209-I841 HydrophobicContact CD2-CD1 4.45Å; L209-I841 HydrophobicContact CG-CD1 4.26Å
210	G	93.4	Very high	92.9	Very high	21 Å²	21	40.2 Å²	40.2	22%	0.216	22%	0.219	C	C	.	.	I	π-helix	trans	-71.9	-42.6	-179.1	0	0	0	0	0	114.1	C206 S207 P215	C206-G210 PolarHBondContact O-N 3.12Å; S207-G210 PolarHBondContact O-N 3Å; G210-P215 VanDerWaalsContact O-CD 3.24Å; G210-P215 WeakPolarHBondContact O-CD 3.4Å; G210-P215 WeakPolarHBondContact O-CG 3.44Å
211	S	94	Very high	93.2	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.021	23%	0.225	C	C	.	.	I	π-helix	trans	-75.5	-36.8	-178	61.4	0	0	0	0	113.4	T131 I134 S207 P215 F837	T131-S211 WeakPolarHBondContact OG1-CB 3.38Å; I134-S211 VanDerWaalsContact CD1-O 3.26Å; I134-S211 WeakPolarHBondContact CD1-O 3.25Å; I134-S211 WeakPolarHBondContact CG2-O 3.38Å; S207-S211 WeakPolarHBondContact O-CB 3.16Å; S207-S211 PolarHBondContact O-N 3.43Å; S207-S211 PolarHBondContact O-OG 3.16Å; S211-P215 WeakPolarHBondContact O-CG 3.34Å; S211-F837 VanDerWaalsContact OG-CE1 3.26Å; S211-F837 WeakPolarHBondContact OG-CE1 3.45Å
212	F	95.2	Very high	93.5	Very high	2 Å²	2	41 Å²	41	1%	0.009	23%	0.225	C	C	.	.	I	π-helix	trans	-122.2	-57.9	-172.4	179.3	-102.3	0	0	0	115	S208 L214 P215 A216 F829 L830 W833 L834 F837	S208-F212 PolarHBondContact O-N 3.37Å; S208-F212 VanDerWaalsContact O-N 3.13Å; F212-L214 PolarHBondContact O-N 2.91Å; F212-P215 WeakPolarHBondContact O-CD 3.45Å; F212-A216 HydrophobicContact CE1-CB 4.4Å; F212-A216 HydrophobicContact CE2-CB 4.43Å; F212-A216 HydrophobicContact CZ-CB 4.24Å; F212-A216 VanDerWaalsContact O-CB 3.23Å; F212-A216 WeakPolarHBondContact O-CB 3.41Å; F212-A216 PolarHBondContact O-N 2.78Å; F212-F829 HydrophobicContact CD2-CE1 4.37Å; F212-F829 AromaticContact CD2-CZ 3.98Å; F212-F829 HydrophobicContact CD2-CZ 3.98Å; F212-F829 AromaticContact CE2-CE1 3.94Å; F212-F829 HydrophobicContact CE2-CE1 3.94Å; F212-F829 AromaticContact CE2-CZ 3.92Å; F212-F829 HydrophobicContact CE2-CZ 3.92Å; F212-L830 HydrophobicContact CE2-CD2 4.24Å; F212-L830 HydrophobicContact CZ-CD2 4.06Å; F212-W833 HydrophobicContact CD2-CB 3.86Å; F212-W833 HydrophobicContact CE2-CB 3.53Å; F212-W833 HydrophobicContact CZ-CB 4.36Å; F212-L834 HydrophobicContact CE1-CB 4.32Å; F212-L834 HydrophobicContact CE1-CD1 3.77Å; F212-L834 HydrophobicContact CZ-CB 3.94Å; F212-L834 HydrophobicContact CZ-CD1 4.16Å; F212-F837 HydrophobicContact CB-CB 4.11Å; F212-F837 HydrophobicContact CB-CD1 3.79Å; F212-F837 HydrophobicContact CB-CD2 3.34Å; F212-F837 HydrophobicContact CB-CE1 3.99Å; F212-F837 HydrophobicContact CB-CE2 3.55Å; F212-F837 HydrophobicContact CB-CG 3.46Å; F212-F837 VanDerWaalsContact CB-CG 3.46Å; F212-F837 HydrophobicContact CB-CZ 3.87Å; F212-F837 HydrophobicContact CD1-CB 3.56Å; F212-F837 AromaticContact CD1-CD2 3.84Å; F212-F837 HydrophobicContact CD1-CD2 3.84Å; F212-F837 AromaticContact CD1-CG 3.85Å; F212-F837 HydrophobicContact CD1-CG 3.85Å; F212-F837 AromaticContact CD2-CD2 3.55Å; F212-F837 HydrophobicContact CD2-CD2 3.55Å; F212-F837 AromaticContact CD2-CE2 3.89Å; F212-F837 HydrophobicContact CD2-CE2 3.89Å; F212-F837 HydrophobicContact CD2-CG 4.35Å; F212-F837 HydrophobicContact CE1-CB 4.2Å; F212-F837 HydrophobicContact CE2-CD2 4.32Å; F212-F837 HydrophobicContact CG-CB 3.91Å; F212-F837 HydrophobicContact CG-CD1 4.44Å; F212-F837 AromaticContact CG-CD2 3.27Å; F212-F837 HydrophobicContact CG-CD2 3.27Å; F212-F837 AromaticContact CG-CE2 3.84Å; F212-F837 HydrophobicContact CG-CE2 3.84Å; F212-F837 AromaticContact CG-CG 3.62Å; F212-F837 HydrophobicContact CG-CG 3.62Å
213	Y	95.4	Very high	93.4	Very high	54 Å²	54	36.4 Å²	36.4	21%	0.212	20%	0.199	C	C	.	.	I	π-helix	trans	-66.8	-43.7	-167.5	-70.9	-85.9	0	0	0	113	S208 L209 A216 I217 L834 F837 S838 I841	S208-Y213 WeakPolarHBondContact O-CD2 3.31Å; S208-Y213 PolarHBondContact O-N 3.38Å; L209-Y213 HydrophobicContact CD2-CD2 4.13Å; L209-Y213 HydrophobicContact CD2-CG 4.27Å; L209-Y213 PolarHBondContact O-N 3.36Å; Y213-A216 PolarHBondContact O-N 3.1Å; Y213-I217 WeakPolarHBondContact O-CD1 3.29Å; Y213-I217 VanDerWaalsContact O-CG1 3.28Å; Y213-I217 WeakPolarHBondContact O-CG1 3.47Å; Y213-I217 PolarHBondContact O-N 3.02Å; Y213-L834 HydrophobicContact CE1-CD1 4.39Å; Y213-F837 HydrophobicContact CE2-CB 3.88Å; Y213-F837 WeakPolarHBondContact CE2-O 3.44Å; Y213-F837 PolarHBondContact OH-O 3.15Å; Y213-S838 WeakPolarHBondContact OH-CA 3.23Å; Y213-S838 PolarHBondContact OH-N 3.42Å; Y213-I841 HydrophobicContact CD2-CG1 4.37Å; Y213-I841 HydrophobicContact CE2-CD1 4.18Å; Y213-I841 HydrophobicContact CE2-CG1 3.49Å; Y213-I841 VanDerWaalsContact CE2-CG1 3.49Å
214	L	95	Very high	93.4	Very high	102 Å²	102	41.4 Å²	41.4	53%	0.534	22%	0.223	S	C	.	.	H	α-helix	trans	-63.9	-49.7	175.5	-69.4	173.4	0	0	0	111.5	L209 F212 A216 I217 I218	L209-L214 WeakPolarHBondContact O-CB 3.44Å; L209-L214 WeakPolarHBondContact O-CG 3.44Å; L209-L214 PolarHBondContact O-N 2.75Å; F212-L214 PolarHBondContact O-N 2.91Å; L214-A216 PolarHBondContact O-N 2.7Å; L214-I217 PolarHBondContact O-N 2.94Å; L214-I218 VanDerWaalsContact O-CG1 3.31Å; L214-I218 WeakPolarHBondContact O-CG1 3.24Å; L214-I218 PolarHBondContact O-N 3.25Å
215	P	93.9	Very high	93.5	Very high	4 Å²	4	47 Å²	47	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-51.8	-46.2	168.5	-35.9	42.4	0	0	0	115	I134 L135 V138 G210 S211 F212 I217 I218 L219	I134-P215 HydrophobicContact CG2-CB 3.56Å; I134-P215 HydrophobicContact CG2-CG 4.1Å; L135-P215 HydrophobicContact CD2-CB 4.38Å; L135-P215 HydrophobicContact CD2-CG 3.64Å; V138-P215 HydrophobicContact CG2-CB 3.72Å; G210-P215 VanDerWaalsContact O-CD 3.24Å; G210-P215 WeakPolarHBondContact O-CD 3.4Å; G210-P215 WeakPolarHBondContact O-CG 3.44Å; S211-P215 WeakPolarHBondContact O-CG 3.34Å; F212-P215 WeakPolarHBondContact O-CD 3.45Å; P215-I217 PolarHBondContact O-N 3.33Å; P215-I218 PolarHBondContact O-N 2.91Å; P215-L219 WeakPolarHBondContact O-CB 3.47Å; P215-L219 VanDerWaalsContact O-CG 3.25Å; P215-L219 WeakPolarHBondContact O-CG 3.35Å; P215-L219 PolarHBondContact O-N 2.77Å
216	A	94.2	Very high	93.3	Very high	9 Å²	9	45.7 Å²	45.7	7%	0.074	24%	0.237	C	C	.	.	H	α-helix	trans	-62.6	-42.5	-179.7	0	0	0	0	0	112.1	F212 Y213 L214 L219 I220 L830	F212-A216 HydrophobicContact CE1-CB 4.4Å; F212-A216 HydrophobicContact CE2-CB 4.43Å; F212-A216 HydrophobicContact CZ-CB 4.24Å; F212-A216 VanDerWaalsContact O-CB 3.23Å; F212-A216 WeakPolarHBondContact O-CB 3.41Å; F212-A216 PolarHBondContact O-N 2.78Å; Y213-A216 PolarHBondContact O-N 3.1Å; L214-A216 PolarHBondContact O-N 2.7Å; A216-L219 PolarHBondContact O-N 3.05Å; A216-I220 WeakPolarHBondContact O-CB 3.25Å; A216-I220 WeakPolarHBondContact O-CD1 3.3Å; A216-I220 VanDerWaalsContact O-CG1 3.24Å; A216-I220 WeakPolarHBondContact O-CG1 3.49Å; A216-I220 PolarHBondContact O-N 3.43Å; A216-L830 HydrophobicContact CB-CD2 3.81Å
217	I	94.6	Very high	93.1	Very high	99 Å²	99	48.8 Å²	48.8	51%	0.508	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-46.1	174.7	-68.8	164.1	0	0	0	110.5	Y213 L214 P215 L219 I220 V221	Y213-I217 WeakPolarHBondContact O-CD1 3.29Å; Y213-I217 VanDerWaalsContact O-CG1 3.28Å; Y213-I217 WeakPolarHBondContact O-CG1 3.47Å; Y213-I217 PolarHBondContact O-N 3.02Å; L214-I217 PolarHBondContact O-N 2.94Å; P215-I217 PolarHBondContact O-N 3.33Å; I217-L219 PolarHBondContact O-N 2.94Å; I217-I220 PolarHBondContact O-N 3.25Å; I217-V221 HydrophobicContact CG2-CG2 4.42Å; I217-V221 WeakPolarHBondContact O-CB 3.29Å; I217-V221 WeakPolarHBondContact O-CG2 3.5Å; I217-V221 PolarHBondContact O-N 3.48Å
218	I	93.7	Very high	92.9	Very high	76 Å²	76	50.1 Å²	50.1	39%	0.39	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-47.4	177.1	-67.1	164.1	0	0	0	110.6	V138 L214 P215 I220 V221 V222	V138-I218 HydrophobicContact CG1-CG2 3.89Å; L214-I218 VanDerWaalsContact O-CG1 3.31Å; L214-I218 WeakPolarHBondContact O-CG1 3.24Å; L214-I218 PolarHBondContact O-N 3.25Å; P215-I218 PolarHBondContact O-N 2.91Å; I218-I220 PolarHBondContact O-N 2.94Å; I218-V221 PolarHBondContact O-N 3.4Å; I218-V222 HydrophobicContact CG2-CG2 4.21Å; I218-V222 WeakPolarHBondContact O-CB 3.48Å; I218-V222 WeakPolarHBondContact O-CG2 3.46Å; I218-V222 PolarHBondContact O-N 2.95Å
219	L	92.2	Very high	92.6	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-50.2	177.4	-73.1	172.1	0	0	0	111.6	V138 C141 P215 A216 I217 V222 Y223 L826 F829	V138-L219 HydrophobicContact CB-CD2 4.46Å; V138-L219 HydrophobicContact CG2-CD1 4.28Å; V138-L219 HydrophobicContact CG2-CD2 4.17Å; V138-L219 HydrophobicContact CG2-CG 4.03Å; C141-L219 HydrophobicContact CB-CD2 3.43Å; C141-L219 VanDerWaalsContact CB-CD2 3.43Å; P215-L219 WeakPolarHBondContact O-CB 3.47Å; P215-L219 VanDerWaalsContact O-CG 3.25Å; P215-L219 WeakPolarHBondContact O-CG 3.35Å; P215-L219 PolarHBondContact O-N 2.77Å; A216-L219 PolarHBondContact O-N 3.05Å; I217-L219 PolarHBondContact O-N 2.94Å; L219-V222 PolarHBondContact O-N 3.1Å; L219-Y223 HydrophobicContact CD2-CE2 4.46Å; L219-Y223 WeakPolarHBondContact O-CB 3.25Å; L219-Y223 VanDerWaalsContact O-CD2 3.3Å; L219-Y223 WeakPolarHBondContact O-CD2 3.2Å; L219-Y223 PolarHBondContact O-N 2.95Å; L219-L826 HydrophobicContact CB-CD1 4.07Å; L219-L826 HydrophobicContact CB-CD2 4.38Å; L219-L826 HydrophobicContact CD1-CD2 4.07Å; L219-L826 HydrophobicContact CD2-CD2 4Å; L219-L826 HydrophobicContact CG-CD2 4.37Å; L219-F829 HydrophobicContact CD1-CD1 4.18Å; L219-F829 HydrophobicContact CD1-CE1 3.92Å
220	I	92.3	Very high	92.1	Very high	69 Å²	69	49.6 Å²	49.6	35%	0.354	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-50.7	-179.6	-69.8	164.8	0	0	0	110.9	A216 I217 I218 V222 Y223 Q224 L830	A216-I220 WeakPolarHBondContact O-CB 3.25Å; A216-I220 WeakPolarHBondContact O-CD1 3.3Å; A216-I220 VanDerWaalsContact O-CG1 3.24Å; A216-I220 WeakPolarHBondContact O-CG1 3.49Å; A216-I220 PolarHBondContact O-N 3.43Å; I217-I220 PolarHBondContact O-N 3.25Å; I218-I220 PolarHBondContact O-N 2.94Å; I220-V222 PolarHBondContact O-N 3.46Å; I220-Y223 PolarHBondContact O-N 2.94Å; I220-Q224 WeakPolarHBondContact O-CB 3.09Å; I220-Q224 VanDerWaalsContact O-CG 3.26Å; I220-Q224 WeakPolarHBondContact O-CG 3.37Å; I220-Q224 PolarHBondContact O-N 3.45Å; I220-L830 HydrophobicContact CD1-CD1 4.19Å; I220-L830 HydrophobicContact CG1-CD1 4.19Å
221	V	93.9	Very high	91.8	Very high	58 Å²	58	55.5 Å²	55.5	35%	0.352	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-42.9	-178.4	172	0	0	0	0	111.6	I217 I218 Q224 R225	I217-V221 HydrophobicContact CG2-CG2 4.42Å; I217-V221 WeakPolarHBondContact O-CB 3.29Å; I217-V221 WeakPolarHBondContact O-CG2 3.5Å; I217-V221 PolarHBondContact O-N 3.48Å; I218-V221 PolarHBondContact O-N 3.4Å; V221-Q224 PolarHBondContact O-N 2.89Å; V221-R225 WeakPolarHBondContact O-CG 3.34Å; V221-R225 PolarHBondContact O-N 3.26Å; V221-R225 VanDerWaalsContact O-N 3.14Å
222	V	92.5	Very high	91.4	Very high	14 Å²	14	61.3 Å²	61.3	9%	0.085	30%	0.298	C	S	.	.	H	α-helix	trans	-68.7	-41.4	-179.6	175.7	0	0	0	0	111.1	C141 L142 Y145 I218 L219 I220 R225 I226	C141-V222 WeakPolarHBondContact SG-CG1 3.33Å; L142-V222 HydrophobicContact CD2-CG1 4.46Å; L142-V222 HydrophobicContact CD2-CG2 4Å; Y145-V222 HydrophobicContact CD1-CG1 4.47Å; Y145-V222 HydrophobicContact CD2-CG1 3.91Å; Y145-V222 HydrophobicContact CG-CG1 3.74Å; I218-V222 HydrophobicContact CG2-CG2 4.21Å; I218-V222 WeakPolarHBondContact O-CB 3.48Å; I218-V222 WeakPolarHBondContact O-CG2 3.46Å; I218-V222 PolarHBondContact O-N 2.95Å; L219-V222 PolarHBondContact O-N 3.1Å; I220-V222 PolarHBondContact O-N 3.46Å; V222-R225 WeakPolarHBondContact O-CB 3.39Å; V222-R225 PolarHBondContact O-N 3.06Å; V222-I226 HydrophobicContact CG1-CD1 4.2Å; V222-I226 WeakPolarHBondContact O-CG1 3.45Å; V222-I226 PolarHBondContact O-N 3.42Å
223	Y	88.7	Confident	90.8	Very high	25 Å²	25	65.6 Å²	65.6	10%	0.098	31%	0.314	C	S	.	.	H	α-helix	trans	-67.9	-36.7	176.2	-89.5	-107.6	0	0	0	113.4	C141 L219 I220 R225 I226 F227 L822 L826	C141-Y223 HydrophobicContact CB-CD2 4.39Å; C141-Y223 HydrophobicContact CB-CE2 3.73Å; C141-Y223 WeakPolarHBondContact SG-CD2 3.44Å; C141-Y223 WeakPolarHBondContact SG-CE2 3.32Å; L219-Y223 HydrophobicContact CD2-CE2 4.46Å; L219-Y223 WeakPolarHBondContact O-CB 3.25Å; L219-Y223 VanDerWaalsContact O-CD2 3.3Å; L219-Y223 WeakPolarHBondContact O-CD2 3.2Å; L219-Y223 PolarHBondContact O-N 2.95Å; I220-Y223 PolarHBondContact O-N 2.94Å; Y223-R225 VanDerWaalsContact C-N 3.27Å; Y223-R225 PolarHBondContact O-N 3.22Å; Y223-I226 PolarHBondContact O-N 3.1Å; Y223-F227 WeakPolarHBondContact O-CB 3.4Å; Y223-F227 PolarHBondContact O-N 3.15Å; Y223-L822 HydrophobicContact CE1-CB 3.73Å; Y223-L822 WeakPolarHBondContact OH-CB 3.35Å; Y223-L822 PolarHBondContact OH-O 2.77Å; Y223-L826 HydrophobicContact CD1-CD1 3.98Å; Y223-L826 HydrophobicContact CD1-CG 4.42Å; Y223-L826 HydrophobicContact CD2-CD1 3.32Å; Y223-L826 HydrophobicContact CD2-CG 4.12Å; Y223-L826 HydrophobicContact CE1-CD1 4.07Å; Y223-L826 HydrophobicContact CE1-CG 4.03Å; Y223-L826 HydrophobicContact CE2-CD1 3.39Å; Y223-L826 HydrophobicContact CE2-CD2 3.93Å; Y223-L826 HydrophobicContact CE2-CG 3.68Å; Y223-L826 HydrophobicContact CG-CD1 3.57Å; Y223-L826 HydrophobicContact CG-CG 4.42Å
224	Q	90.4	Very high	90	Very high	124 Å²	124	65.3 Å²	65.3	58%	0.579	31%	0.314	S	S	*	.	H	α-helix	trans	-57.1	-43.5	171.3	-75.2	174.8	8.2	0	0	110.8	I220 V221 F227 A228	I220-Q224 WeakPolarHBondContact O-CB 3.09Å; I220-Q224 VanDerWaalsContact O-CG 3.26Å; I220-Q224 WeakPolarHBondContact O-CG 3.37Å; I220-Q224 PolarHBondContact O-N 3.45Å; V221-Q224 PolarHBondContact O-N 2.89Å; Q224-F227 PolarHBondContact O-N 3.28Å; Q224-A228 VanDerWaalsContact O-CB 3.31Å; Q224-A228 WeakPolarHBondContact O-CB 3.45Å; Q224-A228 PolarHBondContact O-N 3.26Å
225	R	92.6	Very high	89.4	Confident	130 Å²	130	67.6 Å²	67.6	49%	0.491	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-44.4	174.7	-67.7	174.6	178.1	-163.9	-0.7	112.5	Y145 V221 V222 Y223 F227 A228 L229	Y145-R225 HydrophobicContact CE2-CB 3.83Å; V221-R225 WeakPolarHBondContact O-CG 3.34Å; V221-R225 PolarHBondContact O-N 3.26Å; V221-R225 VanDerWaalsContact O-N 3.14Å; V222-R225 WeakPolarHBondContact O-CB 3.39Å; V222-R225 PolarHBondContact O-N 3.06Å; Y223-R225 VanDerWaalsContact C-N 3.27Å; Y223-R225 PolarHBondContact O-N 3.22Å; R225-F227 PolarHBondContact O-N 3.42Å; R225-A228 PolarHBondContact O-N 2.91Å; R225-L229 WeakPolarHBondContact O-CB 3.39Å; R225-L229 WeakPolarHBondContact O-CD1 3.43Å; R225-L229 VanDerWaalsContact O-CG 3.25Å; R225-L229 WeakPolarHBondContact O-CG 3.36Å; R225-L229 PolarHBondContact O-N 3.5Å
226	I	90.2	Very high	88.7	Confident	5 Å²	5	70.3 Å²	70.3	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-55.9	-50.1	174.5	-68.3	171.4	0	0	0	110.5	Y145 V148 V222 Y223 L229 I230 T819	Y145-I226 HydrophobicContact CD2-CG1 3.87Å; V148-I226 HydrophobicContact CG2-CG2 4.41Å; V222-I226 HydrophobicContact CG1-CD1 4.2Å; V222-I226 WeakPolarHBondContact O-CG1 3.45Å; V222-I226 PolarHBondContact O-N 3.42Å; Y223-I226 PolarHBondContact O-N 3.1Å; I226-L229 PolarHBondContact O-N 3.05Å; I226-I230 HydrophobicContact CG2-CD1 3.72Å; I226-I230 WeakPolarHBondContact O-CG1 3.32Å; I226-I230 PolarHBondContact O-N 2.69Å; I226-T819 HydrophobicContact CG2-CG2 4.1Å
227	F	88.2	Confident	87.8	Confident	136 Å²	136	73.5 Å²	73.5	60%	0.596	36%	0.355	S	S	*	.	H	α-helix	trans	-65.8	-41.4	-178	-173.2	-100.3	0	0	0	112.2	Y223 Q224 R225 I230 K231	Y223-F227 WeakPolarHBondContact O-CB 3.4Å; Y223-F227 PolarHBondContact O-N 3.15Å; Q224-F227 PolarHBondContact O-N 3.28Å; R225-F227 PolarHBondContact O-N 3.42Å; F227-I230 PolarHBondContact O-N 2.89Å; F227-K231 WeakPolarHBondContact O-CB 3.31Å; F227-K231 PolarHBondContact O-N 3.49Å
228	A	90	Very high	87	Confident	42 Å²	42	76.9 Å²	76.9	35%	0.347	36%	0.361	S	S	.	.	H	α-helix	trans	-59.7	-46.4	174.8	0	0	0	0	0	111.9	Q224 R225 I230 K231 Q232	Q224-A228 VanDerWaalsContact O-CB 3.31Å; Q224-A228 WeakPolarHBondContact O-CB 3.45Å; Q224-A228 PolarHBondContact O-N 3.26Å; R225-A228 PolarHBondContact O-N 2.91Å; A228-I230 PolarHBondContact O-N 3.43Å; A228-K231 PolarHBondContact O-N 2.9Å; A228-Q232 WeakPolarHBondContact O-CB 3.31Å; A228-Q232 VanDerWaalsContact O-CG 3.31Å; A228-Q232 WeakPolarHBondContact O-CG 3.19Å; A228-Q232 PolarHBondContact O-N 3.31Å
229	L	89.4	Confident	86.2	Confident	44 Å²	44	78 Å²	78	23%	0.23	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-41.5	178.1	-71.3	165.8	0	0	0	112.4	Y145 V148 T149 R225 I226 Q232 R233	Y145-L229 HydrophobicContact CE2-CD1 4.28Å; V148-L229 HydrophobicContact CG1-CB 4.44Å; T149-L229 HydrophobicContact CG2-CD1 3.55Å; R225-L229 WeakPolarHBondContact O-CB 3.39Å; R225-L229 WeakPolarHBondContact O-CD1 3.43Å; R225-L229 VanDerWaalsContact O-CG 3.25Å; R225-L229 WeakPolarHBondContact O-CG 3.36Å; R225-L229 PolarHBondContact O-N 3.5Å; I226-L229 PolarHBondContact O-N 3.05Å; L229-Q232 PolarHBondContact O-N 3Å; L229-R233 WeakPolarHBondContact O-CB 3.39Å; L229-R233 WeakPolarHBondContact O-CG 3.35Å; L229-R233 PolarHBondContact O-N 3.01Å
230	I	84.9	Confident	85.1	Confident	23 Å²	23	82.5 Å²	82.5	12%	0.118	39%	0.391	C	S	.	.	H	α-helix	trans	-65.2	-42.5	175.7	-69.3	167.9	0	0	0	110.7	V148 I226 F227 A228 R233 H234 T819	V148-I230 HydrophobicContact CG1-CG1 4.37Å; I226-I230 HydrophobicContact CG2-CD1 3.72Å; I226-I230 WeakPolarHBondContact O-CG1 3.32Å; I226-I230 PolarHBondContact O-N 2.69Å; F227-I230 PolarHBondContact O-N 2.89Å; A228-I230 PolarHBondContact O-N 3.43Å; I230-R233 PolarHBondContact O-N 3.07Å; I230-H234 PolarHBondContact O-CD2 3.11Å; I230-H234 VanDerWaalsContact O-CD2 3.3Å; I230-H234 PolarHBondContact O-N 2.95Å; I230-T819 HydrophobicContact CD1-CG2 3.91Å; I230-T819 WeakPolarHBondContact CD1-OG1 3.46Å
231	K	86	Confident	83.9	Confident	145 Å²	145	83.7 Å²	83.7	63%	0.63	40%	0.395	S	S	*	.	H	α-helix	trans	-62.4	-42.7	175.4	-172.5	178	179.8	-177.9	0	112	F227 A228 H234 K235	F227-K231 WeakPolarHBondContact O-CB 3.31Å; F227-K231 PolarHBondContact O-N 3.49Å; A228-K231 PolarHBondContact O-N 2.9Å; K231-H234 PolarHBondContact O-N 3.49Å; K231-K235 PolarHBondContact O-N 2.86Å
232	Q	85.6	Confident	82.2	Confident	126 Å²	126	83.8 Å²	83.8	59%	0.589	40%	0.399	S	S	*	.	H	α-helix	trans	-62.7	-46	174.4	-75	173.3	-6.7	0	0	111.9	A228 L229 H234 K235 S236	A228-Q232 WeakPolarHBondContact O-CB 3.31Å; A228-Q232 VanDerWaalsContact O-CG 3.31Å; A228-Q232 WeakPolarHBondContact O-CG 3.19Å; A228-Q232 PolarHBondContact O-N 3.31Å; L229-Q232 PolarHBondContact O-N 3Å; Q232-H234 VanDerWaalsContact C-N 3.32Å; Q232-H234 PolarHBondContact O-N 2.83Å; Q232-K235 PolarHBondContact O-N 3.31Å; Q232-K235 VanDerWaalsContact O-N 3.17Å; Q232-S236 PolarHBondContact O-N 3.39Å
233	R	82.4	Confident	80.6	Confident	91 Å²	91	87 Å²	87	34%	0.343	42%	0.418	S	S	.	.	H	α-helix	trans	-59.2	-41.7	175.3	-76.5	179.7	179.4	166.6	7.7	111.9	V148 L229 I230 S236 L237	V148-R233 PolarHBondContact O-NH1 3.44Å; V148-R233 PolarHBondContact O-NH2 2.98Å; L229-R233 WeakPolarHBondContact O-CB 3.39Å; L229-R233 WeakPolarHBondContact O-CG 3.35Å; L229-R233 PolarHBondContact O-N 3.01Å; I230-R233 PolarHBondContact O-N 3.07Å; R233-S236 PolarHBondContact O-N 2.95Å; R233-L237 WeakPolarHBondContact O-CB 3.46Å; R233-L237 VanDerWaalsContact O-CG 3.31Å; R233-L237 WeakPolarHBondContact O-CG 3.37Å; R233-L237 PolarHBondContact O-N 2.97Å
234	H	78.5	Confident	79	Confident	49 Å²	49	90.9 Å²	90.9	23%	0.227	44%	0.436	C	S	.	.	H	α-helix	trans	-65.3	-37.5	174.5	-79.5	-51.1	0	0	0	113.9	I230 K231 Q232 R238 S812 K816	I230-H234 PolarHBondContact O-CD2 3.11Å; I230-H234 VanDerWaalsContact O-CD2 3.3Å; I230-H234 PolarHBondContact O-N 2.95Å; K231-H234 PolarHBondContact O-N 3.49Å; Q232-H234 VanDerWaalsContact C-N 3.32Å; Q232-H234 PolarHBondContact O-N 2.83Å; H234-R238 WeakPolarHBondContact O-CG 3.17Å; H234-R238 PolarHBondContact O-N 3.47Å; H234-R238 VanDerWaalsContact O-N 3.1Å; H234-S812 PolarHBondContact CE1-OG 3.26Å; H234-K816 WeakPolarHBondContact CE1-CE 3.1Å; H234-K816 WeakPolarHBondContact NE2-CE 3.29Å
235	K	82.9	Confident	77.3	Confident	150 Å²	150	91.5 Å²	91.5	65%	0.652	44%	0.439	S	S	*	.	H	α-helix	trans	-62.4	-46.3	172.5	-170.3	178	179.6	-177.5	0	110.9	K231 Q232 R238 L239	K231-K235 PolarHBondContact O-N 2.86Å; Q232-K235 PolarHBondContact O-N 3.31Å; Q232-K235 VanDerWaalsContact O-N 3.17Å; K235-R238 PolarHBondContact O-N 3.36Å; K235-L239 HydrophobicContact CG-CD1 4.26Å; K235-L239 WeakPolarHBondContact O-CG 3.47Å; K235-L239 PolarHBondContact O-N 3.48Å
236	S	78.6	Confident	75.5	Confident	61 Å²	61	91.9 Å²	91.9	43%	0.427	45%	0.446	S	S	.	.	H	α-helix	trans	-63.2	-43.5	177.8	-177.2	0	0	0	0	112.8	Q232 R233 R238 L239 N240	Q232-S236 PolarHBondContact O-N 3.39Å; R233-S236 PolarHBondContact O-N 2.95Å; S236-R238 PolarHBondContact O-N 3.5Å; S236-L239 PolarHBondContact O-N 2.93Å; S236-N240 WeakPolarHBondContact O-CB 3.38Å; S236-N240 PolarHBondContact O-N 3.46Å; S236-N240 PolarHBondContact O-ND2 3.35Å; S236-N240 PolarHBondContact OG-ND2 3.12Å
237	L	77.3	Confident	74	Confident	76 Å²	76	95 Å²	95	40%	0.398	47%	0.468	S	S	.	.	H	α-helix	trans	-63.8	-38.9	177.9	-73.7	169.3	0	0	0	112.4	R233 Q241	R233-L237 WeakPolarHBondContact O-CB 3.46Å; R233-L237 VanDerWaalsContact O-CG 3.31Å; R233-L237 WeakPolarHBondContact O-CG 3.37Å; R233-L237 PolarHBondContact O-N 2.97Å; L237-Q241 WeakPolarHBondContact O-CG 3.41Å; L237-Q241 PolarHBondContact O-N 2.85Å; L237-Q241 VanDerWaalsContact O-N 3.12Å
238	R	75.9	Confident	72.6	Confident	169 Å²	169	92.7 Å²	92.7	64%	0.638	47%	0.465	S	S	*	.	H	α-helix	trans	-64.2	-47.5	173.9	-76.1	177.6	172.2	-176	-4.4	111.9	H234 K235 S236 N240 Q241 S242	H234-R238 WeakPolarHBondContact O-CG 3.17Å; H234-R238 PolarHBondContact O-N 3.47Å; H234-R238 VanDerWaalsContact O-N 3.1Å; K235-R238 PolarHBondContact O-N 3.36Å; S236-R238 PolarHBondContact O-N 3.5Å; R238-N240 VanDerWaalsContact C-N 3.34Å; R238-N240 PolarHBondContact O-N 3.25Å; R238-Q241 WeakPolarHBondContact O-CB 3.27Å; R238-Q241 PolarHBondContact O-N 3.25Å; R238-S242 PolarHBondContact O-N 2.97Å; R238-S242 PolarHBondContact O-OG 3.37Å
239	L	78.1	Confident	71.4	Confident	101 Å²	101	95 Å²	95	53%	0.529	48%	0.475	S	S	.	.	H	α-helix	trans	-58.6	-44.5	177	-70.2	168	0	0	0	111.9	K235 S236 Q241 S242 T243	K235-L239 HydrophobicContact CG-CD1 4.26Å; K235-L239 WeakPolarHBondContact O-CG 3.47Å; K235-L239 PolarHBondContact O-N 3.48Å; S236-L239 PolarHBondContact O-N 2.93Å; L239-Q241 PolarHBondContact O-N 3.48Å; L239-S242 PolarHBondContact O-N 3.36Å; L239-T243 PolarHBondContact O-N 2.95Å; L239-T243 PolarHBondContact O-OG1 2.86Å
240	N	68.7	Low	70.4	Confident	94 Å²	94	97.9 Å²	97.9	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-65.3	-23.6	176	-78.5	-75.2	0	0	0	113.7	S236 R238 K244	S236-N240 WeakPolarHBondContact O-CB 3.38Å; S236-N240 PolarHBondContact O-N 3.46Å; S236-N240 PolarHBondContact O-ND2 3.35Å; S236-N240 PolarHBondContact OG-ND2 3.12Å; R238-N240 VanDerWaalsContact C-N 3.34Å; R238-N240 PolarHBondContact O-N 3.25Å; N240-K244 WeakPolarHBondContact O-CB 3.38Å; N240-K244 WeakPolarHBondContact O-CG 3.39Å; N240-K244 PolarHBondContact O-N 3.03Å
241	Q	66.3	Low	69.6	Low	94 Å²	94	99.7 Å²	99.7	44%	0.439	51%	0.505	S	S	.	.	H	α-helix	trans	-75.4	-45.7	170.9	-73.4	165.5	-15.8	0	0	110.7	L237 R238 L239 K244 Q245	L237-Q241 WeakPolarHBondContact O-CG 3.41Å; L237-Q241 PolarHBondContact O-N 2.85Å; L237-Q241 VanDerWaalsContact O-N 3.12Å; R238-Q241 WeakPolarHBondContact O-CB 3.27Å; R238-Q241 PolarHBondContact O-N 3.25Å; L239-Q241 PolarHBondContact O-N 3.48Å; Q241-K244 PolarHBondContact O-N 2.87Å; Q241-Q245 PolarHBondContact O-N 3.04Å
242	S	59.5	Low	68.6	Low	61 Å²	61	95.8 Å²	95.8	43%	0.427	50%	0.496	S	S	.	.	H	α-helix	trans	-58.9	-48.7	176.2	-52.6	0	0	0	0	112.5	R238 L239 K244 Q245 Q246	R238-S242 PolarHBondContact O-N 2.97Å; R238-S242 PolarHBondContact O-OG 3.37Å; L239-S242 PolarHBondContact O-N 3.36Å; S242-K244 VanDerWaalsContact C-N 3.3Å; S242-K244 PolarHBondContact O-N 3.32Å; S242-Q245 PolarHBondContact O-N 2.97Å; S242-Q246 PolarHBondContact O-N 3.48Å
243	T	59.4	Low	68	Low	80 Å²	80	95.5 Å²	95.5	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-62.7	-37.7	177.4	-51.9	0	0	0	0	111.6	L239 Q246 S247	L239-T243 PolarHBondContact O-N 2.95Å; L239-T243 PolarHBondContact O-OG1 2.86Å; T243-Q246 PolarHBondContact O-N 3.21Å; T243-S247 PolarHBondContact O-N 2.81Å; T243-S247 PolarHBondContact O-OG 3.28Å; T243-S247 VanDerWaalsContact O-OG 3.05Å
244	K	54	Low	67.5	Low	108 Å²	108	96.7 Å²	96.7	47%	0.47	50%	0.502	S	S	.	.	H	α-helix	trans	-66.7	-38.8	175.5	-81.7	-168.1	172	-152.8	0	112.7	N240 Q241 S242 Q246 S247 T248	N240-K244 WeakPolarHBondContact O-CB 3.38Å; N240-K244 WeakPolarHBondContact O-CG 3.39Å; N240-K244 PolarHBondContact O-N 3.03Å; Q241-K244 PolarHBondContact O-N 2.87Å; S242-K244 VanDerWaalsContact C-N 3.3Å; S242-K244 PolarHBondContact O-N 3.32Å; K244-Q246 VanDerWaalsContact C-N 3.35Å; K244-S247 PolarHBondContact O-N 3.4Å; K244-T248 WeakPolarHBondContact O-CB 3.44Å; K244-T248 PolarHBondContact O-N 2.85Å; K244-T248 PolarHBondContact O-OG1 2.91Å
245	Q	55.2	Low	67.2	Low	137 Å²	137	100.1 Å²	100.1	64%	0.64	52%	0.518	S	S	*	.	H	α-helix	trans	-62	-42.2	173.5	-74.3	174.4	-49.2	0	0	111.5	Q241 S242 T248 T249	Q241-Q245 PolarHBondContact O-N 3.04Å; S242-Q245 PolarHBondContact O-N 2.97Å; Q245-T248 PolarHBondContact O-N 3.15Å; Q245-T249 WeakPolarHBondContact O-CG2 3.33Å; Q245-T249 PolarHBondContact O-N 3.03Å; Q245-T249 PolarHBondContact O-OG1 3.34Å
246	Q	55.6	Low	66.7	Low	138 Å²	138	96.3 Å²	96.3	65%	0.645	51%	0.511	S	S	*	.	H	α-helix	trans	-62.3	-42.5	172.3	-79.2	-178.4	-37.8	0	0	112.9	S242 T243 K244 T248 T249 L250	S242-Q246 PolarHBondContact O-N 3.48Å; T243-Q246 PolarHBondContact O-N 3.21Å; K244-Q246 VanDerWaalsContact C-N 3.35Å; Q246-T248 PolarHBondContact O-N 3.48Å; Q246-T249 WeakPolarHBondContact CA-OG1 3.49Å; Q246-T249 PolarHBondContact O-OG1 3.12Å; Q246-L250 VanDerWaalsContact O-CB 3.3Å; Q246-L250 WeakPolarHBondContact O-CB 3.23Å; Q246-L250 PolarHBondContact O-N 3.24Å
247	S	57.4	Low	66.5	Low	69 Å²	69	98.7 Å²	98.7	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-40.5	175.2	-56.4	0	0	0	0	112.4	T243 K244 S251	T243-S247 PolarHBondContact O-N 2.81Å; T243-S247 PolarHBondContact O-OG 3.28Å; T243-S247 VanDerWaalsContact O-OG 3.05Å; K244-S247 PolarHBondContact O-N 3.4Å; S247-S251 WeakPolarHBondContact O-CB 3.43Å; S247-S251 PolarHBondContact O-N 2.65Å; S247-S251 PolarHBondContact O-OG 3.15Å
248	T	59.7	Low	66.5	Low	89 Å²	89	101.7 Å²	101.7	55%	0.546	53%	0.527	S	S	.	.	H	α-helix	trans	-70.2	-41.7	-179.6	-55.5	0	0	0	0	112	K244 Q245 Q246 S251 S252	K244-T248 WeakPolarHBondContact O-CB 3.44Å; K244-T248 PolarHBondContact O-N 2.85Å; K244-T248 PolarHBondContact O-OG1 2.91Å; Q245-T248 PolarHBondContact O-N 3.15Å; Q246-T248 PolarHBondContact O-N 3.48Å; T248-S251 WeakPolarHBondContact CA-OG 3.45Å; T248-S251 PolarHBondContact O-N 2.86Å; T248-S251 PolarHBondContact O-OG 3.35Å; T248-S252 WeakPolarHBondContact O-CB 3.41Å; T248-S252 PolarHBondContact O-N 3.3Å; T248-S252 PolarHBondContact O-OG 3.48Å
249	T	63.3	Low	66.5	Low	90 Å²	90	98.3 Å²	98.3	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-40.7	174.5	45.8	0	0	0	0	111.8	Q245 Q246 S252 F253	Q245-T249 WeakPolarHBondContact O-CG2 3.33Å; Q245-T249 PolarHBondContact O-N 3.03Å; Q245-T249 PolarHBondContact O-OG1 3.34Å; Q246-T249 WeakPolarHBondContact CA-OG1 3.49Å; Q246-T249 PolarHBondContact O-OG1 3.12Å; T249-S252 WeakPolarHBondContact CA-OG 3.5Å; T249-S252 PolarHBondContact O-N 3.26Å; T249-S252 PolarHBondContact O-OG 2.94Å; T249-F253 VanDerWaalsContact O-CB 3.27Å; T249-F253 WeakPolarHBondContact O-CB 3.28Å; T249-F253 PolarHBondContact O-N 2.91Å
250	L	68.8	Low	66.4	Low	104 Å²	104	98.3 Å²	98.3	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-65.4	-43.4	175.3	-168.5	67.4	0	0	0	112	Q246 F253 Q254	Q246-L250 VanDerWaalsContact O-CB 3.3Å; Q246-L250 WeakPolarHBondContact O-CB 3.23Å; Q246-L250 PolarHBondContact O-N 3.24Å; L250-F253 PolarHBondContact O-N 3.34Å; L250-Q254 WeakPolarHBondContact O-CG 3.21Å; L250-Q254 PolarHBondContact O-N 3.21Å
251	S	67.8	Low	66.8	Low	62 Å²	62	100.3 Å²	100.3	43%	0.434	53%	0.527	S	S	.	.	H	α-helix	trans	-66.6	-39	177.2	60.2	0	0	0	0	112.8	S247 T248 F253 Q254 Q255	S247-S251 WeakPolarHBondContact O-CB 3.43Å; S247-S251 PolarHBondContact O-N 2.65Å; S247-S251 PolarHBondContact O-OG 3.15Å; T248-S251 WeakPolarHBondContact CA-OG 3.45Å; T248-S251 PolarHBondContact O-N 2.86Å; T248-S251 PolarHBondContact O-OG 3.35Å; S251-F253 VanDerWaalsContact C-N 3.35Å; S251-Q254 PolarHBondContact O-N 2.91Å; S251-Q255 WeakPolarHBondContact O-CB 3.43Å; S251-Q255 PolarHBondContact O-N 2.79Å
252	S	66	Low	67.2	Low	62 Å²	62	101.6 Å²	101.6	43%	0.434	53%	0.533	S	S	.	.	H	α-helix	trans	-69.7	-33.3	175.4	54.5	0	0	0	0	112.1	T248 T249 S256	T248-S252 WeakPolarHBondContact O-CB 3.41Å; T248-S252 PolarHBondContact O-N 3.3Å; T248-S252 PolarHBondContact O-OG 3.48Å; T249-S252 WeakPolarHBondContact CA-OG 3.5Å; T249-S252 PolarHBondContact O-N 3.26Å; T249-S252 PolarHBondContact O-OG 2.94Å; S252-S256 VanDerWaalsContact O-CB 3.25Å; S252-S256 WeakPolarHBondContact O-CB 3.13Å; S252-S256 PolarHBondContact O-N 3.2Å
253	F	72.4	Confident	67.9	Low	120 Å²	120	104.9 Å²	104.9	53%	0.526	54%	0.542	S	S	.	.	H	α-helix	trans	-66.6	-45.1	173.7	-175.2	-113.9	0	0	0	111.5	T249 L250 S251 S256 Q257	T249-F253 VanDerWaalsContact O-CB 3.27Å; T249-F253 WeakPolarHBondContact O-CB 3.28Å; T249-F253 PolarHBondContact O-N 2.91Å; L250-F253 PolarHBondContact O-N 3.34Å; S251-F253 VanDerWaalsContact C-N 3.35Å; F253-S256 PolarHBondContact O-N 2.91Å; F253-Q257 PolarHBondContact O-N 2.94Å
254	Q	71.7	Confident	68.6	Low	116 Å²	116	107 Å²	107	54%	0.542	55%	0.546	S	S	.	.	H	α-helix	trans	-61.5	-43.8	173.6	-72.5	-177.1	-59.1	0	0	112.2	L250 S251 S256 Q257 Q258	L250-Q254 WeakPolarHBondContact O-CG 3.21Å; L250-Q254 PolarHBondContact O-N 3.21Å; S251-Q254 PolarHBondContact O-N 2.91Å; Q254-S256 VanDerWaalsContact C-N 3.35Å; Q254-S256 PolarHBondContact O-N 3.09Å; Q254-Q257 PolarHBondContact O-N 3.18Å; Q254-Q258 WeakPolarHBondContact O-CG 3.28Å; Q254-Q258 PolarHBondContact O-N 3.16Å
255	Q	73.1	Confident	69.5	Low	122 Å²	122	104.5 Å²	104.5	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-66.4	-36.4	177.4	-169	172.2	12.8	0	0	112.2	S251 Q258 L259	S251-Q255 WeakPolarHBondContact O-CB 3.43Å; S251-Q255 PolarHBondContact O-N 2.79Å; Q255-Q258 PolarHBondContact O-N 3.4Å; Q255-L259 HydrophobicContact CG-CD1 4.43Å; Q255-L259 WeakPolarHBondContact O-CG 3.28Å; Q255-L259 PolarHBondContact O-N 2.94Å
256	S	72	Confident	70.4	Confident	70 Å²	70	102.2 Å²	102.2	49%	0.49	53%	0.534	S	S	.	.	H	α-helix	trans	-66.8	-37.3	173.6	-168.7	0	0	0	0	112.3	S252 F253 Q254 L260	S252-S256 VanDerWaalsContact O-CB 3.25Å; S252-S256 WeakPolarHBondContact O-CB 3.13Å; S252-S256 PolarHBondContact O-N 3.2Å; F253-S256 PolarHBondContact O-N 2.91Å; Q254-S256 VanDerWaalsContact C-N 3.35Å; Q254-S256 PolarHBondContact O-N 3.09Å; S256-L260 WeakPolarHBondContact O-CB 3.42Å; S256-L260 PolarHBondContact O-N 2.9Å
257	Q	74.7	Confident	71.3	Confident	111 Å²	111	100.3 Å²	100.3	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-66.3	-42.6	172.8	-74.5	-168.6	6.2	0	0	111.7	F253 Q254 L260 H261	F253-Q257 PolarHBondContact O-N 2.94Å; Q254-Q257 PolarHBondContact O-N 3.18Å; Q257-L260 PolarHBondContact O-N 3.08Å; Q257-H261 WeakPolarHBondContact O-CB 3.35Å; Q257-H261 PolarHBondContact O-N 2.91Å
258	Q	76.9	Confident	72	Confident	139 Å²	139	102 Å²	102	65%	0.65	53%	0.528	S	S	*	.	H	α-helix	trans	-61.1	-46	176.6	-74.8	178.4	-30.2	0	0	112.1	Q254 Q255 L260 H261 Q262	Q254-Q258 WeakPolarHBondContact O-CG 3.28Å; Q254-Q258 PolarHBondContact O-N 3.16Å; Q255-Q258 PolarHBondContact O-N 3.4Å; Q258-L260 PolarHBondContact O-N 3.13Å; Q258-H261 PolarHBondContact O-N 2.99Å; Q258-Q262 VanDerWaalsContact O-CB 3.31Å; Q258-Q262 WeakPolarHBondContact O-CB 3.3Å; Q258-Q262 PolarHBondContact O-N 2.93Å
259	L	77.1	Confident	72.8	Confident	98 Å²	98	102.4 Å²	102.4	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-61.1	-42.9	176	-77.6	166.1	0	0	0	112.4	Q255 Q262 Q263	Q255-L259 HydrophobicContact CG-CD1 4.43Å; Q255-L259 WeakPolarHBondContact O-CG 3.28Å; Q255-L259 PolarHBondContact O-N 2.94Å; L259-Q262 PolarHBondContact O-N 3.28Å; L259-Q263 WeakPolarHBondContact O-CG 3.48Å; L259-Q263 PolarHBondContact O-N 3.5Å
260	L	76	Confident	73.3	Confident	100 Å²	100	102.9 Å²	102.9	52%	0.524	52%	0.523	S	S	.	.	H	α-helix	trans	-67.8	-41.8	179.3	-161.4	156.6	0	0	0	111	S256 Q257 Q258 Q262 Q263 Q264	S256-L260 WeakPolarHBondContact O-CB 3.42Å; S256-L260 PolarHBondContact O-N 2.9Å; Q257-L260 PolarHBondContact O-N 3.08Å; Q258-L260 PolarHBondContact O-N 3.13Å; L260-Q262 VanDerWaalsContact C-N 3.31Å; L260-Q262 PolarHBondContact O-N 3.14Å; L260-Q263 PolarHBondContact O-N 3.46Å; L260-Q264 WeakPolarHBondContact O-CB 3.39Å; L260-Q264 PolarHBondContact O-N 3.29Å
261	H	75.9	Confident	73.7	Confident	137 Å²	137	102.3 Å²	102.3	63%	0.634	52%	0.517	S	S	*	.	H	α-helix	trans	-66	-34.2	177.2	-153.2	-19.5	0	0	0	112.3	Q257 Q258 Q264 S265	Q257-H261 WeakPolarHBondContact O-CB 3.35Å; Q257-H261 PolarHBondContact O-N 2.91Å; Q258-H261 PolarHBondContact O-N 2.99Å; H261-Q264 PolarHBondContact O-N 3.33Å; H261-S265 PolarHBondContact O-N 3.15Å
262	Q	74.7	Confident	74.2	Confident	120 Å²	120	102.9 Å²	102.9	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-74.7	-37.7	175.8	-167.9	171.7	25	0	0	112.4	Q258 L259 L260 Q264 S265 N266	Q258-Q262 VanDerWaalsContact O-CB 3.31Å; Q258-Q262 WeakPolarHBondContact O-CB 3.3Å; Q258-Q262 PolarHBondContact O-N 2.93Å; L259-Q262 PolarHBondContact O-N 3.28Å; L260-Q262 VanDerWaalsContact C-N 3.31Å; L260-Q262 PolarHBondContact O-N 3.14Å; Q262-Q264 PolarHBondContact O-N 2.96Å; Q262-S265 PolarHBondContact O-OG 3.18Å; Q262-N266 VanDerWaalsContact O-CG 3.27Å; Q262-N266 PolarHBondContact O-N 3.35Å; Q262-N266 VanDerWaalsContact O-N 3.12Å; Q262-N266 PolarHBondContact O-OD1 3.23Å
263	Q	73.9	Confident	74.8	Confident	131 Å²	131	105.8 Å²	105.8	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-60.9	-37	167.4	-78.7	-175.7	-34.5	0	0	111.7	L259 L260 L267	L259-Q263 WeakPolarHBondContact O-CG 3.48Å; L259-Q263 PolarHBondContact O-N 3.5Å; L260-Q263 PolarHBondContact O-N 3.46Å; Q263-L267 WeakPolarHBondContact O-CB 3.22Å; Q263-L267 PolarHBondContact O-N 3.24Å
264	Q	75.4	Confident	74.9	Confident	124 Å²	124	105.4 Å²	105.4	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-75.2	-29.2	-177.6	-160.2	166.5	18.2	0	0	113.4	L260 H261 Q262 H268	L260-Q264 WeakPolarHBondContact O-CB 3.39Å; L260-Q264 PolarHBondContact O-N 3.29Å; H261-Q264 PolarHBondContact O-N 3.33Å; Q262-Q264 PolarHBondContact O-N 2.96Å; Q264-H268 PolarHBondContact O-N 2.68Å
265	S	72.1	Confident	75.2	Confident	55 Å²	55	106.4 Å²	106.4	39%	0.385	51%	0.514	S	S	.	.	H	α-helix	trans	-70.9	-50.4	167.2	86.2	0	0	0	0	110.6	H261 Q262 L267 H268 D269	H261-S265 PolarHBondContact O-N 3.15Å; Q262-S265 PolarHBondContact O-OG 3.18Å; S265-L267 PolarHBondContact O-N 3.46Å; S265-L267 VanDerWaalsContact O-N 3.16Å; S265-H268 CarbonylContact O-C 3.56Å; S265-H268 WeakPolarHBondContact O-CA 3.34Å; S265-H268 WeakPolarHBondContact O-CB 3.41Å; S265-H268 PolarHBondContact O-N 2.83Å; S265-D269 PolarHBondContact O-N 3.49Å; S265-D269 VanDerWaalsContact O-OD2 3.05Å
266	N	73.4	Confident	75.5	Confident	89 Å²	89	107.5 Å²	107.5	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-54	-40.1	178.9	-70.4	4.3	0	0	0	112.4	Q262 D269 E270	Q262-N266 VanDerWaalsContact O-CG 3.27Å; Q262-N266 PolarHBondContact O-N 3.35Å; Q262-N266 VanDerWaalsContact O-N 3.12Å; Q262-N266 PolarHBondContact O-OD1 3.23Å; N266-D269 PolarHBondContact O-N 3.38Å; N266-E270 WeakPolarHBondContact O-CB 3.29Å; N266-E270 WeakPolarHBondContact O-CG 3.48Å; N266-E270 PolarHBondContact O-N 3.03Å
267	L	74.2	Confident	75.7	Confident	98 Å²	98	108.6 Å²	108.6	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-36	174.4	-90.6	163.4	0	0	0	113.4	Q263 S265 E271	Q263-L267 WeakPolarHBondContact O-CB 3.22Å; Q263-L267 PolarHBondContact O-N 3.24Å; S265-L267 PolarHBondContact O-N 3.46Å; S265-L267 VanDerWaalsContact O-N 3.16Å; L267-E271 WeakPolarHBondContact O-CB 3.28Å; L267-E271 WeakPolarHBondContact O-CG 3.44Å; L267-E271 PolarHBondContact O-N 3.23Å
268	H	74	Confident	75.6	Confident	106 Å²	106	111.9 Å²	111.9	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-73.2	-38	176.6	-158.9	-73	0	0	0	111.4	Q264 S265 E271 E272	Q264-H268 PolarHBondContact O-N 2.68Å; S265-H268 CarbonylContact O-C 3.56Å; S265-H268 WeakPolarHBondContact O-CA 3.34Å; S265-H268 WeakPolarHBondContact O-CB 3.41Å; S265-H268 PolarHBondContact O-N 2.83Å; H268-E271 PolarHBondContact O-N 2.87Å; H268-E272 IonicContact CE1-OE1 3.62Å; H268-E272 IonicContact ND1-OE1 2.7Å; H268-E272 PolarHBondContact O-N 3.33Å
269	D	75.1	Confident	75.3	Confident	97 Å²	97	111.9 Å²	111.9	52%	0.519	52%	0.518	S	S	.	.	H	α-helix	trans	-64.7	-45.4	172.9	-63.8	-49.4	0	0	0	110.8	S265 N266 E271 E272 E273	S265-D269 PolarHBondContact O-N 3.49Å; S265-D269 VanDerWaalsContact O-OD2 3.05Å; N266-D269 PolarHBondContact O-N 3.38Å; D269-E271 PolarHBondContact O-N 3.47Å; D269-E272 PolarHBondContact O-N 3.49Å; D269-E273 WeakPolarHBondContact O-CB 3.47Å; D269-E273 PolarHBondContact O-N 3.03Å
270	E	74.4	Confident	74.7	Confident	100 Å²	100	115 Å²	115	47%	0.467	53%	0.53	S	S	.	.	H	α-helix	trans	-65.1	-33.4	172.9	-75.5	-174.2	-173.9	0	0	113.3	N266 R274	N266-E270 WeakPolarHBondContact O-CB 3.29Å; N266-E270 WeakPolarHBondContact O-CG 3.48Å; N266-E270 PolarHBondContact O-N 3.03Å; E270-R274 VanDerWaalsContact CB-NH2 3.27Å; E270-R274 VanDerWaalsContact O-CB 3.28Å; E270-R274 WeakPolarHBondContact O-CB 3.36Å; E270-R274 VanDerWaalsContact O-CG 3.25Å; E270-R274 WeakPolarHBondContact O-CG 3.02Å; E270-R274 PolarHBondContact O-N 3.35Å; E270-R274 PolarHBondContact O-NE 3.22Å; E270-R274 IonicContact OE2-CZ 3.69Å; E270-R274 IonicContact OE2-NH1 3.76Å; E270-R274 IonicContact OE2-NH2 2.76Å; E270-R274 PolarHBondContact OE2-NH2 3.28Å
271	E	77.5	Confident	73.9	Confident	92 Å²	92	117.5 Å²	117.5	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-69.8	-42.9	172.9	-86.8	-131.3	128.6	0	0	111.5	L267 H268 D269 R274 R275	L267-E271 WeakPolarHBondContact O-CB 3.28Å; L267-E271 WeakPolarHBondContact O-CG 3.44Å; L267-E271 PolarHBondContact O-N 3.23Å; H268-E271 PolarHBondContact O-N 2.87Å; D269-E271 PolarHBondContact O-N 3.47Å; E271-R274 PolarHBondContact O-N 2.94Å; E271-R275 WeakPolarHBondContact O-CB 3.23Å; E271-R275 WeakPolarHBondContact O-CG 3.45Å; E271-R275 PolarHBondContact O-N 3.1Å; E271-R275 IonicContact OE2-CZ 3.39Å; E271-R275 IonicContact OE2-NE 2.82Å; E271-R275 IonicContact OE2-NH2 2.68Å; E271-R275 PolarHBondContact OE2-NH2 3.16Å
272	E	77.7	Confident	72.7	Confident	73 Å²	73	118.2 Å²	118.2	34%	0.341	54%	0.542	S	S	.	.	H	α-helix	trans	-64.7	-42.9	175.3	-83.1	-157.5	-148.7	0	0	112.2	H268 D269 R275 R276	H268-E272 IonicContact CE1-OE1 3.62Å; H268-E272 IonicContact ND1-OE1 2.7Å; H268-E272 PolarHBondContact O-N 3.33Å; D269-E272 PolarHBondContact O-N 3.49Å; E272-R275 PolarHBondContact O-N 3Å; E272-R276 VanDerWaalsContact O-CG 3.27Å; E272-R276 WeakPolarHBondContact O-CG 3.31Å; E272-R276 PolarHBondContact O-N 3.38Å; E272-R276 IonicContact OE2-CZ 3.93Å; E272-R276 IonicContact OE2-NE 2.9Å; E272-R276 IonicContact OE2-NH2 3.59Å; E272-R276 PolarHBondContact OE2-NH2 3.14Å
273	E	77.8	Confident	71.5	Confident	123 Å²	123	121.5 Å²	121.5	58%	0.575	56%	0.558	S	S	*	*	H	α-helix	trans	-65.5	-41.4	177.8	-167.2	166.9	-121.6	0	0	111.3	D269 R275 R276 Q277	D269-E273 WeakPolarHBondContact O-CB 3.47Å; D269-E273 PolarHBondContact O-N 3.03Å; E273-R275 VanDerWaalsContact C-N 3.33Å; E273-R275 PolarHBondContact O-N 3.41Å; E273-R276 PolarHBondContact O-N 2.84Å; E273-Q277 WeakPolarHBondContact O-CB 3.44Å; E273-Q277 WeakPolarHBondContact O-CG 3.06Å; E273-Q277 PolarHBondContact O-N 2.81Å
274	R	75.4	Confident	70.1	Confident	113 Å²	113	124.3 Å²	124.3	43%	0.426	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-33.1	171.3	-75.9	178.6	-72.1	-151.6	-7	113.1	E270 E271 R278	E270-R274 VanDerWaalsContact CB-NH2 3.27Å; E270-R274 VanDerWaalsContact O-CB 3.28Å; E270-R274 WeakPolarHBondContact O-CB 3.36Å; E270-R274 VanDerWaalsContact O-CG 3.25Å; E270-R274 WeakPolarHBondContact O-CG 3.02Å; E270-R274 PolarHBondContact O-N 3.35Å; E270-R274 PolarHBondContact O-NE 3.22Å; E270-R274 IonicContact OE2-CZ 3.69Å; E270-R274 IonicContact OE2-NH1 3.76Å; E270-R274 IonicContact OE2-NH2 2.76Å; E270-R274 PolarHBondContact OE2-NH2 3.28Å; E271-R274 PolarHBondContact O-N 2.94Å; R274-R278 WeakPolarHBondContact O-CB 3.43Å; R274-R278 VanDerWaalsContact O-CG 3.24Å; R274-R278 WeakPolarHBondContact O-CG 3.43Å; R274-R278 PolarHBondContact O-N 3.39Å
275	R	78.2	Confident	68.5	Low	137 Å²	137	124.4 Å²	124.4	52%	0.517	58%	0.579	S	S	.	*	H	α-helix	trans	-68.4	-43	173.1	-74	168.6	-165.8	-160.9	9.7	111.3	E271 E272 E273 R278 Q279	E271-R275 WeakPolarHBondContact O-CB 3.23Å; E271-R275 WeakPolarHBondContact O-CG 3.45Å; E271-R275 PolarHBondContact O-N 3.1Å; E271-R275 IonicContact OE2-CZ 3.39Å; E271-R275 IonicContact OE2-NE 2.82Å; E271-R275 IonicContact OE2-NH2 2.68Å; E271-R275 PolarHBondContact OE2-NH2 3.16Å; E272-R275 PolarHBondContact O-N 3Å; E273-R275 VanDerWaalsContact C-N 3.33Å; E273-R275 PolarHBondContact O-N 3.41Å; R275-R278 PolarHBondContact O-N 3.12Å; R275-Q279 WeakPolarHBondContact O-CG 3.26Å; R275-Q279 PolarHBondContact O-N 3.33Å
276	R	79.1	Confident	66.9	Low	145 Å²	145	127.1 Å²	127.1	55%	0.547	60%	0.596	S	S	.	*	H	α-helix	trans	-63.2	-44.9	176	-67.9	169.2	-163.5	-169.2	7.6	111.4	E272 E273 R278 Q279 Q280	E272-R276 VanDerWaalsContact O-CG 3.27Å; E272-R276 WeakPolarHBondContact O-CG 3.31Å; E272-R276 PolarHBondContact O-N 3.38Å; E272-R276 IonicContact OE2-CZ 3.93Å; E272-R276 IonicContact OE2-NE 2.9Å; E272-R276 IonicContact OE2-NH2 3.59Å; E272-R276 PolarHBondContact OE2-NH2 3.14Å; E273-R276 PolarHBondContact O-N 2.84Å; R276-R278 PolarHBondContact O-N 2.98Å; R276-Q279 PolarHBondContact O-N 3.37Å; R276-Q280 WeakPolarHBondContact O-CG 3.24Å; R276-Q280 PolarHBondContact O-N 2.92Å
277	Q	76.1	Confident	65.1	Low	92 Å²	92	128.6 Å²	128.6	43%	0.43	61%	0.608	S	S	.	*	H	α-helix	trans	-61.2	-43	174	-71.8	175.4	11.8	0	0	112.1	E273 Q279 Q280 Q281	E273-Q277 WeakPolarHBondContact O-CB 3.44Å; E273-Q277 WeakPolarHBondContact O-CG 3.06Å; E273-Q277 PolarHBondContact O-N 2.81Å; Q277-Q279 VanDerWaalsContact C-N 3.35Å; Q277-Q279 PolarHBondContact O-N 2.79Å; Q277-Q280 PolarHBondContact O-N 3.34Å; Q277-Q281 WeakPolarHBondContact O-CG 3.49Å; Q277-Q281 PolarHBondContact O-N 3.19Å; Q277-Q281 VanDerWaalsContact O-N 3.16Å
278	R	73.1	Confident	63	Low	181 Å²	181	130.6 Å²	130.6	68%	0.683	62%	0.619	S	S	*	*	H	α-helix	trans	-64.3	-36	175.8	-77.2	175.3	178.4	-161.1	-0.3	113.1	R274 R275 R276 Q281 Q282	R274-R278 WeakPolarHBondContact O-CB 3.43Å; R274-R278 VanDerWaalsContact O-CG 3.24Å; R274-R278 WeakPolarHBondContact O-CG 3.43Å; R274-R278 PolarHBondContact O-N 3.39Å; R275-R278 PolarHBondContact O-N 3.12Å; R276-R278 PolarHBondContact O-N 2.98Å; R278-Q281 PolarHBondContact O-N 2.82Å; R278-Q282 WeakPolarHBondContact O-CG 3.19Å
279	Q	70.2	Confident	61.3	Low	139 Å²	139	134.9 Å²	134.9	65%	0.65	64%	0.639	S	S	*	*	H	α-helix	trans	-69.7	-36	174.6	-74.7	173.8	-19.4	0	0	112.1	R275 R276 Q277 Q281	R275-Q279 WeakPolarHBondContact O-CG 3.26Å; R275-Q279 PolarHBondContact O-N 3.33Å; R276-Q279 PolarHBondContact O-N 3.37Å; Q277-Q279 VanDerWaalsContact C-N 3.35Å; Q277-Q279 PolarHBondContact O-N 2.79Å; Q279-Q281 VanDerWaalsContact C-N 3.26Å; Q279-Q281 PolarHBondContact O-N 2.66Å
280	Q	65.1	Low	59.2	Low	164 Å²	164	136.6 Å²	136.6	77%	0.766	65%	0.647	S	S	*	*	H	α-helix	trans	-75	-9.9	176.3	-71.7	177	-7.6	0	0	114.3	R276 Q277	R276-Q280 WeakPolarHBondContact O-CG 3.24Å; R276-Q280 PolarHBondContact O-N 2.92Å; Q277-Q280 PolarHBondContact O-N 3.34Å
281	Q	57.9	Low	57.3	Low	152 Å²	152	142.7 Å²	142.7	71%	0.71	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	13.1	178.1	-68.8	177.3	9	0	0	113.3	Q277 R278 Q279	Q277-Q281 WeakPolarHBondContact O-CG 3.49Å; Q277-Q281 PolarHBondContact O-N 3.19Å; Q277-Q281 VanDerWaalsContact O-N 3.16Å; R278-Q281 PolarHBondContact O-N 2.82Å; Q279-Q281 VanDerWaalsContact C-N 3.26Å; Q279-Q281 PolarHBondContact O-N 2.66Å
282	Q	50.8	Low	55.1	Low	151 Å²	151	144.8 Å²	144.8	71%	0.706	68%	0.682	S	S	*	*			trans	-100.1	14	-175.6	-90.6	-178.6	-26.8	0	0	115.3	R278	R278-Q282 WeakPolarHBondContact O-CG 3.19Å
283	E	49.4	Very low	53	Low	190 Å²	190	145.9 Å²	145.9	89%	0.888	70%	0.698	S	S	*	*	S	Bend	trans	-104.6	5.3	-176.7	-151.6	160.3	-149.2	0	0	114.7
284	E	44.9	Very low	51.1	Low	189 Å²	189	148.3 Å²	148.3	88%	0.883	71%	0.709	S	S	*	*			trans	-123	122.3	170.5	-73.3	-164.8	127.9	0	0	113.4
285	V	41.8	Very low	49	Very low	126 Å²	126	148 Å²	148	76%	0.764	72%	0.723	S	S	*	*			trans	-151	127.1	178.2	175.9	0	0	0	0	104.7
286	P	38.3	Very low	46.9	Very low	113 Å²	113	150.6 Å²	150.6	73%	0.734	74%	0.738	S	S	*	*				-152.2	141	65.4	34.7	-11.4	0	0	0	119.8
287	T	36.2	Very low	44.8	Very low	120 Å²	120	149.6 Å²	149.6	74%	0.736	74%	0.744	S	S	*	*				79.9	132.9	125.6	-58.2	0	0	0	0	122.5
288	L	30	Very low	42.9	Very low	140 Å²	140	151.9 Å²	151.9	73%	0.733	76%	0.759	S	S	*	*			trans	67.9	112.6	161.5	-110.8	71.1	0	0	0	120.2
289	Q	38.1	Very low	41.3	Very low	195 Å²	195	149.3 Å²	149.3	91%	0.911	76%	0.759	S	S	*	*				-159.1	144.4	101.5	-101.4	169.9	25.3	0	0	110.7
290	L	31.6	Very low	39.8	Very low	133 Å²	133	150 Å²	150	70%	0.696	76%	0.762	S	S	*	*			trans	-93.2	149.7	175.3	-85.2	76.8	0	0	0	110.7
291	Y	34.7	Very low	38.3	Very low	229 Å²	229	147.3 Å²	147.3	90%	0.898	76%	0.757	S	S	*	*			trans	-154	103.8	146.2	-133.2	-86.1	0	0	0	111.1
292	D	31.1	Very low	37.3	Very low	135 Å²	135	147.9 Å²	147.9	72%	0.722	76%	0.764	S	S	*	*			trans	-92.3	136.4	173.5	-73.7	-63.6	0	0	0	111.2
293	S	34	Very low	36.5	Very low	97 Å²	97	146.1 Å²	146.1	68%	0.678	76%	0.764	S	S	*	*			trans	177.3	138.4	164.8	-79.2	0	0	0	0	109.6
294	Q	37.6	Very low	35.9	Very low	173 Å²	173	144.2 Å²	144.2	81%	0.808	76%	0.758	S	S	*	*			cis	-158.6	-176.5	-10.6	-158.6	133.3	-42.4	0	0	110.5
295	C	31.4	Very low	35.4	Very low	106 Å²	106	143.4 Å²	143.4	72%	0.716	75%	0.754	S	S	*	*			trans	-52.3	156.5	-170.4	-53.9	0	0	0	0	117.2
296	F	34.2	Very low	35.1	Very low	192 Å²	192	142.4 Å²	142.4	84%	0.842	75%	0.753	S	S	*	*			cis	75.1	149.5	44.1	-116.3	-77.9	0	0	0	115.3
297	N	33.7	Very low	35	Very low	124 Å²	124	142.2 Å²	142.2	66%	0.663	75%	0.754	S	S	*	*			trans	80	143.8	171.8	-62.5	13.7	0	0	0	116.5
298	D	37.6	Very low	35	Very low	140 Å²	140	141.3 Å²	141.3	75%	0.749	75%	0.753	S	S	*	*			cis	-135	-157.5	-16.8	-74.3	-43.1	0	0	0	106.8
299	D	38.8	Very low	35.2	Very low	128 Å²	128	140 Å²	140	68%	0.684	76%	0.756	S	S	*	*			cis	-161.9	-172.3	3.8	-152.9	5.4	0	0	0	106
300	Q	38.5	Very low	35	Very low	152 Å²	152	136.6 Å²	136.6	71%	0.71	75%	0.748	S	S	*	*			cis	-154.3	162.2	2.1	-160.8	171	93.9	0	0	111.7
301	T	34.6	Very low	35.1	Very low	109 Å²	109	139.3 Å²	139.3	67%	0.669	75%	0.754	S	S	*	*			trans	-15	139.1	171.2	60.8	0	0	0	0	123.1
302	L	36.9	Very low	35.1	Very low	164 Å²	164	134.9 Å²	134.9	86%	0.859	75%	0.751	S	S	*	*				-166.2	150.6	97.5	-102.8	167.3	0	0	0	114.1
303	T	32.4	Very low	35.2	Very low	113 Å²	113	135.6 Å²	135.6	69%	0.693	75%	0.754	S	S	*	*			trans	-80.2	163.3	-173.2	47.5	0	0	0	0	113.6
304	I	37.2	Very low	35.2	Very low	151 Å²	151	138.3 Å²	138.3	77%	0.774	76%	0.756	S	S	*	*				-158.9	131.4	54.2	-69	167.4	0	0	0	106.3
305	Q	35.6	Very low	35.1	Very low	172 Å²	172	134.6 Å²	134.6	80%	0.804	74%	0.742	S	S	*	*			cis	98.4	81.3	42.9	-169.7	-171.6	0.6	0	0	115.1
306	S	35.4	Very low	35.4	Very low	104 Å²	104	135.4 Å²	135.4	73%	0.727	75%	0.745	S	S	*	*			trans	-179.8	106.7	148.4	56.3	0	0	0	0	109.7
307	S	36.2	Very low	35.7	Very low	110 Å²	110	131 Å²	131	77%	0.769	73%	0.729	S	S	*	*				53.2	130.3	86.7	69.1	0	0	0	0	115.6
308	S	35.2	Very low	36	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	74%	0.735	S	S	*	*			cis	-177.1	142.6	-5.4	45.9	0	0	0	0	111.1
309	S	34.6	Very low	36.1	Very low	114 Å²	114	134.2 Å²	134.2	80%	0.797	74%	0.736	S	S	*	*			trans	66.6	153.1	167.2	-49.1	0	0	0	0	115.9
310	T	34	Very low	36.3	Very low	123 Å²	123	133.2 Å²	133.2	76%	0.755	73%	0.729	S	S	*	*			cis	-149.6	149.9	7.7	-24.6	0	0	0	0	111.4
311	K	33	Very low	36.5	Very low	190 Å²	190	131.6 Å²	131.6	83%	0.826	72%	0.722	S	S	*	*			trans	-8.3	139.7	163.3	-51.8	168.7	-179.2	-179.8	0	119.3
312	V	34.5	Very low	36.7	Very low	135 Å²	135	131.9 Å²	131.9	82%	0.818	72%	0.718	S	S	*	*				159.8	139	115.8	157.4	0	0	0	0	113
313	L	34	Very low	37.3	Very low	151 Å²	151	127.5 Å²	127.5	79%	0.791	70%	0.699	S	S	*	*			trans	74.9	139.7	163.9	-127.5	66.6	0	0	0	122.4
314	E	35.1	Very low	37.8	Very low	154 Å²	154	126.6 Å²	126.6	72%	0.72	69%	0.69	S	S	*	*			trans	-71.9	153	-178.4	-52.5	118.7	123	0	0	115.2
315	D	34.6	Very low	38.3	Very low	95 Å²	95	123.3 Å²	123.3	51%	0.508	67%	0.673	S	S	.	*			trans	-166.1	113.1	133.4	-120.4	-21.7	0	0	0	109.6	I317 K513	D315-I317 PolarHBondContact O-N 3.33Å; D315-K513 IonicContact OD2-NZ 3.82Å; D315-K513 PolarHBondContact OD2-NZ 2.95Å
316	P	36.9	Very low	38.9	Very low	122 Å²	122	120.3 Å²	120.3	79%	0.792	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	51.5	-174.6	34.2	-36.9	0	0	0	113.3
317	I	40.8	Very low	39.4	Very low	99 Å²	99	119.5 Å²	119.5	51%	0.508	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.4	-30.5	-172.7	-62.3	178.3	0	0	0	112.3	D315 H319 I320	D315-I317 PolarHBondContact O-N 3.33Å; I317-H319 VanDerWaalsContact C-N 3.34Å; I317-H319 PolarHBondContact O-N 3.01Å; I317-I320 PolarHBondContact O-N 3.3Å
318	Q	41.1	Very low	39.7	Very low	169 Å²	169	121 Å²	121	79%	0.79	65%	0.645	S	S	*	*	H	α-helix	trans	-68.3	-23.1	-168.6	-119.6	128.8	17.6	0	0	115.6	I320	Q318-I320 VanDerWaalsContact C-N 3.33Å; Q318-I320 PolarHBondContact O-N 3.47Å
319	H	39	Very low	40.3	Very low	164 Å²	164	121 Å²	121	76%	0.759	64%	0.636	S	S	*	*	H	α-helix	trans	-74.1	-20.5	178	-106.7	-77.7	0	0	0	114	I317 T323	I317-H319 VanDerWaalsContact C-N 3.34Å; I317-H319 PolarHBondContact O-N 3.01Å; H319-T323 PolarHBondContact O-OG1 3.37Å
320	I	43	Very low	40.6	Very low	107 Å²	107	124.1 Å²	124.1	55%	0.549	63%	0.63	S	S	.	*	H	α-helix	trans	-84.1	-27.7	178.4	-66.6	174.8	0	0	0	111.1	I317 Q318 T323 N324	I317-I320 PolarHBondContact O-N 3.3Å; Q318-I320 VanDerWaalsContact C-N 3.33Å; Q318-I320 PolarHBondContact O-N 3.47Å; I320-T323 PolarHBondContact O-OG1 2.79Å; I320-N324 WeakPolarHBondContact CG2-ND2 3.48Å; I320-N324 WeakPolarHBondContact O-CB 3.42Å; I320-N324 PolarHBondContact O-N 3.41Å; I320-N324 PolarHBondContact O-ND2 3.1Å
321	Q	42	Very low	40.8	Very low	118 Å²	118	123.3 Å²	123.3	55%	0.551	62%	0.621	S	S	*	*	H	α-helix	trans	-65.5	-54.4	177.4	-148.4	73.7	13.2	0	0	111	T323 N324 D325	Q321-T323 VanDerWaalsContact C-N 3.3Å; Q321-T323 PolarHBondContact O-N 2.93Å; Q321-N324 PolarHBondContact O-N 3.32Å; Q321-N324 VanDerWaalsContact O-N 3.11Å; Q321-D325 PolarHBondContact O-N 3.11Å
322	L	39.9	Very low	41.2	Very low	114 Å²	114	117 Å²	117	60%	0.597	60%	0.601	S	S	*	*	H	α-helix	trans	-65.5	-31.2	-173.8	-161.5	71.4	0	0	0	113.3	L326	L322-L326 WeakPolarHBondContact O-CB 3.18Å; L322-L326 WeakPolarHBondContact O-CG 3.35Å; L322-L326 PolarHBondContact O-N 2.81Å; L322-L326 VanDerWaalsContact O-N 3.15Å
323	T	48.3	Very low	41.2	Very low	73 Å²	73	114.5 Å²	114.5	45%	0.448	59%	0.588	S	S	.	*	H	α-helix	trans	-77.7	-30	176.2	46	0	0	0	0	112.7	H319 I320 Q321 N327	H319-T323 PolarHBondContact O-OG1 3.37Å; I320-T323 PolarHBondContact O-OG1 2.79Å; Q321-T323 VanDerWaalsContact C-N 3.3Å; Q321-T323 PolarHBondContact O-N 2.93Å; T323-N327 PolarHBondContact O-N 3.29Å; T323-N327 PolarHBondContact O-ND2 3.38Å
324	N	43.1	Very low	41.4	Very low	94 Å²	94	113.2 Å²	113.2	50%	0.503	58%	0.581	S	S	.	*	H	α-helix	trans	-73.3	-44.2	170.2	-80.1	-52.5	0	0	0	111.8	I320 Q321 L326 N327 H328	I320-N324 WeakPolarHBondContact CG2-ND2 3.48Å; I320-N324 WeakPolarHBondContact O-CB 3.42Å; I320-N324 PolarHBondContact O-N 3.41Å; I320-N324 PolarHBondContact O-ND2 3.1Å; Q321-N324 PolarHBondContact O-N 3.32Å; Q321-N324 VanDerWaalsContact O-N 3.11Å; N324-L326 PolarHBondContact O-N 3.09Å; N324-N327 CarbonylContact O-C 3.55Å; N324-N327 PolarHBondContact O-N 3.47Å; N324-N327 VanDerWaalsContact O-N 3.13Å; N324-H328 WeakPolarHBondContact O-CB 3.18Å; N324-H328 PolarHBondContact O-N 3.04Å
325	D	48.6	Very low	41.5	Very low	81 Å²	81	109.8 Å²	109.8	43%	0.433	57%	0.574	S	S	.	*	H	α-helix	trans	-62.1	-41.9	178.9	-70.4	-34.3	0	0	0	111.7	Q321 N327 H328 I329	Q321-D325 PolarHBondContact O-N 3.11Å; D325-N327 VanDerWaalsContact C-N 3.34Å; D325-N327 PolarHBondContact O-N 3.21Å; D325-H328 PolarHBondContact O-N 3.49Å; D325-I329 WeakPolarHBondContact O-CB 3.43Å; D325-I329 VanDerWaalsContact O-CG1 3.3Å; D325-I329 WeakPolarHBondContact O-CG1 3.28Å; D325-I329 PolarHBondContact O-N 2.82Å
326	L	47.3	Very low	41.5	Very low	110 Å²	110	109 Å²	109	58%	0.576	58%	0.576	S	S	*	*	H	α-helix	trans	-63.6	-35.8	174	-77.9	169.6	0	0	0	113	L322 N324 R330	L322-L326 WeakPolarHBondContact O-CB 3.18Å; L322-L326 WeakPolarHBondContact O-CG 3.35Å; L322-L326 PolarHBondContact O-N 2.81Å; L322-L326 VanDerWaalsContact O-N 3.15Å; N324-L326 PolarHBondContact O-N 3.09Å; L326-R330 VanDerWaalsContact O-CB 3.27Å; L326-R330 WeakPolarHBondContact O-CB 3.42Å; L326-R330 PolarHBondContact O-N 2.79Å
327	N	45.3	Very low	41.3	Very low	87 Å²	87	111.8 Å²	111.8	47%	0.465	58%	0.579	S	S	.	*	H	α-helix	trans	-74.8	-30.9	173.6	-80.1	-48.9	0	0	0	112.7	T323 N324 D325 R330 N331	T323-N327 PolarHBondContact O-N 3.29Å; T323-N327 PolarHBondContact O-ND2 3.38Å; N324-N327 CarbonylContact O-C 3.55Å; N324-N327 PolarHBondContact O-N 3.47Å; N324-N327 VanDerWaalsContact O-N 3.13Å; D325-N327 VanDerWaalsContact C-N 3.34Å; D325-N327 PolarHBondContact O-N 3.21Å; N327-R330 PolarHBondContact O-N 3.06Å; N327-N331 WeakPolarHBondContact O-CB 3.27Å; N327-N331 PolarHBondContact O-N 2.69Å; N327-N331 PolarHBondContact O-ND2 3.18Å
328	H	43.7	Very low	40.8	Very low	142 Å²	142	111.9 Å²	111.9	66%	0.657	59%	0.588	S	S	*	*	H	α-helix	trans	-71.5	-34.5	175.5	-153.9	-49	0	0	0	111.4	N324 D325 S332	N324-H328 WeakPolarHBondContact O-CB 3.18Å; N324-H328 PolarHBondContact O-N 3.04Å; D325-H328 PolarHBondContact O-N 3.49Å; H328-S332 WeakPolarHBondContact O-CB 3.31Å; H328-S332 PolarHBondContact O-N 2.7Å; H328-S332 PolarHBondContact O-OG 3.32Å
329	I	47.6	Very low	40.3	Very low	99 Å²	99	113.6 Å²	113.6	51%	0.508	59%	0.588	S	S	.	*	H	α-helix	trans	-70	-47.3	170.5	-68.4	165.8	0	0	0	110.6	D325 N331 S332 C333	D325-I329 WeakPolarHBondContact O-CB 3.43Å; D325-I329 VanDerWaalsContact O-CG1 3.3Å; D325-I329 WeakPolarHBondContact O-CG1 3.28Å; D325-I329 PolarHBondContact O-N 2.82Å; I329-N331 VanDerWaalsContact C-N 3.26Å; I329-N331 PolarHBondContact O-N 2.92Å; I329-S332 WeakPolarHBondContact CA-OG 3.4Å; I329-S332 PolarHBondContact O-N 3.27Å; I329-S332 VanDerWaalsContact O-N 3.12Å; I329-S332 PolarHBondContact O-OG 2.86Å; I329-C333 PolarHBondContact O-N 2.82Å; I329-C333 PolarHBondContact O-SG 3.2Å; I329-C333 VanDerWaalsContact O-SG 3.36Å
330	R	40.1	Very low	39.9	Very low	180 Å²	180	114.3 Å²	114.3	68%	0.679	59%	0.592	S	S	*	*	H	α-helix	trans	-60.4	-34.6	179.6	-158.4	176.6	-158.6	103.5	1.4	112.6	L326 N327 I334	L326-R330 VanDerWaalsContact O-CB 3.27Å; L326-R330 WeakPolarHBondContact O-CB 3.42Å; L326-R330 PolarHBondContact O-N 2.79Å; N327-R330 PolarHBondContact O-N 3.06Å; R330-I334 WeakPolarHBondContact O-CG1 3.17Å
331	N	39.4	Very low	39.2	Very low	106 Å²	106	116.5 Å²	116.5	57%	0.567	61%	0.605	S	S	*	*	H	α-helix	trans	-84.5	-25	175.1	-70.6	-56.9	0	0	0	113.8	N327 I329 S335	N327-N331 WeakPolarHBondContact O-CB 3.27Å; N327-N331 PolarHBondContact O-N 2.69Å; N327-N331 PolarHBondContact O-ND2 3.18Å; I329-N331 VanDerWaalsContact C-N 3.26Å; I329-N331 PolarHBondContact O-N 2.92Å; N331-S335 PolarHBondContact O-N 2.96Å; N331-S335 PolarHBondContact O-OG 3.49Å
332	S	40.9	Very low	38.7	Very low	57 Å²	57	116.3 Å²	116.3	40%	0.399	62%	0.617	S	S	.	*	H	α-helix	trans	-69.5	-37.3	169	63.2	0	0	0	0	112.1	H328 I329 I334 S335 S336	H328-S332 WeakPolarHBondContact O-CB 3.31Å; H328-S332 PolarHBondContact O-N 2.7Å; H328-S332 PolarHBondContact O-OG 3.32Å; I329-S332 WeakPolarHBondContact CA-OG 3.4Å; I329-S332 PolarHBondContact O-N 3.27Å; I329-S332 VanDerWaalsContact O-N 3.12Å; I329-S332 PolarHBondContact O-OG 2.86Å; S332-I334 PolarHBondContact O-N 2.97Å; S332-S335 WeakPolarHBondContact CA-OG 3.29Å; S332-S335 PolarHBondContact O-N 3.45Å; S332-S335 PolarHBondContact O-OG 2.94Å; S332-S336 PolarHBondContact O-N 3.42Å; S332-S336 PolarHBondContact O-OG 2.95Å
333	C	34.2	Very low	38.3	Very low	82 Å²	82	118 Å²	118	55%	0.554	63%	0.626	S	S	*	*	H	α-helix	trans	-70.9	-10.9	177.7	-67.3	0	0	0	0	114.4	I329 S336	I329-C333 PolarHBondContact O-N 2.82Å; I329-C333 PolarHBondContact O-SG 3.2Å; I329-C333 VanDerWaalsContact O-SG 3.36Å; C333-S336 PolarHBondContact O-OG 3.43Å
334	I	38.7	Very low	37.4	Very low	124 Å²	124	121.5 Å²	121.5	64%	0.636	64%	0.642	S	S	*	*	H	α-helix	trans	-105	-10.1	176	-65.1	172.6	0	0	0	111.6	R330 S332	R330-I334 WeakPolarHBondContact O-CG1 3.17Å; S332-I334 PolarHBondContact O-N 2.97Å
335	S	37.7	Very low	36.9	Very low	83 Å²	83	125 Å²	125	58%	0.58	66%	0.659	S	S	*	*	H	α-helix	trans	-99.5	-3.1	176.6	44.9	0	0	0	0	114.4	N331 S332	N331-S335 PolarHBondContact O-N 2.96Å; N331-S335 PolarHBondContact O-OG 3.49Å; S332-S335 WeakPolarHBondContact CA-OG 3.29Å; S332-S335 PolarHBondContact O-N 3.45Å; S332-S335 PolarHBondContact O-OG 2.94Å
336	S	33.2	Very low	36.2	Very low	79 Å²	79	129.6 Å²	129.6	55%	0.552	68%	0.678	S	S	*	*	S	Bend	trans	-76.9	-28.9	176.3	24.6	0	0	0	0	114.7	S332 C333 S338	S332-S336 PolarHBondContact O-N 3.42Å; S332-S336 PolarHBondContact O-OG 2.95Å; C333-S336 PolarHBondContact O-OG 3.43Å; S336-S338 PolarHBondContact O-N 3.47Å; S336-S338 VanDerWaalsContact O-N 3.1Å
337	E	33.2	Very low	35.3	Very low	180 Å²	180	133.2 Å²	133.2	84%	0.841	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	17.8	-175.2	-79.1	-172.3	144.1	0	0	115.5
338	S	30.3	Very low	34.8	Very low	100 Å²	100	137.8 Å²	137.8	70%	0.699	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	17.8	-177.4	-79.8	0	0	0	0	115.3	S336	S336-S338 PolarHBondContact O-N 3.47Å; S336-S338 VanDerWaalsContact O-N 3.1Å
339	Y	31.1	Very low	34.3	Very low	205 Å²	205	134.3 Å²	134.3	80%	0.804	71%	0.711	S	S	*	*	S	Bend	trans	-126.7	4.2	177.2	-95.8	-81.5	0	0	0	116.6
340	E	30.1	Very low	34	Very low	180 Å²	180	135.8 Å²	135.8	84%	0.841	73%	0.727	S	S	*	*			trans	-110.7	93.7	167.7	-64.4	-157.6	140.8	0	0	111.2
341	N	29.2	Very low	33.8	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	74%	0.738	S	S	*	*			trans	-165	56.8	166.7	-110.3	-76.5	0	0	0	108.9
342	S	31.7	Very low	33.6	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	75%	0.747	S	S	*	*	S	Bend	trans	-144.4	19.5	-175.3	-168.2	0	0	0	0	114.4
343	L	31.1	Very low	33.2	Very low	151 Å²	151	144.7 Å²	144.7	79%	0.791	77%	0.765	S	S	*	*	S	Bend	trans	-151.9	157.6	162.3	-100.4	141.3	0	0	0	107.4
344	D	29.1	Very low	33.3	Very low	146 Å²	146	148.6 Å²	148.6	78%	0.781	78%	0.779	S	S	*	*			trans	46.7	88.8	169.1	-54.2	-18.9	0	0	0	118.3
345	L	33.4	Very low	33.3	Very low	167 Å²	167	148.4 Å²	148.4	87%	0.874	79%	0.786	S	S	*	*			trans	-146.9	148.9	142.9	-118.5	162.7	0	0	0	111.1
346	H	32	Very low	33.2	Very low	177 Å²	177	148.5 Å²	148.5	82%	0.819	79%	0.787	S	S	*	*			trans	-81.5	169.1	-160.1	-140	-114.7	0	0	0	113.6	E348	H346-E348 PolarHBondContact O-N 3.09Å
347	F	29.6	Very low	33.4	Very low	186 Å²	186	150.9 Å²	150.9	82%	0.816	80%	0.8	S	S	*	*			trans	-81	92	-175.3	-174.6	-89.8	0	0	0	111.9
348	E	34.7	Very low	33.5	Very low	183 Å²	183	149.4 Å²	149.4	86%	0.855	80%	0.798	S	S	*	*			trans	-135.1	136.9	165.1	-84.1	-177.9	123.6	0	0	111.3	H346	H346-E348 PolarHBondContact O-N 3.09Å
349	G	33.2	Very low	33.8	Very low	70 Å²	70	151.7 Å²	151.7	72%	0.722	80%	0.801	S	S	*	*			trans	-103.9	125.6	-170.1	0	0	0	0	0	113.7
350	P	40.5	Very low	34	Very low	130 Å²	130	149.1 Å²	149.1	84%	0.844	80%	0.802	S	S	*	*			trans	-68.6	156.5	167.6	-19.3	33.4	0	0	0	112.4
351	R	35.9	Very low	34.3	Very low	241 Å²	241	145.2 Å²	145.2	91%	0.909	79%	0.794	S	S	*	*			trans	-86	-173.5	-172.1	-59	-179	-174.4	-177	1.5	112.8
352	N	35.6	Very low	34.5	Very low	144 Å²	144	146.7 Å²	146.7	77%	0.77	80%	0.796	S	S	*	*			trans	-60	-174.4	-167.2	-59.6	-17	0	0	0	116.3
353	D	33.1	Very low	34.6	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	79%	0.791	S	S	*	*			trans	83.4	87.1	159	-47.6	-33.8	0	0	0	117.3
354	I	35	Very low	34.7	Very low	164 Å²	164	146.3 Å²	146.3	84%	0.841	79%	0.79	S	S	*	*			trans	-166.6	118.1	138	-91.3	142.1	0	0	0	107.5
355	P	39.4	Very low	34.9	Very low	119 Å²	119	151.2 Å²	151.2	77%	0.773	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.4	148.3	170.2	-19	32.9	0	0	0	112.5
356	S	36.4	Very low	34.8	Very low	86 Å²	86	151.5 Å²	151.5	60%	0.601	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-67.6	137.6	168.8	-74	0	0	0	0	110.8	N358	S356-N358 PolarHBondContact O-N 2.84Å
357	P	37.5	Very low	34.9	Very low	128 Å²	128	150.4 Å²	150.4	83%	0.831	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.7	121.6	-175.9	27.8	-34.4	0	0	0	111.1
358	N	34.7	Very low	34.9	Very low	150 Å²	150	152.8 Å²	152.8	80%	0.802	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78.7	133.8	-179	-143.3	-1.6	0	0	0	110.6	S356 N360	S356-N358 PolarHBondContact O-N 2.84Å; N358-N360 PolarHBondContact O-N 2.84Å
359	L	37.1	Very low	34.7	Very low	147 Å²	147	148.8 Å²	148.8	77%	0.77	80%	0.801	S	S	*	*			trans	-94	57.1	-171.6	-165.3	72.6	0	0	0	112.5
360	N	35.2	Very low	34.6	Very low	152 Å²	152	153 Å²	153	81%	0.813	81%	0.805	S	S	*	*			trans	-98.3	112.8	166.4	-83.1	5.7	0	0	0	109	N358	N358-N360 PolarHBondContact O-N 2.84Å
361	S	35.4	Very low	34.1	Very low	97 Å²	97	152.8 Å²	152.8	68%	0.678	80%	0.801	S	S	*	*			trans	-133	75.5	-173.5	63.9	0	0	0	0	112.6
362	H	33.2	Very low	34.1	Very low	185 Å²	185	150.8 Å²	150.8	86%	0.856	80%	0.802	S	S	*	*	S	Bend	trans	-154.7	9.7	157	-132.4	-73.2	0	0	0	118.1
363	T	34	Very low	34	Very low	112 Å²	112	149.3 Å²	149.3	69%	0.687	80%	0.798	S	S	*	*	S	Bend	trans	-127.1	173.8	169.6	54.6	0	0	0	0	110.9
364	D	32.9	Very low	34.1	Very low	143 Å²	143	152.7 Å²	152.7	77%	0.765	80%	0.802	S	S	*	*			trans	65.8	48.4	161.4	-43.8	-46.9	0	0	0	116.7
365	R	33.9	Very low	34.2	Very low	250 Å²	250	150.6 Å²	150.6	94%	0.943	80%	0.799	S	S	*	*	S	Bend	trans	-127.8	18.6	167.9	-106.1	-171.7	-178.6	-143.2	-1.3	116.6
366	L	31.9	Very low	33.6	Very low	172 Å²	172	152.5 Å²	152.5	90%	0.901	80%	0.801	S	S	*	*	S	Bend	trans	-119	-2.9	176.3	-92.7	166.2	0	0	0	115.1
367	I	33	Very low	33.4	Very low	154 Å²	154	155.6 Å²	155.6	79%	0.79	81%	0.811	S	S	*	*	S	Bend	trans	-128	63.5	-174.3	-44	-179.8	0	0	0	111.5
368	Y	29.7	Very low	33.3	Very low	237 Å²	237	156.9 Å²	156.9	93%	0.929	81%	0.806	S	S	*	*	S	Bend	trans	-161.9	51.1	157.2	-133.6	-86	0	0	0	113.1
369	A	32.1	Very low	33.2	Very low	98 Å²	98	156.9 Å²	156.9	81%	0.81	80%	0.799	S	S	*	*	S	Bend	trans	-142.2	14.4	-179.4	0	0	0	0	0	114.5
370	I	30.7	Very low	32.9	Very low	158 Å²	158	158 Å²	158	81%	0.81	80%	0.797	S	S	*	*			trans	-140.5	116.6	176.6	-54.3	176.1	0	0	0	107.7
371	T	29.7	Very low	32.9	Very low	126 Å²	126	156 Å²	156	77%	0.773	80%	0.796	S	S	*	*			trans	139	61.5	164.4	49	0	0	0	0	114.1
372	H	35.2	Very low	32.9	Very low	200 Å²	200	157.2 Å²	157.2	93%	0.926	80%	0.799	S	S	*	*			trans	-140.4	109.2	152.1	-97.7	25.3	0	0	0	107.6
373	T	34.5	Very low	32.9	Very low	112 Å²	112	155.1 Å²	155.1	69%	0.687	79%	0.794	S	S	*	*			trans	-114	-178.3	-177.4	47.1	0	0	0	0	111.1
374	Y	35	Very low	32.9	Very low	217 Å²	217	159.1 Å²	159.1	85%	0.851	81%	0.805	S	S	*	*			trans	83.3	141.5	-180	-50.7	-70.5	0	0	0	115.6
375	P	36.5	Very low	32.8	Very low	119 Å²	119	160 Å²	160	77%	0.773	81%	0.808	S	S	*	*				-129.2	178.4	-51.4	31.5	-15.1	0	0	0	112.4
376	L	28	Very low	32.9	Very low	159 Å²	159	157.7 Å²	157.7	83%	0.832	81%	0.808	S	S	*	*			trans	-68.9	153.1	173.5	-69	79.7	0	0	0	111.2
377	D	31.6	Very low	32.8	Very low	151 Å²	151	152.5 Å²	152.5	81%	0.807	80%	0.797	S	S	*	*				-161.7	168.6	110.3	-125.6	-38.4	0	0	0	115.2
378	H	35	Very low	32.7	Very low	156 Å²	156	152.8 Å²	152.8	72%	0.722	80%	0.798	S	S	*	*			trans	78.3	89.5	160.7	-110.6	-103.8	0	0	0	123.3
379	F	31.9	Very low	32.8	Very low	149 Å²	149	149 Å²	149	65%	0.654	79%	0.794	S	S	*	*				71.9	96.9	123.1	-96.5	-111.3	0	0	0	124.2
380	K	32.6	Very low	32.6	Very low	170 Å²	170	152 Å²	152	74%	0.739	80%	0.796	S	S	*	*				67.1	140.5	107.7	-102.9	175.1	177.2	174.9	0	124.2
381	S	34.1	Very low	32.8	Very low	111 Å²	111	152.7 Å²	152.7	78%	0.776	80%	0.801	S	S	*	*			trans	81.2	147.2	150.1	90.9	0	0	0	0	118.4
382	T	34.8	Very low	32.8	Very low	123 Å²	123	155.7 Å²	155.7	76%	0.755	81%	0.806	S	S	*	*			cis	-143.3	163.2	2	-34.8	0	0	0	0	112.9
383	N	34.1	Very low	32.9	Very low	141 Å²	141	153.7 Å²	153.7	75%	0.754	80%	0.802	S	S	*	*			trans	-70.5	164.9	-177.6	-36.6	-43.3	0	0	0	115
384	Q	35	Very low	32.9	Very low	196 Å²	196	155.8 Å²	155.8	92%	0.916	80%	0.804	S	S	*	*				-165.1	164.9	107.4	-104.5	177.2	14.9	0	0	113.3
385	I	30.2	Very low	32.9	Very low	160 Å²	160	151.3 Å²	151.3	82%	0.821	80%	0.795	S	S	*	*			trans	-141.6	139.1	-169.7	-58.9	172.8	0	0	0	109.1
386	Q	35.1	Very low	32.9	Very low	202 Å²	202	153 Å²	153	94%	0.944	79%	0.792	S	S	*	*			trans	-160.6	160.8	154.5	-118.8	166.9	-5.3	0	0	111.2
387	G	30.6	Very low	33.2	Very low	64 Å²	64	151.2 Å²	151.2	66%	0.66	78%	0.783	S	S	*	*			trans	179.2	-163.9	-179.1	0	0	0	0	0	113.2
388	I	29.7	Very low	33.4	Very low	160 Å²	160	150.4 Å²	150.4	82%	0.821	78%	0.779	S	S	*	*			trans	69.4	108.4	176.9	-49.9	174.1	0	0	0	115
389	N	32.6	Very low	33.4	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	78%	0.784	S	S	*	*				-163.5	146.5	114.1	-101.1	-40.6	0	0	0	111.5
390	L	27.4	Very low	33.3	Very low	161 Å²	161	151 Å²	151	84%	0.843	79%	0.793	S	S	*	*			trans	-106.8	153.5	169.7	-75.8	163.7	0	0	0	108.6
391	N	34.4	Very low	33.4	Very low	172 Å²	172	150.1 Å²	150.1	92%	0.92	80%	0.795	S	S	*	*			trans	-156.8	144.9	146.1	-98.7	-20.4	0	0	0	108.2
392	E	31.1	Very low	33.5	Very low	189 Å²	189	152 Å²	152	88%	0.883	80%	0.797	S	S	*	*			trans	-89.2	149	-179.2	-58.2	170.3	116.4	0	0	110
393	D	35.9	Very low	33.3	Very low	158 Å²	158	153.5 Å²	153.5	85%	0.845	80%	0.8	S	S	*	*			trans	-160.6	169.7	135.7	-129.5	-37.3	0	0	0	113.6
394	H	35.5	Very low	33.3	Very low	156 Å²	156	152.6 Å²	152.6	72%	0.722	80%	0.802	S	S	*	*			trans	-81	153.5	-150.1	-99.2	-90.3	0	0	0	120.5
395	N	35.5	Very low	32.8	Very low	123 Å²	123	152.1 Å²	152.1	66%	0.658	80%	0.797	S	S	*	*			trans	91.6	126.4	136.9	-72.6	-13	0	0	0	124
396	H	35.9	Very low	32.8	Very low	154 Å²	154	151.3 Å²	151.3	71%	0.713	79%	0.794	S	S	*	*			trans	54	112.4	140.2	-78.5	-77.8	0	0	0	119.5
397	N	34.2	Very low	32.6	Very low	121 Å²	121	151.4 Å²	151.4	65%	0.647	79%	0.794	S	S	*	*				-171.4	149.2	52.4	-96	-41.1	0	0	0	114.9
398	N	35.2	Very low	32.4	Very low	135 Å²	135	156.1 Å²	156.1	72%	0.722	80%	0.804	S	S	*	*			trans	61.9	126.9	145.7	-59.4	-17.1	0	0	0	122.7
399	N	36.2	Very low	32.2	Very low	154 Å²	154	153.6 Å²	153.6	82%	0.824	80%	0.801	S	S	*	*			trans	76.8	63	147	-57.8	-4.3	0	0	0	119.4
400	L	30.1	Very low	32.1	Very low	162 Å²	162	151.8 Å²	151.8	85%	0.848	80%	0.795	S	S	*	*			trans	-41.7	156.9	133.5	-108.3	66.6	0	0	0	112.1
401	I	34.3	Very low	32.2	Very low	152 Å²	152	149.4 Å²	149.4	78%	0.779	79%	0.792	S	S	*	*			cis	-133.2	139.9	19.7	-61.8	175.6	0	0	0	110.8
402	N	34.6	Very low	32.2	Very low	152 Å²	152	150.7 Å²	150.7	81%	0.813	79%	0.793	S	S	*	*			trans	-105.1	167.3	167.5	-87.6	-56.2	0	0	0	112.1
403	N	31	Very low	32.2	Very low	154 Å²	154	148 Å²	148	82%	0.824	79%	0.789	S	S	*	*			trans	-42.2	148.4	148.9	-88.4	-46.5	0	0	0	110.8
404	P	33.9	Very low	32.3	Very low	121 Å²	121	148.2 Å²	148.2	79%	0.786	79%	0.79	S	S	*	*				-153.7	-179	68.3	42.6	-22.7	0	0	0	117.9
405	F	25.4	Very low	32	Very low	187 Å²	187	148.1 Å²	148.1	82%	0.82	79%	0.794	S	S	*	*			trans	-73.5	167.8	158.2	-122.4	-107.1	0	0	0	111.1
406	N	29.6	Very low	32	Very low	142 Å²	142	149.2 Å²	149.2	76%	0.759	80%	0.8	S	S	*	*			trans	73.1	101.5	171.8	-55.8	-14.3	0	0	0	117.5
407	Q	31.3	Very low	32	Very low	204 Å²	204	147.8 Å²	147.8	95%	0.953	80%	0.803	S	S	*	*				-149.3	154	118.7	-106.3	166.1	36.8	0	0	109.3
408	L	26.7	Very low	31.9	Very low	163 Å²	163	149.7 Å²	149.7	85%	0.853	81%	0.812	S	S	*	*			trans	-141.9	151.4	-171.7	-171.6	76.5	0	0	0	109
409	S	26.2	Very low	31.9	Very low	108 Å²	108	152.6 Å²	152.6	76%	0.755	82%	0.818	S	S	*	*			trans	63.1	127.4	-176.6	68.6	0	0	0	0	113.1
410	T	30.3	Very low	31.9	Very low	120 Å²	120	149.7 Å²	149.7	74%	0.736	81%	0.81	S	S	*	*				-154.2	122.1	56.4	39.9	0	0	0	0	108.3
411	S	28.3	Very low	32	Very low	110 Å²	110	150.7 Å²	150.7	77%	0.769	81%	0.808	S	S	*	*				60.1	83.9	81	74.5	0	0	0	0	114.9
412	E	35.8	Very low	32.1	Very low	200 Å²	200	151.5 Å²	151.5	94%	0.935	81%	0.808	S	S	*	*			trans	-146.3	152.8	144.7	-137.7	158.5	-151.9	0	0	110.4
413	T	31	Very low	31.9	Very low	132 Å²	132	149.3 Å²	149.3	81%	0.81	80%	0.804	S	S	*	*			trans	-101.3	147.4	-170.3	45.4	0	0	0	0	111.9
414	D	36.4	Very low	32.3	Very low	162 Å²	162	146.5 Å²	146.5	87%	0.866	80%	0.795	S	S	*	*			trans	-143.7	146.8	145.5	-134	-30	0	0	0	112
415	L	29.9	Very low	32.4	Very low	155 Å²	155	148.7 Å²	148.7	81%	0.812	79%	0.792	S	S	*	*			trans	-138.5	110	-163.7	173	73.1	0	0	0	111.4
416	N	35.3	Very low	33	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	79%	0.785	S	S	*	*			trans	-165.9	138.3	173.4	-90.7	-52	0	0	0	109.1
417	T	36.1	Very low	33.3	Very low	125 Å²	125	146.7 Å²	146.7	77%	0.767	78%	0.783	S	S	*	*			cis	-151.4	155.6	-2.4	-56.2	0	0	0	0	110.3
418	L	31.5	Very low	33.1	Very low	160 Å²	160	144.7 Å²	144.7	84%	0.838	78%	0.778	S	S	*	*			trans	-77.9	149.2	-178.7	-66	129.2	0	0	0	115.5
419	K	36.4	Very low	33.4	Very low	197 Å²	197	142.6 Å²	142.6	86%	0.857	78%	0.777	S	S	*	*				166.7	154.4	128.1	-92.4	162.4	-173.8	-180	0	110.8
420	S	35.1	Very low	33.4	Very low	93 Å²	93	144.8 Å²	144.8	65%	0.65	78%	0.781	S	S	*	*			cis	-164.1	133	5.1	31.8	0	0	0	0	112.8
421	F	32.1	Very low	33.6	Very low	183 Å²	183	144.6 Å²	144.6	80%	0.803	78%	0.784	S	S	*	*			trans	58	157.7	150.8	-68.3	-103.3	0	0	0	118.4
422	E	36.4	Very low	33.7	Very low	169 Å²	169	146.4 Å²	146.4	79%	0.79	79%	0.785	S	S	*	*			cis	-140.4	-177.3	14.7	-157.2	112	-128.4	0	0	112.3
423	S	31.1	Very low	33.6	Very low	105 Å²	105	146.6 Å²	146.6	73%	0.734	79%	0.786	S	S	*	*			trans	-164.9	-158.7	-173.4	-143.7	0	0	0	0	108.9
424	P	40.3	Very low	33.6	Very low	96 Å²	96	145 Å²	145	62%	0.623	79%	0.786	S	S	*	*			cis	-140	-164.8	-15.4	24.6	2.3	0	0	0	115.4
425	K	36.5	Very low	33.4	Very low	167 Å²	167	142.3 Å²	142.3	73%	0.726	78%	0.78	S	S	*	*			trans	97.9	153.3	148.7	-48.2	-171.3	-162.1	175.2	0	117.7
426	H	37.7	Very low	33.4	Very low	147 Å²	147	142.9 Å²	142.9	68%	0.681	78%	0.783	S	S	*	*			cis	-146.5	153.6	7.5	-114.9	-56.4	0	0	0	112.1
427	I	34.4	Very low	33.4	Very low	140 Å²	140	144.1 Å²	144.1	72%	0.718	79%	0.788	S	S	*	*			trans	48.5	119.9	146.9	-62.7	158.6	0	0	0	118.5
428	L	28.2	Very low	33.3	Very low	161 Å²	161	143 Å²	143	84%	0.843	79%	0.785	S	S	*	*			cis	85.1	100.4	30.7	-164.9	136.3	0	0	0	116.8
429	S	32.8	Very low	33.6	Very low	120 Å²	120	140 Å²	140	84%	0.839	78%	0.776	S	S	*	*			trans	-169.2	155.5	130.3	48.7	0	0	0	0	110.4
430	N	25.2	Very low	33.6	Very low	154 Å²	154	138.8 Å²	138.8	82%	0.824	77%	0.772	S	S	*	*			trans	-142.7	127.8	-176.2	-157.8	16	0	0	0	108.5
431	S	35.5	Very low	33.7	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	78%	0.775	S	S	*	*			trans	-152	121.5	171.5	57.6	0	0	0	0	110.8
432	N	29.7	Very low	33.8	Very low	149 Å²	149	137.1 Å²	137.1	80%	0.797	77%	0.769	S	S	*	*			trans	-83.6	139.4	176.9	-57.9	-58.6	0	0	0	111
433	Q	34.4	Very low	33.9	Very low	204 Å²	204	135.5 Å²	135.5	95%	0.953	77%	0.766	S	S	*	*			trans	-154.4	151.2	139.8	-115.2	166.6	12.5	0	0	110.4
434	A	31	Very low	34.4	Very low	98 Å²	98	137 Å²	137	81%	0.81	77%	0.766	S	S	*	*			trans	-131.1	130.9	-168.3	0	0	0	0	0	112.3
435	S	32.4	Very low	34.5	Very low	105 Å²	105	140.1 Å²	140.1	73%	0.734	78%	0.777	S	S	*	*			trans	-179.1	110.2	162.5	43.9	0	0	0	0	106.5
436	L	30	Very low	34.8	Very low	167 Å²	167	139.6 Å²	139.6	87%	0.874	78%	0.782	S	S	*	*				88.4	150.6	84.7	-85.9	164	0	0	0	113.2
437	I	34.6	Very low	34.9	Very low	171 Å²	171	139.5 Å²	139.5	88%	0.877	79%	0.787	S	S	*	*			trans	86.2	150.8	174.1	-55.2	158.4	0	0	0	115.5
438	S	33.7	Very low	35.3	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	79%	0.788	S	S	*	*			trans	-173.6	167.6	-161.9	-176.3	0	0	0	0	107.4
439	P	39.2	Very low	35.9	Very low	97 Å²	97	138.3 Å²	138.3	63%	0.63	78%	0.783	S	S	*	*			cis	-123.9	-159.3	-33.1	31.3	-10.1	0	0	0	112.1
440	H	34.7	Very low	36.2	Very low	170 Å²	170	140.3 Å²	140.3	79%	0.787	78%	0.784	S	S	*	*			trans	72.4	155.1	-179.1	-56.9	-83.3	0	0	0	114.6
441	T	38.7	Very low	36.8	Very low	117 Å²	117	136.4 Å²	136.4	72%	0.718	78%	0.78	S	S	*	*			cis	-104.5	159.3	1.8	38.7	0	0	0	0	111.8
442	N	33.3	Very low	36.8	Very low	124 Å²	124	138.7 Å²	138.7	66%	0.663	78%	0.783	S	S	*	*				65.2	157.4	67.2	-100.8	66.6	0	0	0	114.4
443	D	39.5	Very low	37.2	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	79%	0.786	S	S	*	*			trans	88.8	135.2	-178.9	-41.2	-11.9	0	0	0	113.3
444	D	41.1	Very low	37.3	Very low	137 Å²	137	139 Å²	139	73%	0.733	78%	0.78	S	S	*	*			cis	150	170.2	-22.6	-85.2	-11.1	0	0	0	107.4
445	D	40.9	Very low	37.6	Very low	160 Å²	160	142.9 Å²	142.9	86%	0.856	78%	0.782	S	S	*	*			trans	71.2	157.7	-173	-58.6	-27.8	0	0	0	116.1
446	D	43	Very low	37.6	Very low	156 Å²	156	146.5 Å²	146.5	83%	0.834	79%	0.787	S	S	*	*			trans	-135.4	-139.6	-159.9	-76.2	-75.7	0	0	0	113.4
447	D	41.4	Very low	37.6	Very low	146 Å²	146	146.2 Å²	146.2	78%	0.781	78%	0.781	S	S	*	*			trans	72.2	155.2	172.9	-51.7	-9.1	0	0	0	118.7
448	D	41.4	Very low	37.4	Very low	138 Å²	138	143 Å²	143	74%	0.738	77%	0.769	S	S	*	*			cis	-162.8	161.6	-35.9	-108.3	-13.2	0	0	0	111.8
449	D	42.2	Very low	37.1	Very low	138 Å²	138	143.9 Å²	143.9	74%	0.738	78%	0.775	S	S	*	*			trans	37.6	151.5	154.4	-82.3	-17.4	0	0	0	128
450	D	39.3	Very low	36.5	Very low	161 Å²	161	142.7 Å²	142.7	86%	0.861	78%	0.78	S	S	*	*			trans	65.1	146.2	147.4	-69.7	-16.7	0	0	0	125
451	G	37.2	Very low	36.2	Very low	73 Å²	73	140.9 Å²	140.9	75%	0.753	78%	0.781	S	S	*	*			trans	149.3	103.1	167.9	0	0	0	0	0	115.3
452	D	35.6	Very low	35.6	Very low	162 Å²	162	140.7 Å²	140.7	87%	0.866	78%	0.781	S	S	*	*			trans	-82.1	-158.6	-175.7	-64.4	-69.6	0	0	0	115.4
453	E	37.9	Very low	35.5	Very low	182 Å²	182	144.9 Å²	144.9	85%	0.85	79%	0.793	S	S	*	*			trans	82.4	140.5	168.1	-59.9	176.7	-166.3	0	0	118.3
454	E	36.5	Very low	34.9	Very low	177 Å²	177	144.7 Å²	144.7	83%	0.827	79%	0.788	S	S	*	*			cis	-164	-166.2	-32.7	-139	177.2	-154.7	0	0	110.2
455	E	36.6	Very low	34.4	Very low	181 Å²	181	144.5 Å²	144.5	85%	0.846	80%	0.796	S	S	*	*			trans	78.1	121.3	162.7	-66.2	-167.4	151.7	0	0	123
456	E	33.6	Very low	33.8	Very low	180 Å²	180	142.2 Å²	142.2	84%	0.841	78%	0.783	S	S	*	*			trans	-78.5	-173.3	162.3	-50.6	173.2	129.5	0	0	110.2
457	E	29.4	Very low	33.5	Very low	162 Å²	162	143.4 Å²	143.4	76%	0.757	78%	0.784	S	S	*	*			cis	-159.5	171.6	-9.6	-137.8	-159.3	169.2	0	0	110.2
458	V	30.7	Very low	33	Very low	103 Å²	103	141.5 Å²	141.5	62%	0.624	78%	0.777	S	S	*	*			trans	53.2	123.1	144	167.3	0	0	0	0	123.5
459	S	26.4	Very low	32.4	Very low	121 Å²	121	144.5 Å²	144.5	85%	0.846	78%	0.78	S	S	*	*			trans	45.5	129.7	145.4	-60.4	0	0	0	0	123.2
460	G	27.7	Very low	31.9	Very low	72 Å²	72	144.2 Å²	144.2	74%	0.742	78%	0.778	S	S	*	*			trans	-174.2	105.7	163.3	0	0	0	0	0	117.1
461	T	28.2	Very low	31.6	Very low	132 Å²	132	141.9 Å²	141.9	81%	0.81	77%	0.77	S	S	*	*			trans	3.4	124.3	156.6	53.2	0	0	0	0	121.5
462	T	25.8	Very low	31.2	Very low	114 Å²	114	143.7 Å²	143.7	70%	0.699	77%	0.771	S	S	*	*				21	123.9	127.4	-46.2	0	0	0	0	119.6
463	F	30.6	Very low	31.3	Very low	212 Å²	212	141.1 Å²	141.1	93%	0.93	76%	0.763	S	S	*	*			trans	-135.4	142.2	140.6	-112.6	-83.7	0	0	0	111.4
464	Q	27.5	Very low	30.8	Very low	132 Å²	132	138.7 Å²	138.7	62%	0.617	75%	0.754	S	S	*	*			trans	-135.2	140.1	-169.7	172.1	175.3	-31.4	0	0	109.4	D466	Q464-D466 PolarHBondContact NE2-OD2 3.06Å
465	C	31.6	Very low	30.4	Very low	132 Å²	132	138.6 Å²	138.6	89%	0.892	75%	0.751	S	S	*	*			trans	-134.4	105.8	167.8	-75.8	0	0	0	0	109.5
466	D	27.9	Very low	30.4	Very low	112 Å²	112	138.4 Å²	138.4	60%	0.599	75%	0.75	S	S	*	*			trans	-72.7	168.2	170.9	-66	-88.7	0	0	0	112.6	Q464	Q464-D466 PolarHBondContact NE2-OD2 3.06Å
467	H	36.4	Very low	30.3	Very low	181 Å²	181	134.7 Å²	134.7	84%	0.838	74%	0.744	S	S	*	*			trans	152.7	140.8	139.8	-84	-63.2	0	0	0	111.4
468	V	31.3	Very low	30.7	Very low	106 Å²	106	131.6 Å²	131.6	64%	0.642	74%	0.738	S	S	*	*			cis	-159.3	127.5	-23.1	92.1	0	0	0	0	110.5
469	Y	27.7	Very low	30.7	Very low	202 Å²	202	134.8 Å²	134.8	79%	0.792	74%	0.744	S	S	*	*			trans	56.6	158.7	143.2	-85.6	-113	0	0	0	125.1
470	N	31.4	Very low	31	Very low	132 Å²	132	136.1 Å²	136.1	71%	0.706	73%	0.734	S	S	*	*			trans	79.2	135.1	157	-63.6	-16.9	0	0	0	119.3
471	T	34	Very low	31.2	Very low	112 Å²	112	139.4 Å²	139.4	69%	0.687	73%	0.73	S	S	*	*			cis	-160.2	136.8	-7.8	8.2	0	0	0	0	112
472	S	29.5	Very low	31.4	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	73%	0.728	S	S	*	*				50.8	155.8	125.4	-58.8	0	0	0	0	123.4
473	P	36.8	Very low	31.5	Very low	107 Å²	107	142.2 Å²	142.2	70%	0.695	74%	0.735	S	S	*	*			trans	-133.3	-159.3	-145.1	31.2	-6.4	0	0	0	115.5
474	I	27.2	Very low	31.5	Very low	132 Å²	132	140.1 Å²	140.1	68%	0.677	73%	0.726	S	S	*	*			trans	98.5	131.5	152.4	-64.5	162.2	0	0	0	119.1
475	K	28.4	Very low	31.5	Very low	174 Å²	174	140 Å²	140	76%	0.757	73%	0.725	S	S	*	*			trans	69.6	156.1	166.8	-72.2	157.2	-162.7	169.4	0	116.6
476	H	36.1	Very low	31.3	Very low	178 Å²	178	141.4 Å²	141.4	82%	0.824	72%	0.719	S	S	*	*			cis	-119.9	179.4	9.8	-100.9	-83.4	0	0	0	114.5
477	S	32.2	Very low	31.4	Very low	101 Å²	101	144 Å²	144	71%	0.706	73%	0.727	S	S	*	*			trans	-143.4	-163.7	-170.5	61	0	0	0	0	109.2
478	P	36.5	Very low	30.9	Very low	97 Å²	97	140.8 Å²	140.8	63%	0.63	73%	0.725	S	S	*	*			cis	-142.1	-155.9	-1.5	42.6	-20.8	0	0	0	115.2
479	F	31.1	Very low	30.7	Very low	171 Å²	171	142 Å²	142	75%	0.75	73%	0.727	S	S	*	*			trans	76.2	147.2	162.5	-74.2	-165.2	0	0	0	117.2
480	K	34.2	Very low	30.7	Very low	149 Å²	149	140.4 Å²	140.4	65%	0.648	72%	0.724	S	S	*	*			cis	-169.6	172.9	-10.6	-105.2	-170.4	175.9	-150.3	0	107.4
481	Q	30.7	Very low	30.6	Very low	141 Å²	141	140.4 Å²	140.4	66%	0.659	72%	0.72	S	S	*	*			cis	-174.9	148.9	-28	166.8	175.5	5.4	0	0	108.6
482	S	32.7	Very low	30.3	Very low	110 Å²	110	141.8 Å²	141.8	77%	0.769	72%	0.719	S	S	*	*			trans	65.8	139.6	179.4	70.5	0	0	0	0	115.9
483	K	27.9	Very low	30.5	Very low	194 Å²	194	141.2 Å²	141.2	84%	0.843	71%	0.707	S	S	*	*			cis	78.3	95.1	4.9	-152.3	-165.5	-173.6	-165.3	0	117.6
484	K	30.3	Very low	30.3	Very low	168 Å²	168	143.8 Å²	143.8	73%	0.73	71%	0.71	S	S	*	*			trans	-175.4	144.1	146.5	-99.2	-175.4	172.5	-79.7	0	106.8
485	E	27.7	Very low	30.7	Very low	131 Å²	131	144.9 Å²	144.9	61%	0.612	72%	0.716	S	S	*	*				57.2	134.3	72.6	-67.5	157.2	-141.5	0	0	111.9
486	E	28.4	Very low	30.8	Very low	160 Å²	160	141.7 Å²	141.7	75%	0.748	71%	0.711	S	S	*	*			cis	-167.4	174.5	-3.5	-177.7	150.1	-141.3	0	0	109
487	E	28.2	Very low	30.7	Very low	166 Å²	166	140.7 Å²	140.7	78%	0.776	71%	0.706	S	S	*	*			trans	50.3	134.3	155.5	-93.6	-179.2	165.5	0	0	123.6
488	S	26.9	Very low	30.8	Very low	114 Å²	114	142.4 Å²	142.4	80%	0.797	71%	0.707	S	S	*	*			trans	73.7	169.8	137.5	84.3	0	0	0	0	119.2
489	L	27.3	Very low	30.7	Very low	131 Å²	131	142.3 Å²	142.3	69%	0.686	71%	0.709	S	S	*	*			cis	-178.5	122.5	-43.5	176.1	122.4	0	0	0	105.5
490	K	27.5	Very low	30.8	Very low	169 Å²	169	139.8 Å²	139.8	74%	0.735	71%	0.713	S	S	*	*			trans	62.4	170.4	175.9	-66.7	173.9	-173.8	-175.8	0	113
491	E	28.8	Very low	30.4	Very low	132 Å²	132	140.8 Å²	140.8	62%	0.617	72%	0.722	S	S	*	*			cis	-153.3	162.4	-12.7	-126.8	172.8	120.1	0	0	109.4
492	Q	28.3	Very low	30.3	Very low	142 Å²	142	141.5 Å²	141.5	66%	0.664	73%	0.728	S	S	*	*			trans	66.4	160.4	150	-72.8	174.5	42.7	0	0	117.1
493	N	32.9	Very low	30	Very low	99 Å²	99	143.9 Å²	143.9	53%	0.529	73%	0.732	S	S	.	*			cis	-150.6	148.5	3.4	-126.3	-27.4	0	0	0	112.1
494	Q	33	Very low	30	Very low	160 Å²	160	143.8 Å²	143.8	75%	0.748	73%	0.734	S	S	*	*			trans	64.7	163.6	151.5	-62.8	149.8	14.3	0	0	116.3
495	I	35.1	Very low	30	Very low	156 Å²	156	144.2 Å²	144.2	80%	0.8	74%	0.739	S	S	*	*			cis	-123.8	136.6	12.5	-64.5	166.9	0	0	0	111.7
496	T	30.9	Very low	30.1	Very low	107 Å²	107	146.9 Å²	146.9	66%	0.656	75%	0.751	S	S	*	*			trans	-43.5	153.8	170.8	47.5	0	0	0	0	116.1
497	H	34.9	Very low	30.3	Very low	157 Å²	157	145.1 Å²	145.1	73%	0.727	75%	0.751	S	S	*	*				-176.2	160.7	75.1	-123.4	-84	0	0	0	114.2
498	N	34.7	Very low	30.5	Very low	137 Å²	137	144.5 Å²	144.5	73%	0.733	75%	0.751	S	S	*	*			trans	69.1	148.1	162.8	-53.9	-19.1	0	0	0	118.5
499	S	33.5	Very low	30.6	Very low	94 Å²	94	143.6 Å²	143.6	66%	0.657	74%	0.744	S	S	*	*			cis	-167.7	146.6	-27.7	-101.8	0	0	0	0	111.1
500	S	32.9	Very low	30.9	Very low	119 Å²	119	144.5 Å²	144.5	83%	0.832	75%	0.75	S	S	*	*			trans	60.1	150.4	155.3	51.8	0	0	0	0	121.9
501	M	25.8	Very low	31.2	Very low	170 Å²	170	141 Å²	141	84%	0.837	75%	0.747	S	S	*	*			trans	-59.9	159.6	165.5	-59	155.9	53.7	0	0	112.7
502	I	29.4	Very low	31.4	Very low	156 Å²	156	141.9 Å²	141.9	80%	0.8	75%	0.754	S	S	*	*				-174.1	154.9	121.8	-97.5	156	0	0	0	110.8
503	L	26.6	Very low	31.7	Very low	160 Å²	160	142.5 Å²	142.5	84%	0.838	75%	0.754	S	S	*	*			trans	-82.3	142.6	170.2	-65.8	128.5	0	0	0	110.5
504	Q	27.9	Very low	31.7	Very low	192 Å²	192	146 Å²	146	90%	0.897	77%	0.768	S	S	*	*			trans	-169.7	162.2	138.8	-111.4	153.7	-16	0	0	115.1
505	E	28.4	Very low	31.8	Very low	177 Å²	177	143 Å²	143	83%	0.827	76%	0.764	S	S	*	*			trans	-98.9	142.8	170.2	-59.5	166.4	100.6	0	0	110
506	E	31.8	Very low	31.7	Very low	186 Å²	186	142.3 Å²	142.3	87%	0.869	76%	0.762	S	S	*	*			trans	-132.7	126.3	150.9	-65.8	-169.3	125.4	0	0	106.8
507	V	32	Very low	31.8	Very low	124 Å²	124	142.6 Å²	142.6	75%	0.752	76%	0.764	S	S	*	*			cis	84	155.1	37.9	-175.1	0	0	0	0	112
508	I	32.3	Very low	31.7	Very low	152 Å²	152	139.7 Å²	139.7	78%	0.779	76%	0.761	S	S	*	*			trans	86.3	121.2	-172.8	-55	167.9	0	0	0	112.2
509	C	28.6	Very low	31.6	Very low	96 Å²	96	143.9 Å²	143.9	65%	0.649	77%	0.767	S	S	*	*			cis	-150.7	144.6	8.5	-144.6	0	0	0	0	113.8
510	N	33.9	Very low	31.5	Very low	149 Å²	149	146.1 Å²	146.1	80%	0.797	77%	0.771	S	S	*	*			trans	55.6	142.1	151.2	-68.3	-11.5	0	0	0	120.9
511	S	34.5	Very low	31.3	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	76%	0.763	S	S	*	*			cis	-160.8	150.8	13	35.1	0	0	0	0	113.8
512	I	32.7	Very low	31.6	Very low	151 Å²	151	143.9 Å²	143.9	77%	0.774	76%	0.759	S	S	*	*			trans	65	133.6	145.5	-67.5	166.9	0	0	0	117.4
513	K	33.6	Very low	31.7	Very low	154 Å²	154	144.2 Å²	144.2	67%	0.67	76%	0.757	S	S	*	*			cis	-145.4	175.7	8.3	-131.3	160	-168.4	173.4	0	109.8	D315	D315-K513 IonicContact OD2-NZ 3.82Å; D315-K513 PolarHBondContact OD2-NZ 2.95Å
514	Q	32.6	Very low	31.9	Very low	174 Å²	174	145.8 Å²	145.8	81%	0.813	76%	0.757	S	S	*	*			trans	-63.1	169.6	-175.5	-54.8	115.4	-36.4	0	0	114.1
515	S	35	Very low	32	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	75%	0.752	S	S	*	*			cis	-170.8	157.5	36	63.4	0	0	0	0	115.7
516	N	34.3	Very low	32	Very low	142 Å²	142	143.8 Å²	143.8	76%	0.759	75%	0.749	S	S	*	*			trans	52.3	141.9	141.8	-60	-4.7	0	0	0	122.5
517	T	33.2	Very low	31.8	Very low	113 Å²	113	144.4 Å²	144.4	69%	0.693	75%	0.745	S	S	*	*			cis	-165.7	140.9	-17.4	20.4	0	0	0	0	111.3
518	S	33	Very low	31.8	Very low	95 Å²	95	145.9 Å²	145.9	66%	0.664	74%	0.743	S	S	*	*			trans	56.8	111.5	135.3	-57.5	0	0	0	0	123.9
519	R	32.2	Very low	31.6	Very low	226 Å²	226	144 Å²	144	85%	0.853	74%	0.739	S	S	*	*				97.2	139.2	113.3	-78.6	-179.4	170.4	-168.1	-2.7	123.5
520	L	30.8	Very low	31.8	Very low	141 Å²	141	148 Å²	148	74%	0.738	75%	0.746	S	S	*	*			trans	74.7	79.3	145.3	-92.9	68.3	0	0	0	121.8
521	S	29.1	Very low	31.6	Very low	97 Å²	97	147.7 Å²	147.7	68%	0.678	74%	0.744	S	S	*	*				35.9	150.5	108	69.6	0	0	0	0	123.7
522	I	32.5	Very low	31.4	Very low	145 Å²	145	151 Å²	151	74%	0.744	75%	0.753	S	S	*	*			trans	109.6	98.8	155.4	-57.5	176.8	0	0	0	116.5
523	Q	30.1	Very low	31.2	Very low	163 Å²	163	148.4 Å²	148.4	76%	0.762	75%	0.748	S	S	*	*			trans	27.6	118.1	136.8	-51.6	173.6	-14.7	0	0	119.9
524	K	32	Very low	30.9	Very low	193 Å²	193	147.1 Å²	147.1	84%	0.839	76%	0.757	S	S	*	*				-175.8	172.4	101	-99.7	169	-173.4	173.9	0	114.3
525	L	30.3	Very low	30.7	Very low	152 Å²	152	147 Å²	147	80%	0.796	76%	0.757	S	S	*	*			trans	-39.4	131.9	-174	-83.1	61.3	0	0	0	118.7
526	K	27.4	Very low	30.5	Very low	174 Å²	174	151.4 Å²	151.4	76%	0.757	77%	0.766	S	S	*	*				55.7	133	113.2	-116.9	176.6	-175.9	-179.7	0	120.7
527	Y	27.1	Very low	30.4	Very low	199 Å²	199	153.3 Å²	153.3	78%	0.78	77%	0.77	S	S	*	*			trans	93.6	148.4	158	-80.8	-76.4	0	0	0	121.4
528	H	32.5	Very low	30.2	Very low	156 Å²	156	155.4 Å²	155.4	72%	0.722	77%	0.772	S	S	*	*			trans	69.1	87	170.8	-80.6	-68.1	0	0	0	121.5
529	T	29.2	Very low	30.1	Very low	113 Å²	113	160.1 Å²	160.1	69%	0.693	78%	0.783	S	S	*	*				31.5	129.5	114.7	66.4	0	0	0	0	118.2
530	K	31.3	Very low	30	Very low	180 Å²	180	156.2 Å²	156.2	78%	0.783	77%	0.774	S	S	*	*				-175.9	156.6	67.6	-122.4	172.3	-174.3	174.9	0	110.4
531	N	30	Very low	29.9	Very low	142 Å²	142	157.9 Å²	157.9	76%	0.759	78%	0.778	S	S	*	*			trans	58.2	130.1	158.9	-55.2	-2.4	0	0	0	116.7
532	L	29.9	Very low	30.1	Very low	165 Å²	165	162.3 Å²	162.3	86%	0.864	79%	0.787	S	S	*	*				-155.4	146.8	57.3	-161.5	69.3	0	0	0	113.3
533	S	29.9	Very low	29.8	Very low	97 Å²	97	164.9 Å²	164.9	68%	0.678	79%	0.789	S	S	*	*			trans	10.3	114.8	160.3	-173.9	0	0	0	0	120.6
534	C	27.5	Very low	29.8	Very low	126 Å²	126	162.6 Å²	162.6	85%	0.851	78%	0.781	S	S	*	*				-155.3	153.1	107.2	-115.9	0	0	0	0	111.1
535	H	28.5	Very low	29.8	Very low	173 Å²	173	160.9 Å²	160.9	80%	0.801	78%	0.78	S	S	*	*			trans	-79.1	124.9	-167.7	-99.3	-115.9	0	0	0	114
536	H	30.8	Very low	29.7	Very low	188 Å²	188	163.8 Å²	163.8	87%	0.87	79%	0.787	S	S	*	*			trans	-151.1	137.8	140.5	-108.7	-74.3	0	0	0	109.5
537	Q	30.9	Very low	29.9	Very low	182 Å²	182	163 Å²	163	85%	0.85	78%	0.783	S	S	*	*			trans	-78.8	131	-174.6	-72.7	168.8	-73	0	0	111.9
538	H	29.2	Very low	30.2	Very low	156 Å²	156	156.9 Å²	156.9	72%	0.722	77%	0.77	S	S	*	*			trans	-71	141.1	165.1	-91.2	-116.4	0	0	0	110.9
539	H	30.3	Very low	30.4	Very low	194 Å²	194	156.2 Å²	156.2	90%	0.898	78%	0.777	S	S	*	*			trans	-134.9	137.5	140.4	-119	-91.9	0	0	0	109.2
540	H	31.7	Very low	30.7	Very low	144 Å²	144	158.7 Å²	158.7	67%	0.667	79%	0.785	S	S	*	*			trans	-78.5	149.4	-172.7	-105.4	-110.6	0	0	0	112.9
541	H	28	Very low	31	Very low	176 Å²	176	158 Å²	158	82%	0.815	78%	0.777	S	S	*	*			trans	20.4	105.1	151.9	-90.5	-110.8	0	0	0	116.7
542	H	32.4	Very low	31.5	Very low	191 Å²	191	157.3 Å²	157.3	88%	0.884	77%	0.774	S	S	*	*			trans	-133.7	147.5	157.4	-131.3	-97.7	0	0	0	113.9
543	Y	27.8	Very low	31.8	Very low	199 Å²	199	156.5 Å²	156.5	78%	0.78	77%	0.769	S	S	*	*			trans	-68.3	159.5	-174.8	-134.5	-133.9	0	0	0	112.3
544	I	29.8	Very low	32.1	Very low	114 Å²	114	161.6 Å²	161.6	59%	0.585	78%	0.78	S	S	*	*			trans	72.5	103.4	161.5	-50.9	152.2	0	0	0	116.6	K547	I544-K547 HydrophobicContact CG2-CB 3.76Å
545	L	30.6	Very low	32.6	Very low	158 Å²	158	160.5 Å²	160.5	83%	0.827	77%	0.769	S	S	*	*	S	Bend	trans	-146.4	47.6	159.1	-122.6	171.4	0	0	0	114.7
546	F	29.7	Very low	32.8	Very low	213 Å²	213	160.4 Å²	160.4	93%	0.934	77%	0.774	S	S	*	*	S	Bend	trans	-142.8	32	160.3	-147.2	-97.2	0	0	0	112.2
547	K	31.2	Very low	32.9	Very low	157 Å²	157	156.5 Å²	156.5	68%	0.683	77%	0.768	S	S	*	*			trans	-139.6	45.2	-171.3	-154.9	176.7	-176.1	177.1	0	113.1	I544 R551	I544-K547 HydrophobicContact CG2-CB 3.76Å; K547-R551 PolarHBondContact O-NH1 3.05Å
548	S	33.5	Very low	33.1	Very low	71 Å²	71	159 Å²	159	50%	0.497	77%	0.769	S	S	.	*			trans	-144.3	31.3	-170.9	54.5	0	0	0	0	115.7
549	T	35.9	Very low	33.4	Very low	141 Å²	141	159.4 Å²	159.4	87%	0.865	78%	0.775	S	S	*	*	S	Bend	trans	-131	8	171.5	-13.5	0	0	0	0	114.1
550	L	36.3	Very low	33.6	Very low	166 Å²	166	157.8 Å²	157.8	87%	0.869	77%	0.768	S	S	*	*	S	Bend	trans	-130.6	9.8	178.7	-93.7	164.2	0	0	0	113.1
551	R	36.5	Very low	33.7	Very low	164 Å²	164	157.3 Å²	157.3	62%	0.619	78%	0.775	S	S	*	*	S	Bend	trans	-110.8	15.1	-174.9	-150.6	178.3	68.6	-120.3	4.9	114.2	K547	K547-R551 PolarHBondContact O-NH1 3.05Å
552	N	40.8	Very low	33.8	Very low	129 Å²	129	155.3 Å²	155.3	69%	0.69	78%	0.78	S	S	*	*	S	Bend	trans	-114.4	17	-175.5	-68.9	16.4	0	0	0	113.5
553	L	37.3	Very low	33.8	Very low	147 Å²	147	152.9 Å²	152.9	77%	0.77	77%	0.773	S	S	*	*	S	Bend	trans	-101.3	-0.7	176.1	-85	166.5	0	0	0	114.2
554	F	35.4	Very low	34	Very low	204 Å²	204	149.9 Å²	149.9	90%	0.895	77%	0.77	S	S	*	*	S	Bend	trans	-137.4	36.8	-174.5	-83	-77.2	0	0	0	113.5
555	T	38.2	Very low	34.1	Very low	104 Å²	104	151 Å²	151	64%	0.638	78%	0.777	S	S	*	*			trans	-133.1	58	-175.9	41.3	0	0	0	0	113.9	S557	T555-S557 PolarHBondContact O-N 3.06Å
556	L	33.4	Very low	34.2	Very low	171 Å²	171	149.9 Å²	149.9	90%	0.895	77%	0.772	S	S	*	*			trans	-89.9	85.1	161.4	-74.3	177.6	0	0	0	110.5	W558	L556-W558 PolarHBondContact O-N 3.06Å
557	S	31.9	Very low	34.3	Very low	106 Å²	106	147.4 Å²	147.4	74%	0.741	76%	0.763	S	S	*	*			trans	-80.7	105.7	175.4	-174.6	0	0	0	0	110.9	T555	T555-S557 PolarHBondContact O-N 3.06Å
558	W	34.5	Very low	34.3	Very low	233 Å²	233	143.8 Å²	143.8	88%	0.883	76%	0.757	S	S	*	*			trans	-144.5	7.1	179.6	-111.2	78.9	0	0	0	115.4	L556	L556-W558 PolarHBondContact O-N 3.06Å
559	I	35.6	Very low	34.2	Very low	165 Å²	165	147.8 Å²	147.8	85%	0.846	77%	0.773	S	S	*	*			trans	-135.3	67	-175.7	-43.8	-179.4	0	0	0	111.2
560	H	35.9	Very low	33.9	Very low	161 Å²	161	146.2 Å²	146.2	75%	0.745	76%	0.763	S	S	*	*	S	Bend	trans	-142.6	24.5	168.1	-149.4	-71.4	0	0	0	113.5
561	T	33.8	Very low	33.5	Very low	133 Å²	133	148.4 Å²	148.4	82%	0.816	76%	0.761	S	S	*	*			trans	-127.6	27.5	-170.9	-29.6	0	0	0	0	113.1
562	C	30.1	Very low	33	Very low	135 Å²	135	147.8 Å²	147.8	91%	0.912	77%	0.77	S	S	*	*			trans	-124.4	36.4	173.3	-67.5	0	0	0	0	112.5
563	L	32.2	Very low	32.6	Very low	140 Å²	140	146.3 Å²	146.3	73%	0.733	77%	0.77	S	S	*	*			trans	-69.4	150.3	151.4	-86.2	163.5	0	0	0	108.7
564	N	31.5	Very low	32.3	Very low	135 Å²	135	143.6 Å²	143.6	72%	0.722	76%	0.764	S	S	*	*			trans	62.5	95	178	-56.1	-11.9	0	0	0	115.7
565	N	32.6	Very low	32	Very low	138 Å²	138	140.2 Å²	140.2	74%	0.738	76%	0.76	S	S	*	*				175.3	147.1	95.4	-85.5	-41.2	0	0	0	112.9
566	N	31.8	Very low	31.8	Very low	134 Å²	134	140.8 Å²	140.8	72%	0.717	77%	0.768	S	S	*	*			trans	34.4	124.3	139.3	-52.2	-16.9	0	0	0	118.3
567	H	32.6	Very low	31.6	Very low	162 Å²	162	140.1 Å²	140.1	75%	0.75	77%	0.765	S	S	*	*			cis	-156.8	142.9	30.3	-110	-168.5	0	0	0	108.7
568	S	31.1	Very low	31.6	Very low	80 Å²	80	143.1 Å²	143.1	56%	0.559	77%	0.773	S	S	*	*				61.2	119.6	83.2	-38.9	0	0	0	0	115.8
569	N	29.7	Very low	31.4	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	76%	0.761	S	S	*	*			trans	72.7	150.9	149.1	-62.2	-11.2	0	0	0	117.8
570	V	30.4	Very low	31.2	Very low	109 Å²	109	135 Å²	135	66%	0.661	76%	0.756	S	S	*	*			cis	-156.2	133	4.4	111.3	0	0	0	0	111.5
571	Y	27.3	Very low	30.9	Very low	211 Å²	211	138 Å²	138	83%	0.827	76%	0.762	S	S	*	*			trans	64.8	143.5	147.6	-73.8	-126.2	0	0	0	124.6
572	N	26.6	Very low	30.7	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	76%	0.763	S	S	*	*			trans	-51	172	154.2	-50.2	-29.2	0	0	0	112.1
573	S	32.4	Very low	30.7	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	76%	0.76	S	S	*	*			cis	-170.3	153	37.6	57.8	0	0	0	0	115.8
574	S	30.5	Very low	30.6	Very low	90 Å²	90	140.2 Å²	140.2	63%	0.629	76%	0.759	S	S	*	*			trans	59.7	117.9	135.3	67.8	0	0	0	0	122.6
575	T	30.1	Very low	30.4	Very low	132 Å²	132	140.7 Å²	140.7	81%	0.81	76%	0.762	S	S	*	*				62	116.3	129.8	61.5	0	0	0	0	121.5
576	S	32.6	Very low	30.3	Very low	117 Å²	117	143.7 Å²	143.7	82%	0.818	77%	0.774	S	S	*	*				-141.7	148.8	126.1	58	0	0	0	0	109.3
577	N	30.9	Very low	30.1	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	77%	0.77	S	S	*	*			trans	-62.8	144.4	-175.9	-52.5	-17.6	0	0	0	112.3
578	D	31.7	Very low	29.9	Very low	169 Å²	169	143 Å²	143	90%	0.904	78%	0.777	S	S	*	*			trans	-140.2	137.4	142.2	-102.6	-41.8	0	0	0	108.5
579	S	30.6	Very low	29.7	Very low	90 Å²	90	144.7 Å²	144.7	63%	0.629	79%	0.787	S	S	*	*			trans	-96.7	176	178.2	61.4	0	0	0	0	111.1
580	N	31	Very low	29.7	Very low	139 Å²	139	147.7 Å²	147.7	74%	0.743	79%	0.788	S	S	*	*			trans	77.6	87	169.6	-40.2	-27.9	0	0	0	115.7
581	Y	29.3	Very low	29.5	Very low	223 Å²	223	146.4 Å²	146.4	88%	0.875	80%	0.797	S	S	*	*			trans	-152.8	82.7	136.7	-98.4	-64	0	0	0	110
582	S	30	Very low	29.7	Very low	119 Å²	119	143 Å²	143	83%	0.832	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.8	122	167.6	49.5	0	0	0	0	110
583	W	29.2	Very low	29.8	Very low	224 Å²	224	138.5 Å²	138.5	85%	0.848	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-93.5	150	163	-78	73	0	0	0	109.6
584	P	30.7	Very low	29.7	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.5	154.1	-166.9	-17	32.3	0	0	0	113.5	M586	P584-M586 PolarHBondContact O-N 3Å
585	N	27.6	Very low	30	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-60.7	126.1	162.7	-82.6	-1	0	0	0	109.6	S587	N585-S587 VanDerWaalsContact C-N 3.27Å; N585-S587 PolarHBondContact O-N 3.47Å
586	M	29.1	Very low	30.3	Very low	201 Å²	201	141.4 Å²	141.4	99%	0.99	77%	0.773	S	S	*	*			trans	-92.9	62.7	168.8	-168.7	168.8	175.2	0	0	109	P584	P584-M586 PolarHBondContact O-N 3Å
587	S	29	Very low	30.4	Very low	89 Å²	89	141.4 Å²	141.4	62%	0.622	76%	0.762	S	S	*	*			trans	-135.8	40.2	-173.1	70.5	0	0	0	0	112.4	N585	N585-S587 VanDerWaalsContact C-N 3.27Å; N585-S587 PolarHBondContact O-N 3.47Å
588	E	27.7	Very low	30.6	Very low	193 Å²	193	139 Å²	139	90%	0.902	75%	0.753	S	S	*	*			trans	-154.9	78.3	-179.6	-135.2	167.5	-137.1	0	0	110.7
589	C	27.6	Very low	30.8	Very low	114 Å²	114	135.8 Å²	135.8	77%	0.77	74%	0.736	S	S	*	*	S	Bend	trans	-161.4	135.4	165.2	-136.1	0	0	0	0	108.9
590	Y	29.7	Very low	31.1	Very low	219 Å²	219	139.2 Å²	139.2	86%	0.859	74%	0.742	S	S	*	*			trans	62.1	75.2	-169.3	-63.2	-77.8	0	0	0	114.9
591	G	26.2	Very low	31	Very low	82 Å²	82	138 Å²	138	85%	0.845	74%	0.743	S	S	*	*			trans	-75	124.2	151.2	0	0	0	0	0	109.9
592	L	30.3	Very low	31.3	Very low	140 Å²	140	134.7 Å²	134.7	73%	0.733	74%	0.74	S	S	*	*			trans	-129.9	146.1	158.5	-84.1	169.5	0	0	0	107.4
593	S	29.2	Very low	31.5	Very low	56 Å²	56	135.7 Å²	135.7	39%	0.392	73%	0.729	S	S	.	*			trans	-57.2	134	-173.8	-27	0	0	0	0	111.2	D595 E596	S593-D595 PolarHBondContact O-N 2.64Å; S593-D595 VanDerWaalsContact O-N 3.17Å; S593-E596 VanDerWaalsContact CB-OE2 3.31Å; S593-E596 WeakPolarHBondContact CB-OE2 3.43Å; S593-E596 PolarHBondContact OG-OE2 3.14Å
594	S	31.2	Very low	31.7	Very low	107 Å²	107	132.2 Å²	132.2	75%	0.748	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-7.7	175.3	-59.4	0	0	0	0	113.5
595	D	36.2	Very low	31.7	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-4.1	-172.2	-48.3	-59.4	0	0	0	114	S593	S593-D595 PolarHBondContact O-N 2.64Å; S593-D595 VanDerWaalsContact O-N 3.17Å
596	E	36.7	Very low	31.8	Very low	132 Å²	132	135.6 Å²	135.6	62%	0.617	73%	0.73	S	S	*	*	S	Bend	trans	-105.8	-9.8	-178	-73	175.6	109.4	0	0	114.1	S593	S593-E596 VanDerWaalsContact CB-OE2 3.31Å; S593-E596 WeakPolarHBondContact CB-OE2 3.43Å; S593-E596 PolarHBondContact OG-OE2 3.14Å
597	I	34.9	Very low	32	Very low	117 Å²	117	132.3 Å²	132.3	60%	0.6	72%	0.716	S	S	*	*	S	Bend	trans	-85.9	-21.3	-173.9	-64.3	176.9	0	0	0	112.2
598	T	34.9	Very low	32.5	Very low	105 Å²	105	136.7 Å²	136.7	64%	0.644	73%	0.727	S	S	*	*	S	Bend	trans	-73.4	-31.9	-177.5	26.8	0	0	0	0	114.7
599	D	36	Very low	33	Very low	101 Å²	101	133.6 Å²	133.6	54%	0.54	72%	0.716	S	S	.	*	G	3₁₀ helix	trans	-82.2	-19.1	-177.4	-160.7	60.5	0	0	0	113.3	K603	D599-K603 IonicContact OD1-NZ 3.94Å; D599-K603 IonicContact OD2-NZ 2.82Å; D599-K603 PolarHBondContact OD2-NZ 2.93Å
600	H	36.8	Very low	33.7	Very low	162 Å²	162	136 Å²	136	75%	0.75	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-87.3	-4.5	-173.7	-148	-53.2	0	0	0	114.2
601	C	29.6	Very low	34.1	Very low	115 Å²	115	131.8 Å²	131.8	78%	0.777	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-101.5	-1.5	178.8	-80.5	0	0	0	0	115
602	L	35.1	Very low	34.9	Very low	152 Å²	152	136.8 Å²	136.8	80%	0.796	72%	0.715	S	S	*	*	S	Bend	trans	-110.5	10.9	-173.9	-84.8	164.2	0	0	0	114.9
603	K	33.1	Very low	35.6	Very low	141 Å²	141	136.5 Å²	136.5	61%	0.613	72%	0.715	S	S	*	*			trans	-120.6	13.1	-161.2	-117	164.2	-164.7	149.3	0	117.6	D599	D599-K603 IonicContact OD1-NZ 3.94Å; D599-K603 IonicContact OD2-NZ 2.82Å; D599-K603 PolarHBondContact OD2-NZ 2.93Å
604	N	33.4	Very low	36.4	Very low	151 Å²	151	140.9 Å²	140.9	81%	0.807	73%	0.734	S	S	*	*	S	Bend	trans	-123.6	45	-177	-74.9	-9.5	0	0	0	113.1
605	Y	30.7	Very low	37.3	Very low	240 Å²	240	142.9 Å²	142.9	94%	0.941	74%	0.736	S	S	*	*	S	Bend	trans	-151	57.2	172.3	-98.4	-66.6	0	0	0	112.6
606	S	30	Very low	38.1	Very low	88 Å²	88	141.6 Å²	141.6	62%	0.615	73%	0.733	S	S	*	*			trans	-150.2	164.8	162.7	62.9	0	0	0	0	110.3
607	D	34.7	Very low	38.8	Very low	131 Å²	131	141.7 Å²	141.7	70%	0.701	74%	0.738	S	S	*	*			trans	64.9	92.9	159.7	-38.4	-42.9	0	0	0	117.6
608	Q	38.7	Very low	39.6	Very low	181 Å²	181	143 Å²	143	85%	0.846	75%	0.746	S	S	*	*				-168.9	104.9	102.8	-101.7	173.5	-7.8	0	0	112.7
609	D	37.4	Very low	40.5	Very low	128 Å²	128	144.7 Å²	144.7	68%	0.684	75%	0.751	S	S	*	*			trans	22.1	126.5	132.7	-39.4	-29.3	0	0	0	119.4
610	D	42.8	Very low	41.3	Very low	165 Å²	165	146.3 Å²	146.3	88%	0.882	76%	0.76	S	S	*	*				-153.3	151.8	112.8	-105.5	-32.5	0	0	0	109.2
611	N	38	Very low	42.2	Very low	131 Å²	131	144.7 Å²	144.7	70%	0.701	76%	0.757	S	S	*	*			trans	-101	157.9	-166.1	-52.3	-91.9	0	0	0	112.5
612	E	43.3	Very low	43.2	Very low	186 Å²	186	145.4 Å²	145.4	87%	0.869	75%	0.753	S	S	*	*			trans	179	96.6	133.2	-99.4	168.1	-161	0	0	110.7
613	D	44.9	Very low	44	Very low	134 Å²	134	145 Å²	145	72%	0.717	75%	0.751	S	S	*	*			trans	23.1	132.3	137	-44.4	-23.2	0	0	0	121.5
614	D	46.8	Very low	44.9	Very low	148 Å²	148	145.6 Å²	145.6	79%	0.791	76%	0.761	S	S	*	*				172.2	104.3	116.6	-89.9	-7.1	0	0	0	113.4
615	D	50.2	Low	45.6	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	76%	0.755	S	S	*	*			trans	57.6	152.1	134	-63.7	-3.3	0	0	0	127
616	V	52.6	Low	46.5	Very low	116 Å²	116	139.1 Å²	139.1	70%	0.703	75%	0.752	S	S	*	*			trans	86	86	158.9	-157.1	0	0	0	0	119.9
617	D	50.5	Low	47.2	Very low	134 Å²	134	141.5 Å²	141.5	72%	0.717	76%	0.757	S	S	*	*				42.2	130.3	108.2	-38.6	-30.1	0	0	0	121.3
618	D	53.2	Low	47.6	Very low	145 Å²	145	144.5 Å²	144.5	78%	0.775	77%	0.767	S	S	*	*				172.2	95.1	113.6	-89.2	-8.1	0	0	0	111.5
619	D	52.2	Low	47.6	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	77%	0.772	S	S	*	*				59.7	149.6	123.9	-67.3	0.8	0	0	0	126.3
620	D	54.4	Low	47.8	Very low	135 Å²	135	147.8 Å²	147.8	72%	0.722	78%	0.784	S	S	*	*			trans	86.2	109.6	149.4	-63.5	-7.2	0	0	0	124.5
621	D	54	Low	47.6	Very low	128 Å²	128	143.1 Å²	143.1	68%	0.684	78%	0.775	S	S	*	*				96.9	107.9	124.7	-64.3	-0	0	0	0	124.3
622	D	52.4	Low	47.6	Very low	129 Å²	129	143.5 Å²	143.5	69%	0.69	78%	0.777	S	S	*	*				79.6	113.9	125.9	-65.8	1.2	0	0	0	124.3
623	D	51.1	Low	47.4	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	78%	0.776	S	S	*	*				47	120.9	128	-61.7	-7.8	0	0	0	121.2
624	D	51.8	Low	47.2	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	77%	0.769	S	S	*	*				-173.5	160.2	73.2	-139.7	-23.7	0	0	0	113.2
625	V	47.6	Very low	46.9	Very low	112 Å²	112	143.6 Å²	143.6	68%	0.679	77%	0.773	S	S	*	*			trans	-84.1	133.5	-164	176.6	0	0	0	0	115.6
626	V	50.1	Low	46.9	Very low	144 Å²	144	144.8 Å²	144.8	87%	0.873	77%	0.768	S	S	*	*			trans	-147.4	124.4	144.4	-167.9	0	0	0	0	110.7
627	D	44.7	Very low	46.7	Very low	137 Å²	137	144 Å²	144	73%	0.733	77%	0.767	S	S	*	*			trans	-84.4	138.9	168.7	-54.3	-82.2	0	0	0	111.7
628	E	43.2	Very low	46.7	Very low	195 Å²	195	141 Å²	141	91%	0.911	76%	0.757	S	S	*	*			trans	168.3	80	144.4	-96.7	175.9	-153.7	0	0	111.4
629	D	38.6	Very low	46.4	Very low	176 Å²	176	135.1 Å²	135.1	94%	0.941	73%	0.727	S	S	*	*			trans	-111.7	84.1	173.4	-100.1	-36.7	0	0	0	111.5
630	E	42	Very low	46.5	Very low	202 Å²	202	138.5 Å²	138.5	94%	0.944	74%	0.735	S	S	*	*			trans	-125.9	123.2	165.8	-77.3	-162.8	171.7	0	0	111
631	G	38.9	Very low	46.3	Very low	67 Å²	67	136.1 Å²	136.1	69%	0.691	73%	0.728	S	S	*	*			trans	131.9	61.7	168.4	0	0	0	0	0	116.3	D633	G631-D633 PolarHBondContact O-N 3.42Å; G631-D633 VanDerWaalsContact O-N 3.12Å
632	N	37	Very low	46.8	Very low	139 Å²	139	131.8 Å²	131.8	74%	0.743	71%	0.707	S	S	*	*			trans	-81.2	90.2	172.9	-149.9	-13.9	0	0	0	110.3	H634	N632-H634 PolarHBondContact O-N 3.41Å
633	D	39.5	Very low	47.1	Very low	157 Å²	157	133.4 Å²	133.4	84%	0.84	71%	0.711	S	S	*	*			trans	-67.2	84.3	-174.5	-88.3	-28.1	0	0	0	113.1	G631 E635	G631-D633 PolarHBondContact O-N 3.42Å; G631-D633 VanDerWaalsContact O-N 3.12Å; D633-E635 PolarHBondContact O-N 3.02Å
634	H	41.2	Very low	47.5	Very low	125 Å²	125	131.1 Å²	131.1	58%	0.579	70%	0.695	S	S	*	*			trans	-74.4	101.5	169.7	-69	-38.3	0	0	0	111.4	N632 Y636	N632-H634 PolarHBondContact O-N 3.41Å; H634-Y636 WeakPolarHBondContact O-CD2 3.5Å; H634-Y636 PolarHBondContact O-N 3.44Å
635	E	40.5	Very low	47.3	Very low	188 Å²	188	127 Å²	127	88%	0.879	68%	0.678	S	S	*	*			trans	-67.9	93.4	-178.4	-167.5	-178	177.7	0	0	112.7	D633 S637	D633-E635 PolarHBondContact O-N 3.02Å; E635-S637 PolarHBondContact O-N 3.2Å
636	Y	49.4	Very low	47.2	Very low	175 Å²	175	128.4 Å²	128.4	69%	0.686	68%	0.681	S	S	*	*			trans	-65.8	91	176.7	-75	-89.3	0	0	0	112.9	H634 S638	H634-Y636 WeakPolarHBondContact O-CD2 3.5Å; H634-Y636 PolarHBondContact O-N 3.44Å; Y636-S638 PolarHBondContact O-N 2.66Å
637	S	48	Very low	46.7	Very low	99 Å²	99	124 Å²	124	69%	0.692	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-70.1	128.5	172.7	82.4	0	0	0	0	111.9	E635	E635-S637 PolarHBondContact O-N 3.2Å
638	S	51.1	Low	46.5	Very low	72 Å²	72	126.3 Å²	126.3	50%	0.503	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-82.1	140.3	179.8	59.8	0	0	0	0	112.4	Y636 K640	Y636-S638 PolarHBondContact O-N 2.66Å; S638-K640 PolarHBondContact O-N 2.94Å
639	C	47.1	Very low	46	Very low	20 Å²	20	122.3 Å²	122.3	14%	0.135	66%	0.656	C	S	.	*	P	Polyproline II helix	trans	-67.6	119.1	-177.8	-176.1	0	0	0	0	111.8	C641 C642 Q643 H644 C657	C639-C641 PolarHBondContact O-N 3.32Å; C639-C642 PolarHBondContact O-N 2.7Å; C639-C642 VanDerWaalsContact O-N 3.09Å; C639-Q643 WeakPolarHBondContact O-CA 3.32Å; C639-Q643 PolarHBondContact O-N 2.88Å; C639-H644 PolarHBondContact N-O 2.84Å; C639-C657 HydrophobicContact CB-CB 4.08Å; C639-C657 WeakPolarHBondContact SG-CB 3.22Å
640	K	53.1	Low	45.7	Very low	212 Å²	212	118.6 Å²	118.6	92%	0.922	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-19.2	-178.3	-73.7	175.1	179	165.1	0	115.3	S638	S638-K640 PolarHBondContact O-N 2.94Å
641	C	50.2	Low	45.4	Very low	84 Å²	84	117 Å²	117	57%	0.568	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-25.8	178.4	-66	0	0	0	0	114.2	C639 C660	C639-C641 PolarHBondContact O-N 3.32Å; C641-C660 HydrophobicContact CB-CB 4.46Å
642	C	65.8	Low	45.1	Very low	37 Å²	37	123 Å²	123	25%	0.25	64%	0.644	C	S	.	*	T	Hydrogen-bonded Turn	trans	-150.7	2.6	-163.5	40.3	0	0	0	0	115	C639 H644 C660	C639-C642 PolarHBondContact O-N 2.7Å; C639-C642 VanDerWaalsContact O-N 3.09Å; C642-H644 PolarHBondContact O-N 3.33Å; C642-C660 HydrophobicContact CB-CB 4.3Å; C642-C660 WeakPolarHBondContact CB-SG 3.38Å; C642-C660 WeakPolarHBondContact SG-CB 3.23Å; C642-C660 CovalentContact SG-SG 2.04Å; C642-C660 PolarHBondContact SG-SG 2.95Å
643	Q	58.5	Low	45	Very low	164 Å²	164	125 Å²	125	77%	0.766	65%	0.649	S	S	*	*			trans	53.4	7.2	171.2	-65.3	-171.2	-32.6	0	0	117.8	C639	C639-Q643 WeakPolarHBondContact O-CA 3.32Å; C639-Q643 PolarHBondContact O-N 2.88Å
644	H	58.5	Low	44.9	Very low	94 Å²	94	120.8 Å²	120.8	44%	0.435	63%	0.632	S	S	.	*			trans	-66.5	147.4	168.9	-93	59.4	0	0	0	112	C639 C642	C639-H644 PolarHBondContact N-O 2.84Å; C642-H644 PolarHBondContact O-N 3.33Å
645	S	47.9	Very low	44.9	Very low	67 Å²	67	124.9 Å²	124.9	47%	0.469	64%	0.644	S	S	.	*			trans	-98.6	-8.6	-178.2	47.8	0	0	0	0	114.2	C647	S645-C647 VanDerWaalsContact C-N 3.35Å; S645-C647 PolarHBondContact O-N 2.89Å
646	L	46.3	Very low	45.2	Very low	142 Å²	142	120.8 Å²	120.8	74%	0.743	63%	0.625	S	S	*	*			trans	-91.4	55.3	-172.2	-65.5	169.9	0	0	0	112.5
647	C	39.3	Very low	45	Very low	53 Å²	53	112.8 Å²	112.8	36%	0.358	60%	0.595	S	S	.	*			trans	-127.5	110.2	173.8	-73.3	0	0	0	0	109.7	S645 C657	S645-C647 VanDerWaalsContact C-N 3.35Å; S645-C647 PolarHBondContact O-N 2.89Å; C647-C657 PolarHBondContact SG-SG 2.91Å
648	Q	41	Very low	45.2	Very low	185 Å²	185	112.8 Å²	112.8	86%	0.864	60%	0.595	S	S	*	*			trans	-69.8	136.9	-175.7	-166.3	168.4	-1.6	0	0	111.3	S650	Q648-S650 PolarHBondContact O-N 3.11Å; Q648-S650 VanDerWaalsContact O-N 3.17Å
649	S	33.2	Very low	45.3	Very low	110 Å²	110	115.4 Å²	115.4	77%	0.769	60%	0.599	S	S	*	*	S	Bend	trans	-82.5	89.5	-170.6	51.6	0	0	0	0	112.7
650	S	32	Very low	45.5	Very low	99 Å²	99	114.7 Å²	114.7	69%	0.692	59%	0.594	S	S	*	*			trans	-144.9	26.8	173.9	56.6	0	0	0	0	114.7	Q648	Q648-S650 PolarHBondContact O-N 3.11Å; Q648-S650 VanDerWaalsContact O-N 3.17Å
651	F	35.2	Very low	45.4	Very low	169 Å²	169	107.3 Å²	107.3	74%	0.741	56%	0.562	S	S	*	*			trans	-140.7	87.6	171.5	-104.2	-84.5	0	0	0	112.5	Q653	F651-Q653 PolarHBondContact O-N 2.97Å
652	E	33.1	Very low	45.2	Very low	191 Å²	191	106 Å²	106	89%	0.893	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	66.8	166.2	-70.8	-164.5	112.2	0	0	111.8
653	Q	34.6	Very low	44	Very low	182 Å²	182	110.1 Å²	110.1	85%	0.85	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	177.8	-10.3	153.9	-102	148.3	82.5	0	0	115.7	F651	F651-Q653 PolarHBondContact O-N 2.97Å
654	S	37	Very low	43.1	Very low	68 Å²	68	104.3 Å²	104.3	48%	0.476	54%	0.544	S	S	.	.			trans	-87.4	141.9	-179.4	62.8	0	0	0	0	112.8	E656	S654-E656 VanDerWaalsContact C-N 3.32Å
655	Y	41.9	Very low	42.2	Very low	211 Å²	211	103.8 Å²	103.8	83%	0.827	54%	0.543	S	S	*	.			trans	-91.8	12.3	-179.4	-72	-94.3	0	0	0	113.1
656	E	46.4	Very low	41.7	Very low	102 Å²	102	106.8 Å²	106.8	48%	0.477	55%	0.55	S	S	.	*			trans	-132.5	115.7	-147.4	-59.7	-174.8	171.2	0	0	112.4	S654 H661 I664	S654-E656 VanDerWaalsContact C-N 3.32Å; E656-H661 IonicContact OE2-CD2 3.71Å; E656-I664 HydrophobicContact CG-CD1 4.19Å
657	C	45.7	Very low	41.2	Very low	8 Å²	8	107 Å²	107	5%	0.054	54%	0.542	C	S	.	.			trans	-82.5	138.8	172.1	165.2	0	0	0	0	110.2	C639 C647 Q659 C660 H661	C639-C657 HydrophobicContact CB-CB 4.08Å; C639-C657 WeakPolarHBondContact SG-CB 3.22Å; C647-C657 PolarHBondContact SG-SG 2.91Å; C657-Q659 VanDerWaalsContact C-N 3.31Å; C657-Q659 PolarHBondContact O-N 3.36Å; C657-C660 HydrophobicContact CB-CB 4.14Å; C657-C660 CarbonylContact O-C 3.53Å; C657-C660 WeakPolarHBondContact O-CA 3.14Å; C657-C660 PolarHBondContact O-N 3.09Å; C657-H661 PolarHBondContact O-N 3.32Å
658	S	51.7	Low	41.1	Very low	99 Å²	99	108.2 Å²	108.2	69%	0.692	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-40.4	179.6	54.9	0	0	0	0	113.9	C660 P662	S658-C660 PolarHBondContact O-N 3.4Å; S658-P662 WeakPolarHBondContact O-CD 3.35Å
659	Q	53.5	Low	40.9	Very low	126 Å²	126	103.1 Å²	103.1	59%	0.589	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.8	176.1	-63.5	-172.8	-4.9	0	0	113.5	C657	C657-Q659 VanDerWaalsContact C-N 3.31Å; C657-Q659 PolarHBondContact O-N 3.36Å
660	C	50.2	Low	41	Very low	5 Å²	5	102.4 Å²	102.4	3%	0.034	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-16	-167.8	-48.3	0	0	0	0	112.3	C641 C642 C657 S658 P662 M663 I664	C641-C660 HydrophobicContact CB-CB 4.46Å; C642-C660 HydrophobicContact CB-CB 4.3Å; C642-C660 WeakPolarHBondContact CB-SG 3.38Å; C642-C660 WeakPolarHBondContact SG-CB 3.23Å; C642-C660 CovalentContact SG-SG 2.04Å; C642-C660 PolarHBondContact SG-SG 2.95Å; C657-C660 HydrophobicContact CB-CB 4.14Å; C657-C660 CarbonylContact O-C 3.53Å; C657-C660 WeakPolarHBondContact O-CA 3.14Å; C657-C660 PolarHBondContact O-N 3.09Å; S658-C660 PolarHBondContact O-N 3.4Å; C660-P662 VanDerWaalsContact C-CD 3.47Å; C660-M663 PolarHBondContact O-N 3.47Å; C660-M663 VanDerWaalsContact O-N 3.08Å; C660-I664 PolarHBondContact O-N 3.12Å; C660-I664 VanDerWaalsContact O-N 3.16Å
661	H	50.5	Low	41.2	Very low	57 Å²	57	101.2 Å²	101.2	26%	0.264	49%	0.494	S	S	.	.	H	α-helix	trans	-49.4	-43.3	168.2	-177.4	-121.8	0	0	0	113.4	E656 C657 M663 I664 I665	E656-H661 IonicContact OE2-CD2 3.71Å; C657-H661 PolarHBondContact O-N 3.32Å; H661-M663 VanDerWaalsContact C-N 3.3Å; H661-M663 PolarHBondContact O-N 3.08Å; H661-I664 PolarHBondContact O-N 2.96Å; H661-I664 VanDerWaalsContact O-N 3.15Å; H661-I665 PolarHBondContact O-N 3.49Å
662	P	47.3	Very low	41.2	Very low	58 Å²	58	96.3 Å²	96.3	38%	0.377	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-31.3	176.2	-23.6	35.1	0	0	0	114.4	S658 C660 Q666	S658-P662 WeakPolarHBondContact O-CD 3.35Å; C660-P662 VanDerWaalsContact C-CD 3.47Å; P662-Q666 WeakPolarHBondContact O-CG 3.32Å
663	M	39.5	Very low	41.4	Very low	122 Å²	122	92.8 Å²	92.8	60%	0.601	47%	0.467	S	S	*	.	H	α-helix	trans	-76.9	-34.2	175.1	-83.1	-164.7	-79	0	0	112.3	C660 H661 Q666 Y667	C660-M663 PolarHBondContact O-N 3.47Å; C660-M663 VanDerWaalsContact O-N 3.08Å; H661-M663 VanDerWaalsContact C-N 3.3Å; H661-M663 PolarHBondContact O-N 3.08Å; M663-Q666 PolarHBondContact O-N 2.92Å; M663-Y667 WeakPolarHBondContact O-CB 3.1Å; M663-Y667 PolarHBondContact O-N 2.94Å
664	I	39.8	Very low	41.5	Very low	42 Å²	42	87.3 Å²	87.3	22%	0.215	44%	0.444	C	S	.	.	H	α-helix	trans	-66.4	-40	179.9	-66.6	169.3	0	0	0	110.9	E656 C660 H661 Q666 Y667 T668	E656-I664 HydrophobicContact CG-CD1 4.19Å; C660-I664 PolarHBondContact O-N 3.12Å; C660-I664 VanDerWaalsContact O-N 3.16Å; H661-I664 PolarHBondContact O-N 2.96Å; H661-I664 VanDerWaalsContact O-N 3.15Å; I664-Q666 PolarHBondContact O-N 3.36Å; I664-Y667 PolarHBondContact O-N 3.35Å; I664-T668 HydrophobicContact CG2-CG2 4.23Å; I664-T668 WeakPolarHBondContact O-CB 3.29Å; I664-T668 WeakPolarHBondContact O-CG2 3.35Å; I664-T668 PolarHBondContact O-N 2.96Å; I664-T668 PolarHBondContact O-OG1 2.87Å
665	I	40.6	Very low	41.6	Very low	83 Å²	83	90.7 Å²	90.7	43%	0.426	45%	0.45	S	S	.	.	H	α-helix	trans	-62.9	-41.2	175.4	-64.6	171.1	0	0	0	111.3	H661 T668 T669	H661-I665 PolarHBondContact O-N 3.49Å; I665-T668 PolarHBondContact O-OG1 2.76Å; I665-T669 WeakPolarHBondContact O-CG2 3.44Å; I665-T669 PolarHBondContact O-N 3.4Å; I665-T669 PolarHBondContact O-OG1 3.16Å
666	Q	37.5	Very low	41.5	Very low	130 Å²	130	87.3 Å²	87.3	61%	0.607	45%	0.447	S	S	*	.	H	α-helix	trans	-67.1	-39.2	175.2	-68.5	-179.4	10.5	0	0	112.1	P662 M663 I664 T669 Y670	P662-Q666 WeakPolarHBondContact O-CG 3.32Å; M663-Q666 PolarHBondContact O-N 2.92Å; I664-Q666 PolarHBondContact O-N 3.36Å; Q666-T669 PolarHBondContact O-OG1 3.28Å; Q666-T669 VanDerWaalsContact O-OG1 3.1Å; Q666-Y670 WeakPolarHBondContact O-CB 3.05Å; Q666-Y670 PolarHBondContact O-N 3.36Å; Q666-Y670 VanDerWaalsContact O-N 3.08Å
667	Y	34.8	Very low	41	Very low	147 Å²	147	85.6 Å²	85.6	58%	0.576	46%	0.456	S	S	*	.	H	α-helix	trans	-73.3	-37.3	-178.3	-156.2	-111.4	0	0	0	113.1	M663 I664 Q671	M663-Y667 WeakPolarHBondContact O-CB 3.1Å; M663-Y667 PolarHBondContact O-N 2.94Å; I664-Y667 PolarHBondContact O-N 3.35Å; Y667-Q671 VanDerWaalsContact CE1-NE2 3.3Å; Y667-Q671 PolarHBondContact O-N 3.34Å
668	T	37.4	Very low	40.4	Very low	79 Å²	79	92.3 Å²	92.3	49%	0.485	49%	0.485	S	S	.	.	H	α-helix	trans	-69.8	-44.4	178.1	49.1	0	0	0	0	112.1	I664 I665 Q671 S672	I664-T668 HydrophobicContact CG2-CG2 4.23Å; I664-T668 WeakPolarHBondContact O-CB 3.29Å; I664-T668 WeakPolarHBondContact O-CG2 3.35Å; I664-T668 PolarHBondContact O-N 2.96Å; I664-T668 PolarHBondContact O-OG1 2.87Å; I665-T668 PolarHBondContact O-OG1 2.76Å; T668-Q671 PolarHBondContact O-N 2.8Å; T668-S672 PolarHBondContact O-N 3.45Å
669	T	36.8	Very low	39.5	Very low	77 Å²	77	96.2 Å²	96.2	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-42	173.1	49.7	0	0	0	0	112	I665 Q666 Q671 S672 L673	I665-T669 WeakPolarHBondContact O-CG2 3.44Å; I665-T669 PolarHBondContact O-N 3.4Å; I665-T669 PolarHBondContact O-OG1 3.16Å; Q666-T669 PolarHBondContact O-OG1 3.28Å; Q666-T669 VanDerWaalsContact O-OG1 3.1Å; T669-Q671 PolarHBondContact O-N 2.89Å; T669-S672 WeakPolarHBondContact O-CB 3.33Å; T669-S672 PolarHBondContact O-N 3.23Å; T669-L673 PolarHBondContact O-N 3.49Å; T669-L673 VanDerWaalsContact O-N 3.13Å
670	Y	34.6	Very low	38.5	Very low	95 Å²	95	99.5 Å²	99.5	37%	0.373	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-35.6	175.7	-170.8	-104.8	0	0	0	113.5	Q666 N674	Q666-Y670 WeakPolarHBondContact O-CB 3.05Å; Q666-Y670 PolarHBondContact O-N 3.36Å; Q666-Y670 VanDerWaalsContact O-N 3.08Å; Y670-N674 WeakPolarHBondContact CE1-ND2 3.4Å; Y670-N674 VanDerWaalsContact CZ-ND2 3.33Å; Y670-N674 PolarHBondContact O-N 2.89Å; Y670-N674 PolarHBondContact O-ND2 3.48Å
671	Q	36.5	Very low	37.6	Very low	75 Å²	75	106.2 Å²	106.2	35%	0.35	54%	0.541	S	S	.	.	H	α-helix	trans	-69.8	-36.3	171.8	-79.5	-160	30	0	0	113.2	Y667 T668 T669 N674 K675	Y667-Q671 VanDerWaalsContact CE1-NE2 3.3Å; Y667-Q671 PolarHBondContact O-N 3.34Å; T668-Q671 PolarHBondContact O-N 2.8Å; T669-Q671 PolarHBondContact O-N 2.89Å; Q671-N674 PolarHBondContact O-N 3.2Å; Q671-K675 WeakPolarHBondContact O-CB 3.43Å; Q671-K675 WeakPolarHBondContact O-CG 3.45Å; Q671-K675 PolarHBondContact O-N 3.33Å
672	S	35.8	Very low	36.8	Very low	66 Å²	66	111 Å²	111	46%	0.462	57%	0.569	S	S	.	*	H	α-helix	trans	-59.9	-48.9	176.7	-176.8	0	0	0	0	111.3	T668 T669 K675 N676	T668-S672 PolarHBondContact O-N 3.45Å; T669-S672 WeakPolarHBondContact O-CB 3.33Å; T669-S672 PolarHBondContact O-N 3.23Å; S672-K675 PolarHBondContact O-N 2.75Å; S672-N676 PolarHBondContact O-ND2 2.89Å
673	L	36.7	Very low	36.2	Very low	116 Å²	116	116.5 Å²	116.5	61%	0.607	60%	0.595	S	S	*	*	H	α-helix	trans	-61	-46.6	177	-73.5	162.6	0	0	0	112.2	T669 N676 G677	T669-L673 PolarHBondContact O-N 3.49Å; T669-L673 VanDerWaalsContact O-N 3.13Å; L673-N676 PolarHBondContact O-N 3.48Å; L673-G677 PolarHBondContact O-N 3.46Å
674	N	37.8	Very low	35.8	Very low	68 Å²	68	113.9 Å²	113.9	36%	0.364	60%	0.599	S	S	.	*	H	α-helix	trans	-67.7	-37.2	-179	-83.7	-66.8	0	0	0	113.8	Y670 Q671 N676 G677 F678	Y670-N674 WeakPolarHBondContact CE1-ND2 3.4Å; Y670-N674 VanDerWaalsContact CZ-ND2 3.33Å; Y670-N674 PolarHBondContact O-N 2.89Å; Y670-N674 PolarHBondContact O-ND2 3.48Å; Q671-N674 PolarHBondContact O-N 3.2Å; N674-N676 VanDerWaalsContact C-N 3.27Å; N674-N676 PolarHBondContact O-N 3Å; N674-G677 PolarHBondContact O-N 3.2Å; N674-F678 PolarHBondContact O-N 3.13Å; N674-F678 VanDerWaalsContact O-N 3.14Å
675	K	39.6	Very low	35.4	Very low	139 Å²	139	122.6 Å²	122.6	60%	0.604	64%	0.636	S	S	*	*	H	α-helix	trans	-62.4	-33.5	179.8	-79	170.4	-175	162.7	0	112.6	Q671 S672	Q671-K675 WeakPolarHBondContact O-CB 3.43Å; Q671-K675 WeakPolarHBondContact O-CG 3.45Å; Q671-K675 PolarHBondContact O-N 3.33Å; S672-K675 PolarHBondContact O-N 2.75Å
676	N	38.4	Very low	35.1	Very low	140 Å²	140	125.1 Å²	125.1	75%	0.749	65%	0.65	S	S	*	*	H	α-helix	trans	-82.6	-21.2	177.4	-69.7	-37.5	0	0	0	113.7	S672 L673 N674	S672-N676 PolarHBondContact O-ND2 2.89Å; L673-N676 PolarHBondContact O-N 3.48Å; N674-N676 VanDerWaalsContact C-N 3.27Å; N674-N676 PolarHBondContact O-N 3Å
677	G	35.8	Very low	34.8	Very low	65 Å²	65	125.5 Å²	125.5	67%	0.67	66%	0.656	S	S	*	*	H	α-helix	trans	-87.2	-36.2	179.7	0	0	0	0	0	115.4	L673 N674	L673-G677 PolarHBondContact O-N 3.46Å; N674-G677 PolarHBondContact O-N 3.2Å
678	F	33.1	Very low	34.8	Very low	150 Å²	150	126.3 Å²	126.3	66%	0.658	67%	0.671	S	S	*	*	S	Bend	trans	-86.8	-10.5	-161.2	-140.8	-93.8	0	0	0	116	N674 K680	N674-F678 PolarHBondContact O-N 3.13Å; N674-F678 VanDerWaalsContact O-N 3.14Å; F678-K680 PolarHBondContact O-N 3.44Å
679	M	32.6	Very low	34.5	Very low	181 Å²	181	129.6 Å²	129.6	89%	0.892	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	29.7	-164.9	-149	179.6	-168.5	0	0	115.8
680	K	32.9	Very low	34.4	Very low	194 Å²	194	133.5 Å²	133.5	84%	0.843	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.8	-3.9	-177.7	-94.9	-175	179.1	175.4	0	118	F678	F678-K680 PolarHBondContact O-N 3.44Å
681	L	31.1	Very low	34.4	Very low	146 Å²	146	135.6 Å²	135.6	76%	0.764	72%	0.721	S	S	*	*			trans	-131.1	84.9	174.8	-78.5	96.5	0	0	0	112.6
682	N	34	Very low	34.3	Very low	159 Å²	159	139.7 Å²	139.7	85%	0.85	75%	0.745	S	S	*	*			trans	-166.7	78.6	146.4	-106.5	-21.3	0	0	0	110.1
683	N	35.7	Very low	34.2	Very low	173 Å²	173	144.1 Å²	144.1	93%	0.925	76%	0.764	S	S	*	*			trans	-143.3	112.3	170.7	-124.6	-13.1	0	0	0	108.4
684	G	30.8	Very low	34	Very low	67 Å²	67	146.2 Å²	146.2	69%	0.691	78%	0.776	S	S	*	*			trans	88.4	85.3	178.3	0	0	0	0	0	115.8
685	F	32	Very low	33.9	Very low	224 Å²	224	152 Å²	152	98%	0.982	80%	0.798	S	S	*	*				-150.8	114.8	114.3	-113	-73.9	0	0	0	109.2
686	N	34	Very low	33.6	Very low	137 Å²	137	152.6 Å²	152.6	73%	0.733	81%	0.806	S	S	*	*			trans	-115.3	146.7	-179.4	-164.6	-0.7	0	0	0	109
687	N	30.8	Very low	33.4	Very low	137 Å²	137	154.1 Å²	154.1	73%	0.733	81%	0.812	S	S	*	*			trans	-7.6	127	179.4	-66.8	-32.3	0	0	0	118.5
688	N	33.6	Very low	33.4	Very low	165 Å²	165	159.5 Å²	159.5	88%	0.882	82%	0.817	S	S	*	*				-156.6	134.4	115.6	-106	-35.9	0	0	0	112.8
689	N	32.3	Very low	33.5	Very low	147 Å²	147	159.2 Å²	159.2	79%	0.786	82%	0.822	S	S	*	*			trans	-75.9	147.1	172.2	-70	-44.6	0	0	0	110.4
690	N	34.3	Very low	33.6	Very low	160 Å²	160	158 Å²	158	86%	0.856	82%	0.82	S	S	*	*			trans	-159.2	148.1	130.6	-111.1	-42.6	0	0	0	113.3
691	N	34.3	Very low	33.6	Very low	139 Å²	139	157.8 Å²	157.8	74%	0.743	82%	0.821	S	S	*	*			trans	-70.6	145.1	-174.4	-59.5	-64.4	0	0	0	112.4
692	N	34.7	Very low	33.8	Very low	160 Å²	160	159.9 Å²	159.9	86%	0.856	83%	0.827	S	S	*	*				-174.5	89.6	125.1	-94.7	-36.2	0	0	0	112.1	N694	N692-N694 PolarHBondContact O-N 3.03Å
693	N	33.6	Very low	33.7	Very low	159 Å²	159	161.1 Å²	161.1	85%	0.85	83%	0.825	S	S	*	*			trans	-74.2	115.6	160.4	-79.1	-27.7	0	0	0	109.2
694	N	33.5	Very low	33.5	Very low	160 Å²	160	160.4 Å²	160.4	86%	0.856	82%	0.821	S	S	*	*			trans	178.4	160.8	143	-102.8	-54.7	0	0	0	114	N692	N692-N694 PolarHBondContact O-N 3.03Å
695	K	34.2	Very low	33.6	Very low	191 Å²	191	167.3 Å²	167.3	83%	0.83	83%	0.832	S	S	*	*			trans	77.3	135	164.4	-79.1	178.6	177.4	174.7	0	120
696	I	34.1	Very low	33.5	Very low	150 Å²	150	166 Å²	166	77%	0.769	83%	0.826	S	S	*	*			trans	77.9	67.5	160	-52.6	149.7	0	0	0	115.9
697	I	34.5	Very low	33.4	Very low	173 Å²	173	166.8 Å²	166.8	89%	0.887	83%	0.829	S	S	*	*			trans	-87.3	105.3	139.5	-63.7	171.2	0	0	0	107
698	K	35.3	Very low	33.3	Very low	178 Å²	178	167.7 Å²	167.7	77%	0.774	83%	0.834	S	S	*	*			trans	-176.1	153.7	160.9	-108.6	161.7	-173.7	178.7	0	111.2
699	N	36.1	Very low	33.2	Very low	143 Å²	143	167.4 Å²	167.4	77%	0.765	83%	0.831	S	S	*	*			trans	63.1	95.4	168.3	-56.1	-2.1	0	0	0	117.4
700	N	33.1	Very low	33	Very low	156 Å²	156	167.8 Å²	167.8	83%	0.834	83%	0.833	S	S	*	*				-172.7	50.6	127.1	-93.2	-30.9	0	0	0	112.5
701	Q	33.5	Very low	32.9	Very low	189 Å²	189	166.5 Å²	166.5	88%	0.883	83%	0.826	S	S	*	*			trans	-79.8	155.5	148.6	-71.2	-178.9	-12.6	0	0	108.2
702	Q	35.2	Very low	32.6	Very low	190 Å²	190	168.1 Å²	168.1	89%	0.888	84%	0.835	S	S	*	*			trans	70.6	78.3	-173.8	-53.2	-175.4	-1.9	0	0	116.4
703	K	31.8	Very low	32.7	Very low	186 Å²	186	167.3 Å²	167.3	81%	0.809	83%	0.826	S	S	*	*			trans	-145.3	157.8	141.2	-110.1	162.6	-173.5	172.6	0	109.6
704	N	31.1	Very low	32.4	Very low	157 Å²	157	169.8 Å²	169.8	84%	0.84	83%	0.829	S	S	*	*			trans	64.7	43.4	175.2	-55.5	-1.8	0	0	0	117
705	K	33.8	Very low	32.4	Very low	213 Å²	213	170 Å²	170	93%	0.926	82%	0.824	S	S	*	*			trans	-112	76	155.7	-115	-172.6	-179	-177.5	0	111
706	K	29.8	Very low	32.2	Very low	196 Å²	196	170.1 Å²	170.1	85%	0.852	83%	0.825	S	S	*	*			trans	-178.2	130.6	168.9	-98.2	166.9	-177	-179.2	0	102.3
707	I	31.9	Very low	31.9	Very low	154 Å²	154	172.9 Å²	172.9	79%	0.79	83%	0.831	S	S	*	*				-142	140.1	55.9	-77.2	155.2	0	0	0	109.9
708	N	28.4	Very low	31.7	Very low	156 Å²	156	173.7 Å²	173.7	83%	0.834	83%	0.829	S	S	*	*			trans	-73.3	143.2	164.7	-68.3	-17.2	0	0	0	109.7
709	L	32.3	Very low	31.7	Very low	159 Å²	159	175 Å²	175	83%	0.832	84%	0.835	S	S	*	*			trans	-161.3	127.2	143	-110.7	156.8	0	0	0	110.7
710	N	27.3	Very low	31.5	Very low	154 Å²	154	177.9 Å²	177.9	82%	0.824	84%	0.841	S	S	*	*			trans	-65.4	147.2	163.1	-67.7	-27.8	0	0	0	109.1
711	L	31.7	Very low	31.5	Very low	133 Å²	133	180.2 Å²	180.2	70%	0.696	84%	0.843	S	S	*	*			trans	-159.6	100	145.8	-109.4	156.5	0	0	0	110	E713	L711-E713 HydrophobicContact CD2-CB 3.98Å; L711-E713 HydrophobicContact CD2-CG 4.4Å; L711-E713 PolarHBondContact O-N 3.48Å
712	N	28.8	Very low	31.6	Very low	174 Å²	174	180 Å²	180	93%	0.93	84%	0.84	S	S	*	*			trans	-73.5	95.3	161.9	-111.9	-10.6	0	0	0	107
713	E	35.8	Very low	31.8	Very low	143 Å²	143	175.6 Å²	175.6	67%	0.668	83%	0.83	S	S	*	*			trans	-147.2	145.5	176.2	-131.2	167.9	-136.7	0	0	114.6	L711 H715	L711-E713 HydrophobicContact CD2-CB 3.98Å; L711-E713 HydrophobicContact CD2-CG 4.4Å; L711-E713 PolarHBondContact O-N 3.48Å; E713-H715 PolarHBondContact O-N 3.37Å; E713-H715 VanDerWaalsContact O-N 3.15Å
714	K	28.3	Very low	32.3	Very low	210 Å²	210	177 Å²	177	91%	0.913	83%	0.83	S	S	*	*			trans	-81.5	92.3	-162.8	-65.1	172.9	179.5	174	0	112.2
715	H	33.8	Very low	32.9	Very low	165 Å²	165	172.2 Å²	172.2	76%	0.764	82%	0.817	S	S	*	*			trans	-94.5	121.1	174	-81.3	-79.9	0	0	0	114	E713	E713-H715 PolarHBondContact O-N 3.37Å; E713-H715 VanDerWaalsContact O-N 3.15Å
716	K	29.6	Very low	33.5	Very low	193 Å²	193	170.4 Å²	170.4	84%	0.839	81%	0.81	S	S	*	*			trans	-54.9	134.8	176.8	-67.1	176.6	175.5	178.5	0	111.7	K718	K716-K718 PolarHBondContact O-N 2.93Å
717	F	28.6	Very low	34.3	Very low	208 Å²	208	165.1 Å²	165.1	91%	0.912	80%	0.795	S	S	*	*			trans	-55.3	110.7	169.1	-103.6	-102.4	0	0	0	110.6
718	K	29.7	Very low	35.3	Very low	191 Å²	191	163.8 Å²	163.8	83%	0.83	79%	0.788	S	S	*	*			trans	-109.4	119	161.2	-81.1	-173.5	173.6	-179.1	0	107.8	K716 K720	K716-K718 PolarHBondContact O-N 2.93Å; K718-K720 PolarHBondContact O-N 3.45Å; K718-K720 VanDerWaalsContact O-N 3.14Å
719	F	34.6	Very low	36	Very low	205 Å²	205	163 Å²	163	90%	0.899	78%	0.778	S	S	*	*			trans	-53.3	118.7	178.8	-102.9	-95.3	0	0	0	111.1	K721	F719-K721 PolarHBondContact O-N 3.29Å
720	K	32.2	Very low	37.2	Very low	204 Å²	204	160.6 Å²	160.6	89%	0.887	76%	0.762	S	S	*	*			trans	-72.5	120.8	178.5	-153.1	173	-173.2	178.5	0	108.2	K718 F722	K718-K720 PolarHBondContact O-N 3.45Å; K718-K720 VanDerWaalsContact O-N 3.14Å; K720-F722 PolarHBondContact O-N 2.94Å
721	K	32.8	Very low	38.6	Very low	204 Å²	204	158.8 Å²	158.8	89%	0.887	75%	0.747	S	S	*	*			trans	-64.2	96.4	-169.7	-163.9	176.9	-173.6	180	0	110.9	F719	F719-K721 PolarHBondContact O-N 3.29Å
722	F	36.4	Very low	40.1	Very low	185 Å²	185	156.6 Å²	156.6	81%	0.811	74%	0.736	S	S	*	*			trans	-61.4	145.1	179.4	-154.4	-93.9	0	0	0	110.9	K720 R724	K720-F722 PolarHBondContact O-N 2.94Å; F722-R724 PolarHBondContact O-N 2.89Å
723	S	39.6	Very low	42.2	Very low	98 Å²	98	150.6 Å²	150.6	69%	0.685	70%	0.704	S	S	*	*			trans	-74	99.8	-169.4	-168.9	0	0	0	0	111.9	G725	S723-G725 PolarHBondContact O-N 3.41Å
724	R	42.6	Very low	43.8	Very low	216 Å²	216	146.9 Å²	146.9	82%	0.815	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	8.3	-179	-83.3	-179.3	146.4	111.4	-6.5	115.1	F722	F722-R724 PolarHBondContact O-N 2.89Å
725	G	43.7	Very low	46	Very low	55 Å²	55	142.7 Å²	142.7	57%	0.567	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-24.2	-164.3	0	0	0	0	0	117.8	S723	S723-G725 PolarHBondContact O-N 3.41Å
726	K	46	Very low	48.1	Very low	176 Å²	176	139.6 Å²	139.6	77%	0.765	65%	0.653	S	S	*	*	S	Bend	trans	-84.9	-60.6	-170.5	-75	-165.5	171.2	-166	0	116	I728 F729	K726-I728 PolarHBondContact O-N 2.98Å; K726-I728 VanDerWaalsContact O-N 3.11Å; K726-F729 WeakPolarHBondContact O-CB 3.3Å; K726-F729 PolarHBondContact O-N 3.04Å
727	P	46.3	Very low	50.7	Low	85 Å²	85	135.1 Å²	135.1	55%	0.552	64%	0.635	S	S	*	*	H	α-helix	trans	-65.5	-24.3	-166.7	24.8	-35.1	0	0	0	114.1	F729 F731	P727-F729 VanDerWaalsContact C-N 3.3Å; P727-F729 PolarHBondContact O-N 2.81Å; P727-F731 WeakPolarHBondContact O-CB 3.23Å; P727-F731 PolarHBondContact O-N 3.28Å; P727-F731 VanDerWaalsContact O-N 3.17Å
728	I	52.3	Low	53.3	Low	125 Å²	125	126.6 Å²	126.6	64%	0.641	60%	0.599	S	S	*	*	H	α-helix	trans	-68.5	-30.5	177.2	-59.2	174.9	0	0	0	111.4	K726 N732	K726-I728 PolarHBondContact O-N 2.98Å; K726-I728 VanDerWaalsContact O-N 3.11Å; I728-N732 VanDerWaalsContact O-CB 3.25Å; I728-N732 WeakPolarHBondContact O-CB 3.44Å; I728-N732 PolarHBondContact O-N 3.09Å
729	F	44.8	Very low	55.9	Low	141 Å²	141	121.8 Å²	121.8	62%	0.618	58%	0.582	S	S	*	*	H	α-helix	trans	-74.2	-46.1	179.6	-168.1	-87.2	0	0	0	111.1	K726 P727 N732 D733	K726-F729 WeakPolarHBondContact O-CB 3.3Å; K726-F729 PolarHBondContact O-N 3.04Å; P727-F729 VanDerWaalsContact C-N 3.3Å; P727-F729 PolarHBondContact O-N 2.81Å; F729-N732 WeakPolarHBondContact O-CB 3.48Å; F729-N732 PolarHBondContact O-N 3.31Å; F729-D733 WeakPolarHBondContact CE1-OD2 3.38Å; F729-D733 PolarHBondContact O-N 3.45Å
730	E	55.8	Low	58.4	Low	107 Å²	107	117.1 Å²	117.1	50%	0.5	56%	0.563	S	S	.	*	H	α-helix	trans	-64.3	-48.5	-177.7	-160.3	150.2	-121.8	0	0	111.8	N732 D733 Q734	E730-N732 VanDerWaalsContact C-N 3.28Å; E730-N732 PolarHBondContact O-N 2.78Å; E730-D733 PolarHBondContact O-N 3.26Å; E730-Q734 PolarHBondContact O-N 3.08Å
731	F	57.2	Low	61	Low	116 Å²	116	109 Å²	109	51%	0.509	53%	0.529	S	S	.	.	H	α-helix	trans	-57.8	-39.5	172.3	179.5	-90.8	0	0	0	112.5	W48 P727 F735	W48-F731 AromaticContact CH2-CD2 3.92Å; W48-F731 HydrophobicContact CH2-CD2 3.92Å; W48-F731 HydrophobicContact CZ3-CD2 4.05Å; P727-F731 WeakPolarHBondContact O-CB 3.23Å; P727-F731 PolarHBondContact O-N 3.28Å; P727-F731 VanDerWaalsContact O-N 3.17Å; F731-F735 WeakPolarHBondContact O-CB 3.29Å; F731-F735 PolarHBondContact O-N 3.21Å
732	N	62.5	Low	63.5	Low	88 Å²	88	100.9 Å²	100.9	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-70	-38.7	179.9	-179.5	54.2	0	0	0	112.3	I728 F729 E730 K736	I728-N732 VanDerWaalsContact O-CB 3.25Å; I728-N732 WeakPolarHBondContact O-CB 3.44Å; I728-N732 PolarHBondContact O-N 3.09Å; F729-N732 WeakPolarHBondContact O-CB 3.48Å; F729-N732 PolarHBondContact O-N 3.31Å; E730-N732 VanDerWaalsContact C-N 3.28Å; E730-N732 PolarHBondContact O-N 2.78Å; N732-K736 WeakPolarHBondContact O-CB 3.5Å; N732-K736 PolarHBondContact O-N 2.95Å
733	D	73.9	Confident	65.8	Low	47 Å²	47	96.3 Å²	96.3	25%	0.251	48%	0.478	S	S	.	.	H	α-helix	trans	-73.2	-34.4	175.2	-92.4	-25.1	0	0	0	112.6	F729 E730 K736 Q737	F729-D733 WeakPolarHBondContact CE1-OD2 3.38Å; F729-D733 PolarHBondContact O-N 3.45Å; E730-D733 PolarHBondContact O-N 3.26Å; D733-K736 IonicContact OD1-NZ 3.56Å; D733-K736 PolarHBondContact OD1-NZ 3.34Å; D733-Q737 WeakPolarHBondContact O-CB 3.4Å; D733-Q737 VanDerWaalsContact O-CG 3.29Å; D733-Q737 WeakPolarHBondContact O-CG 3.48Å; D733-Q737 PolarHBondContact O-N 3.07Å; D733-Q737 PolarHBondContact O-NE2 3.36Å
734	Q	69.5	Low	68.1	Low	66 Å²	66	95.5 Å²	95.5	31%	0.308	46%	0.463	S	S	.	.	H	α-helix	trans	-68.5	-46.2	171.5	-166.3	-168.8	11	0	0	111.4	E730 K736 Q737 N738	E730-Q734 PolarHBondContact O-N 3.08Å; Q734-K736 PolarHBondContact O-N 2.89Å; Q734-Q737 WeakPolarHBondContact O-CB 3.47Å; Q734-Q737 PolarHBondContact O-N 3.13Å; Q734-Q737 VanDerWaalsContact O-N 3.11Å; Q734-N738 WeakPolarHBondContact O-CB 3.42Å; Q734-N738 VanDerWaalsContact O-CG 3.23Å; Q734-N738 PolarHBondContact O-N 2.96Å; Q734-N738 PolarHBondContact O-OD1 3.21Å
735	F	74.4	Confident	70.2	Confident	121 Å²	121	85.2 Å²	85.2	53%	0.531	43%	0.425	S	S	.	.	H	α-helix	trans	-56	-40.5	174.6	174.9	-99.4	0	0	0	111.9	F731 N738 L739	F731-F735 WeakPolarHBondContact O-CB 3.29Å; F731-F735 PolarHBondContact O-N 3.21Å; F735-N738 PolarHBondContact O-N 3.36Å; F735-L739 HydrophobicContact CE1-CD2 4.47Å; F735-L739 VanDerWaalsContact O-CB 3.29Å; F735-L739 WeakPolarHBondContact O-CB 3.34Å; F735-L739 PolarHBondContact O-N 3.42Å
736	K	78.7	Confident	72.3	Confident	101 Å²	101	85.5 Å²	85.5	44%	0.439	41%	0.413	S	S	.	.	H	α-helix	trans	-68.5	-39	176.2	174.2	176.8	144.9	-142.9	0	112.9	N732 D733 Q734 Q740	N732-K736 WeakPolarHBondContact O-CB 3.5Å; N732-K736 PolarHBondContact O-N 2.95Å; D733-K736 IonicContact OD1-NZ 3.56Å; D733-K736 PolarHBondContact OD1-NZ 3.34Å; Q734-K736 PolarHBondContact O-N 2.89Å; K736-Q740 WeakPolarHBondContact O-CG 3.38Å; K736-Q740 PolarHBondContact O-N 3.45Å
737	Q	84.2	Confident	74.2	Confident	98 Å²	98	82.1 Å²	82.1	46%	0.458	40%	0.403	S	S	.	.	H	α-helix	trans	-62.4	-50.2	171	-76.5	167	87.9	0	0	110.6	D733 Q734 L739 Q740 L741	D733-Q737 WeakPolarHBondContact O-CB 3.4Å; D733-Q737 VanDerWaalsContact O-CG 3.29Å; D733-Q737 WeakPolarHBondContact O-CG 3.48Å; D733-Q737 PolarHBondContact O-N 3.07Å; D733-Q737 PolarHBondContact O-NE2 3.36Å; Q734-Q737 WeakPolarHBondContact O-CB 3.47Å; Q734-Q737 PolarHBondContact O-N 3.13Å; Q734-Q737 VanDerWaalsContact O-N 3.11Å; Q737-L739 VanDerWaalsContact C-N 3.29Å; Q737-L739 PolarHBondContact O-N 3.41Å; Q737-Q740 CarbonylContact O-C 3.59Å; Q737-Q740 WeakPolarHBondContact O-CA 3.16Å; Q737-Q740 WeakPolarHBondContact O-CB 3.28Å; Q737-Q740 PolarHBondContact O-N 2.96Å; Q737-L741 WeakPolarHBondContact O-CG 3.34Å; Q737-L741 PolarHBondContact O-N 3.04Å
738	N	82.1	Confident	76	Confident	29 Å²	29	81.3 Å²	81.3	16%	0.155	39%	0.391	C	S	.	.	H	α-helix	trans	-60.6	-38	178.5	-63.8	-10	0	0	0	111.7	Q734 F735 L741 M742 L863 S866	Q734-N738 WeakPolarHBondContact O-CB 3.42Å; Q734-N738 VanDerWaalsContact O-CG 3.23Å; Q734-N738 PolarHBondContact O-N 2.96Å; Q734-N738 PolarHBondContact O-OD1 3.21Å; F735-N738 PolarHBondContact O-N 3.36Å; N738-L741 PolarHBondContact O-N 2.92Å; N738-M742 WeakPolarHBondContact O-CB 3.38Å; N738-M742 WeakPolarHBondContact O-CG 3.25Å; N738-M742 PolarHBondContact O-N 3.45Å; N738-L863 WeakPolarHBondContact O-CD2 3.41Å; N738-S866 PolarHBondContact ND2-OG 2.94Å
739	L	84.3	Confident	77.4	Confident	90 Å²	90	77.9 Å²	77.9	47%	0.471	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-38.6	173	-176.7	61.4	0	0	0	112.4	F735 Q737 I743	F735-L739 HydrophobicContact CE1-CD2 4.47Å; F735-L739 VanDerWaalsContact O-CB 3.29Å; F735-L739 WeakPolarHBondContact O-CB 3.34Å; F735-L739 PolarHBondContact O-N 3.42Å; Q737-L739 VanDerWaalsContact C-N 3.29Å; Q737-L739 PolarHBondContact O-N 3.41Å; L739-I743 HydrophobicContact CD1-CD1 4.44Å; L739-I743 HydrophobicContact CG-CD1 4.26Å; L739-I743 WeakPolarHBondContact O-CD1 3.44Å; L739-I743 VanDerWaalsContact O-CG1 3.25Å; L739-I743 WeakPolarHBondContact O-CG1 3.5Å; L739-I743 PolarHBondContact O-N 3.38Å; L739-I743 VanDerWaalsContact O-N 3.07Å
740	Q	87.2	Confident	79.2	Confident	107 Å²	107	77.5 Å²	77.5	50%	0.5	37%	0.37	S	S	.	.	H	α-helix	trans	-67.1	-41	173.6	-74.9	177.1	-26.8	0	0	112.1	K736 Q737 I743 Q744	K736-Q740 WeakPolarHBondContact O-CG 3.38Å; K736-Q740 PolarHBondContact O-N 3.45Å; Q737-Q740 CarbonylContact O-C 3.59Å; Q737-Q740 WeakPolarHBondContact O-CA 3.16Å; Q737-Q740 WeakPolarHBondContact O-CB 3.28Å; Q737-Q740 PolarHBondContact O-N 2.96Å; Q740-I743 PolarHBondContact O-N 3.27Å; Q740-Q744 WeakPolarHBondContact O-CG 3.36Å; Q740-Q744 PolarHBondContact O-N 2.86Å
741	L	86.3	Confident	80.6	Confident	35 Å²	35	79.3 Å²	79.3	18%	0.183	38%	0.376	C	S	.	.	H	α-helix	trans	-62.9	-45.7	173.9	-67.7	175.3	0	0	0	110.6	Q737 N738 I743 Q744 Y745 Y859 Q862 L863	Q737-L741 WeakPolarHBondContact O-CG 3.34Å; Q737-L741 PolarHBondContact O-N 3.04Å; N738-L741 PolarHBondContact O-N 2.92Å; L741-I743 VanDerWaalsContact C-N 3.3Å; L741-I743 PolarHBondContact O-N 2.84Å; L741-Q744 PolarHBondContact O-N 2.92Å; L741-Q744 VanDerWaalsContact O-N 3.12Å; L741-Y745 VanDerWaalsContact O-CB 3.3Å; L741-Y745 WeakPolarHBondContact O-CB 3.42Å; L741-Y745 PolarHBondContact O-N 3.46Å; L741-Y859 HydrophobicContact CD2-CD1 3.82Å; L741-Y859 HydrophobicContact CD2-CE1 3.79Å; L741-Q862 HydrophobicContact CD1-CB 4.37Å; L741-L863 HydrophobicContact CB-CD1 4.23Å; L741-L863 HydrophobicContact CB-CD2 3.58Å; L741-L863 HydrophobicContact CB-CG 4.01Å
742	M	85.1	Confident	81.5	Confident	32 Å²	32	75.1 Å²	75.1	16%	0.158	36%	0.359	C	S	.	.	H	α-helix	trans	-57	-41.7	174.9	-80.8	-59.5	-58.5	0	0	112.1	N738 Y745 L746 P835 I839 L863 C867	N738-M742 WeakPolarHBondContact O-CB 3.38Å; N738-M742 WeakPolarHBondContact O-CG 3.25Å; N738-M742 PolarHBondContact O-N 3.45Å; M742-Y745 HydrophobicContact CE-CD1 4.39Å; M742-L746 WeakPolarHBondContact O-CB 3.24Å; M742-L746 VanDerWaalsContact O-CG 3.28Å; M742-L746 WeakPolarHBondContact O-CG 3.35Å; M742-L746 PolarHBondContact O-N 2.84Å; M742-P835 HydrophobicContact CE-CB 3.97Å; M742-I839 HydrophobicContact SD-CD1 4.45Å; M742-L863 HydrophobicContact CB-CD2 4.48Å; M742-L863 HydrophobicContact CG-CD1 4.33Å; M742-L863 HydrophobicContact CG-CD2 3.7Å; M742-L863 HydrophobicContact SD-CB 4.35Å; M742-L863 HydrophobicContact SD-CD1 3.73Å; M742-L863 HydrophobicContact SD-CD2 3.81Å; M742-L863 HydrophobicContact SD-CG 4.18Å; M742-C867 VanDerWaalsContact SD-SG 3.7Å
743	I	86.4	Confident	82.1	Confident	90 Å²	90	77.4 Å²	77.4	46%	0.462	37%	0.365	S	S	.	.	H	α-helix	trans	-67.4	-41.2	177.1	-69.5	164	0	0	0	110.9	L739 Q740 L741 N747	L739-I743 HydrophobicContact CD1-CD1 4.44Å; L739-I743 HydrophobicContact CG-CD1 4.26Å; L739-I743 WeakPolarHBondContact O-CD1 3.44Å; L739-I743 VanDerWaalsContact O-CG1 3.25Å; L739-I743 WeakPolarHBondContact O-CG1 3.5Å; L739-I743 PolarHBondContact O-N 3.38Å; L739-I743 VanDerWaalsContact O-N 3.07Å; Q740-I743 PolarHBondContact O-N 3.27Å; L741-I743 VanDerWaalsContact C-N 3.3Å; L741-I743 PolarHBondContact O-N 2.84Å; I743-N747 VanDerWaalsContact O-CB 3.28Å; I743-N747 WeakPolarHBondContact O-CB 3.4Å; I743-N747 PolarHBondContact O-N 3.44Å; I743-N747 PolarHBondContact O-ND2 2.87Å; I743-N747 VanDerWaalsContact O-ND2 3.1Å
744	Q	87.6	Confident	82.3	Confident	80 Å²	80	80.8 Å²	80.8	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-64.2	-46.5	175.4	-72.5	175	57	0	0	111.8	Q740 L741 N747 K748 Y859	Q740-Q744 WeakPolarHBondContact O-CG 3.36Å; Q740-Q744 PolarHBondContact O-N 2.86Å; L741-Q744 PolarHBondContact O-N 2.92Å; L741-Q744 VanDerWaalsContact O-N 3.12Å; Q744-N747 PolarHBondContact O-N 3.42Å; Q744-K748 WeakPolarHBondContact O-CB 3.43Å; Q744-K748 WeakPolarHBondContact O-CG 3.22Å; Q744-K748 PolarHBondContact O-N 3.39Å; Q744-Y859 HydrophobicContact CB-CD1 4.34Å; Q744-Y859 HydrophobicContact CB-CE1 3.8Å; Q744-Y859 VanDerWaalsContact OE1-CE1 3.3Å; Q744-Y859 PolarHBondContact OE1-OH 3.02Å
745	Y	86.7	Confident	82.6	Confident	1 Å²	1	81.1 Å²	81.1	0%	0.004	38%	0.382	C	S	.	.	H	α-helix	trans	-55.2	-55	174.4	165.7	-98	0	0	0	111.7	L741 M742 N747 K748 F749 S838 I839 T842 I856 A860 L863	L741-Y745 VanDerWaalsContact O-CB 3.3Å; L741-Y745 WeakPolarHBondContact O-CB 3.42Å; L741-Y745 PolarHBondContact O-N 3.46Å; M742-Y745 HydrophobicContact CE-CD1 4.39Å; Y745-N747 PolarHBondContact O-N 2.9Å; Y745-K748 PolarHBondContact O-N 3.29Å; Y745-F749 VanDerWaalsContact O-CB 3.28Å; Y745-F749 WeakPolarHBondContact O-CB 3.49Å; Y745-F749 PolarHBondContact O-N 3.06Å; Y745-S838 PolarHBondContact OH-O 3.34Å; Y745-I839 HydrophobicContact CE1-CG1 4.17Å; Y745-I839 HydrophobicContact CE2-CG1 4.27Å; Y745-I839 WeakPolarHBondContact OH-CA 3.46Å; Y745-I839 PolarHBondContact OH-N 3.06Å; Y745-T842 HydrophobicContact CE2-CG2 4.08Å; Y745-T842 PolarHBondContact OH-OG1 2.62Å; Y745-I856 HydrophobicContact CD2-CG2 4.49Å; Y745-I856 HydrophobicContact CE2-CG2 4.37Å; Y745-A860 HydrophobicContact CE2-CB 4.19Å; Y745-L863 HydrophobicContact CD1-CD1 4.37Å; Y745-L863 HydrophobicContact CD2-CD1 4.41Å; Y745-L863 HydrophobicContact CG-CD1 3.86Å
746	L	86.2	Confident	82.5	Confident	60 Å²	60	79.3 Å²	79.3	31%	0.314	38%	0.378	S	S	.	.	H	α-helix	trans	-60.9	-44	179.2	-71.3	172.2	0	0	0	111.6	M742 K748 F749 F750	M742-L746 WeakPolarHBondContact O-CB 3.24Å; M742-L746 VanDerWaalsContact O-CG 3.28Å; M742-L746 WeakPolarHBondContact O-CG 3.35Å; M742-L746 PolarHBondContact O-N 2.84Å; L746-K748 PolarHBondContact O-N 3.31Å; L746-F749 PolarHBondContact O-N 3.26Å; L746-F750 HydrophobicContact CB-CD2 4.35Å; L746-F750 HydrophobicContact CB-CE2 4.29Å; L746-F750 HydrophobicContact CD2-CE2 4.24Å; L746-F750 WeakPolarHBondContact O-CB 3.46Å; L746-F750 WeakPolarHBondContact O-CD2 3.46Å; L746-F750 PolarHBondContact O-N 2.9Å
747	N	86.6	Confident	82.1	Confident	106 Å²	106	78 Å²	78	57%	0.567	38%	0.379	S	S	*	.	H	α-helix	trans	-61.7	-41.5	177.5	-74.4	-25.8	0	0	0	112.3	I743 Q744 Y745 K751	I743-N747 VanDerWaalsContact O-CB 3.28Å; I743-N747 WeakPolarHBondContact O-CB 3.4Å; I743-N747 PolarHBondContact O-N 3.44Å; I743-N747 PolarHBondContact O-ND2 2.87Å; I743-N747 VanDerWaalsContact O-ND2 3.1Å; Q744-N747 PolarHBondContact O-N 3.42Å; Y745-N747 PolarHBondContact O-N 2.9Å; N747-K751 VanDerWaalsContact O-CB 3.29Å; N747-K751 WeakPolarHBondContact O-CB 3.48Å; N747-K751 PolarHBondContact O-N 2.84Å; N747-K751 VanDerWaalsContact O-N 3.16Å
748	K	83.8	Confident	81.2	Confident	68 Å²	68	77.8 Å²	77.8	30%	0.296	38%	0.38	S	S	.	.	H	α-helix	trans	-69.2	-42.9	175.3	-76.5	-164.1	172.1	-163.8	0	112	Q744 Y745 L746 K751 L752 Y854 I856 Y859	Q744-K748 WeakPolarHBondContact O-CB 3.43Å; Q744-K748 WeakPolarHBondContact O-CG 3.22Å; Q744-K748 PolarHBondContact O-N 3.39Å; Y745-K748 PolarHBondContact O-N 3.29Å; L746-K748 PolarHBondContact O-N 3.31Å; K748-K751 PolarHBondContact O-N 2.65Å; K748-L752 PolarHBondContact O-N 3Å; K748-Y854 WeakPolarHBondContact CD-O 3.43Å; K748-Y854 PolarHBondContact NZ-O 3.39Å; K748-I856 HydrophobicContact CB-CD1 3.83Å; K748-I856 HydrophobicContact CB-CG1 3.61Å; K748-I856 HydrophobicContact CD-CG1 3.96Å; K748-I856 HydrophobicContact CG-CG1 4.44Å; K748-Y859 HydrophobicContact CD-CD2 4.11Å; K748-Y859 HydrophobicContact CD-CE2 3.7Å
749	F	82.5	Confident	80.4	Confident	53 Å²	53	84.5 Å²	84.5	23%	0.232	40%	0.403	C	S	.	.	H	α-helix	trans	-61.8	-50.5	179	-179.4	-93.1	0	0	0	111.9	Y745 L746 K751 L752 F753 T842	Y745-F749 VanDerWaalsContact O-CB 3.28Å; Y745-F749 WeakPolarHBondContact O-CB 3.49Å; Y745-F749 PolarHBondContact O-N 3.06Å; L746-F749 PolarHBondContact O-N 3.26Å; F749-K751 VanDerWaalsContact C-N 3.28Å; F749-K751 PolarHBondContact O-N 3.44Å; F749-L752 PolarHBondContact O-N 3.31Å; F749-F753 PolarHBondContact O-N 3Å; F749-T842 HydrophobicContact CD2-CG2 4.15Å; F749-T842 WeakPolarHBondContact CD2-OG1 3.39Å; F749-T842 HydrophobicContact CE2-CG2 4.4Å; F749-T842 WeakPolarHBondContact CE2-OG1 3.2Å
750	F	83	Confident	79.3	Confident	133 Å²	133	83.8 Å²	83.8	58%	0.583	40%	0.4	S	S	*	.	H	α-helix	trans	-62.3	-35.7	175.4	-74.7	-58.8	0	0	0	112.3	L746 F753 H754	L746-F750 HydrophobicContact CB-CD2 4.35Å; L746-F750 HydrophobicContact CB-CE2 4.29Å; L746-F750 HydrophobicContact CD2-CE2 4.24Å; L746-F750 WeakPolarHBondContact O-CB 3.46Å; L746-F750 WeakPolarHBondContact O-CD2 3.46Å; L746-F750 PolarHBondContact O-N 2.9Å; F750-F753 PolarHBondContact O-N 3.28Å; F750-H754 WeakPolarHBondContact O-CB 3.1Å; F750-H754 PolarHBondContact O-N 3.38Å
751	K	83.4	Confident	77.9	Confident	145 Å²	145	84.2 Å²	84.2	63%	0.63	40%	0.402	S	S	*	.	H	α-helix	trans	-64.9	-43.6	174.1	-173.2	178.6	179.6	-176	0	111.8	N747 K748 F749 I755	N747-K751 VanDerWaalsContact O-CB 3.29Å; N747-K751 WeakPolarHBondContact O-CB 3.48Å; N747-K751 PolarHBondContact O-N 2.84Å; N747-K751 VanDerWaalsContact O-N 3.16Å; K748-K751 PolarHBondContact O-N 2.65Å; F749-K751 VanDerWaalsContact C-N 3.28Å; F749-K751 PolarHBondContact O-N 3.44Å; K751-I755 HydrophobicContact CG-CD1 3.95Å; K751-I755 WeakPolarHBondContact O-CB 3.4Å; K751-I755 WeakPolarHBondContact O-CD1 3.23Å; K751-I755 VanDerWaalsContact O-CG1 3.24Å; K751-I755 WeakPolarHBondContact O-CG1 3.47Å; K751-I755 PolarHBondContact O-N 3.43Å
752	L	76.9	Confident	76.2	Confident	28 Å²	28	89 Å²	89	15%	0.147	42%	0.418	C	S	.	.	H	α-helix	trans	-62.6	-47.2	174.3	-101.1	-157.7	0	0	0	111.8	K748 F749 H754 I755 N756 L851 Y854 I856	K748-L752 PolarHBondContact O-N 3Å; F749-L752 PolarHBondContact O-N 3.31Å; L752-H754 VanDerWaalsContact C-N 3.34Å; L752-H754 PolarHBondContact O-N 3.45Å; L752-I755 PolarHBondContact O-N 3.17Å; L752-N756 PolarHBondContact O-N 3.24Å; L752-L851 HydrophobicContact CD1-CD1 4.28Å; L752-L851 HydrophobicContact CD1-CD2 4.49Å; L752-Y854 HydrophobicContact CD1-CD2 4.23Å; L752-Y854 HydrophobicContact CD1-CG 4.27Å; L752-Y854 HydrophobicContact CD2-CD1 3.81Å; L752-Y854 HydrophobicContact CD2-CD2 3.8Å; L752-Y854 HydrophobicContact CD2-CE1 3.76Å; L752-Y854 HydrophobicContact CD2-CE2 3.78Å; L752-Y854 HydrophobicContact CD2-CG 3.83Å; L752-Y854 HydrophobicContact CG-CD1 4.28Å; L752-Y854 HydrophobicContact CG-CD2 4.36Å; L752-Y854 HydrophobicContact CG-CG 4.11Å; L752-I856 HydrophobicContact CB-CD1 4.12Å; L752-I856 HydrophobicContact CD1-CD1 3.4Å; L752-I856 HydrophobicContact CG-CD1 3.53Å
753	F	75.4	Confident	75	Confident	136 Å²	136	90.4 Å²	90.4	60%	0.596	43%	0.426	S	S	*	.	H	α-helix	trans	-56.2	-50.3	179.2	-169.3	-89.7	0	0	0	110.6	F749 F750 I755 N756 T757	F749-F753 PolarHBondContact O-N 3Å; F750-F753 PolarHBondContact O-N 3.28Å; F753-I755 PolarHBondContact O-N 2.95Å; F753-N756 PolarHBondContact O-N 2.91Å; F753-N756 VanDerWaalsContact O-N 3.14Å; F753-T757 PolarHBondContact O-N 3.42Å; F753-T757 PolarHBondContact O-OG1 3.29Å
754	H	77.6	Confident	73.6	Confident	118 Å²	118	90.1 Å²	90.1	55%	0.546	43%	0.426	S	S	.	.	H	α-helix	trans	-63.1	-37.6	178.6	-165.7	-28.3	0	0	0	113.2	F750 L752 N758	F750-H754 WeakPolarHBondContact O-CB 3.1Å; F750-H754 PolarHBondContact O-N 3.38Å; L752-H754 VanDerWaalsContact C-N 3.34Å; L752-H754 PolarHBondContact O-N 3.45Å; H754-N758 PolarHBondContact CE1-OD1 3.05Å; H754-N758 PolarHBondContact ND1-ND2 3.49Å; H754-N758 PolarHBondContact ND1-OD1 3.21Å; H754-N758 WeakPolarHBondContact O-CB 3.32Å; H754-N758 VanDerWaalsContact O-CG 3.23Å; H754-N758 PolarHBondContact O-N 3.36Å; H754-N758 VanDerWaalsContact O-N 3.11Å; H754-N758 PolarHBondContact O-OD1 3.01Å
755	I	77.3	Confident	72.1	Confident	73 Å²	73	90.9 Å²	90.9	37%	0.374	43%	0.429	S	S	.	.	H	α-helix	trans	-64	-43.4	173.6	-72.3	166.3	0	0	0	110.3	K751 L752 F753 N758 R759	K751-I755 HydrophobicContact CG-CD1 3.95Å; K751-I755 WeakPolarHBondContact O-CB 3.4Å; K751-I755 WeakPolarHBondContact O-CD1 3.23Å; K751-I755 VanDerWaalsContact O-CG1 3.24Å; K751-I755 WeakPolarHBondContact O-CG1 3.47Å; K751-I755 PolarHBondContact O-N 3.43Å; L752-I755 PolarHBondContact O-N 3.17Å; F753-I755 PolarHBondContact O-N 2.95Å; I755-N758 PolarHBondContact O-N 2.94Å; I755-R759 WeakPolarHBondContact O-CB 3.49Å; I755-R759 PolarHBondContact O-N 2.92Å
756	N	71.2	Confident	70.4	Confident	83 Å²	83	96.9 Å²	96.9	44%	0.444	46%	0.455	S	S	.	.	H	α-helix	trans	-71.4	-38.8	-178.6	-158.2	28.6	0	0	0	112.2	L752 F753 N758 R759 N760	L752-N756 PolarHBondContact O-N 3.24Å; F753-N756 PolarHBondContact O-N 2.91Å; F753-N756 VanDerWaalsContact O-N 3.14Å; N756-N758 VanDerWaalsContact C-N 3.33Å; N756-N758 PolarHBondContact O-N 2.96Å; N756-R759 PolarHBondContact O-N 3.42Å; N756-N760 WeakPolarHBondContact O-CB 3.44Å; N756-N760 VanDerWaalsContact O-CG 3.3Å; N756-N760 PolarHBondContact O-N 3.11Å
757	T	70.1	Confident	68.8	Low	74 Å²	74	99.6 Å²	99.6	45%	0.454	47%	0.47	S	S	.	.	H	α-helix	trans	-58.6	-45.5	171.9	-45.6	0	0	0	0	111	F753 N760 H761	F753-T757 PolarHBondContact O-N 3.42Å; F753-T757 PolarHBondContact O-OG1 3.29Å; T757-N760 PolarHBondContact O-N 3.41Å; T757-H761 PolarHBondContact O-N 2.82Å
758	N	66	Low	67.1	Low	93 Å²	93	100.5 Å²	100.5	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-66.7	-40	177.6	-71.3	12.1	0	0	0	112.4	H754 I755 N756 H761 Y762	H754-N758 PolarHBondContact CE1-OD1 3.05Å; H754-N758 PolarHBondContact ND1-ND2 3.49Å; H754-N758 PolarHBondContact ND1-OD1 3.21Å; H754-N758 WeakPolarHBondContact O-CB 3.32Å; H754-N758 VanDerWaalsContact O-CG 3.23Å; H754-N758 PolarHBondContact O-N 3.36Å; H754-N758 VanDerWaalsContact O-N 3.11Å; H754-N758 PolarHBondContact O-OD1 3.01Å; I755-N758 PolarHBondContact O-N 2.94Å; N756-N758 VanDerWaalsContact C-N 3.33Å; N756-N758 PolarHBondContact O-N 2.96Å; N758-H761 WeakPolarHBondContact O-CB 3.39Å; N758-H761 PolarHBondContact O-N 3.22Å; N758-Y762 PolarHBondContact O-N 3.24Å
759	R	65.1	Low	65.2	Low	169 Å²	169	103.8 Å²	103.8	64%	0.638	49%	0.492	S	S	*	.	H	α-helix	trans	-64.8	-40.8	177.1	-179.3	171.9	171.5	144.8	-2.9	111.4	I755 N756 Y762 I763	I755-R759 WeakPolarHBondContact O-CB 3.49Å; I755-R759 PolarHBondContact O-N 2.92Å; N756-R759 PolarHBondContact O-N 3.42Å; R759-Y762 PolarHBondContact O-N 2.92Å; R759-I763 HydrophobicContact CG-CD1 3.85Å; R759-I763 WeakPolarHBondContact O-CG1 3.44Å; R759-I763 PolarHBondContact O-N 2.75Å
760	N	60	Low	63.7	Low	76 Å²	76	109.5 Å²	109.5	41%	0.406	52%	0.519	S	S	.	.	H	α-helix	trans	-68.4	-34.4	175.4	-70.1	-13.2	0	0	0	112	N756 T757 N764	N756-N760 WeakPolarHBondContact O-CB 3.44Å; N756-N760 VanDerWaalsContact O-CG 3.3Å; N756-N760 PolarHBondContact O-N 3.11Å; T757-N760 PolarHBondContact O-N 3.41Å; N760-N764 VanDerWaalsContact O-CB 3.24Å; N760-N764 WeakPolarHBondContact O-CB 3.38Å; N760-N764 PolarHBondContact O-N 2.77Å; N760-N764 PolarHBondContact O-ND2 3.28Å
761	H	58.5	Low	61.8	Low	116 Å²	116	109.7 Å²	109.7	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-59	-51.1	170.2	-162	-74.1	0	0	0	111.1	T757 N758 I763 N764 E765	T757-H761 PolarHBondContact O-N 2.82Å; N758-H761 WeakPolarHBondContact O-CB 3.39Å; N758-H761 PolarHBondContact O-N 3.22Å; H761-I763 PolarHBondContact O-N 2.98Å; H761-N764 PolarHBondContact O-N 3.45Å; H761-E765 IonicContact CE1-OE1 3.65Å; H761-E765 PolarHBondContact CE1-OE1 3.2Å; H761-E765 IonicContact CE1-OE2 2.78Å; H761-E765 PolarHBondContact CE1-OE2 3.4Å; H761-E765 IonicContact CG-OE2 3.45Å; H761-E765 IonicContact ND1-OE1 3.55Å; H761-E765 IonicContact ND1-OE2 3.98Å; H761-E765 PolarHBondContact ND1-OE2 3.35Å; H761-E765 WeakPolarHBondContact O-CG 3.19Å; H761-E765 PolarHBondContact O-N 3.4Å
762	Y	51	Low	59.7	Low	134 Å²	134	111.4 Å²	111.4	53%	0.525	54%	0.536	S	S	.	.	H	α-helix	trans	-65.2	-35.2	-179.3	-175.9	-101.3	0	0	0	113.9	N758 R759 K766	N758-Y762 PolarHBondContact O-N 3.24Å; R759-Y762 PolarHBondContact O-N 2.92Å; Y762-K766 HydrophobicContact CE1-CD 3.94Å; Y762-K766 PolarHBondContact O-N 3.02Å; Y762-K766 VanDerWaalsContact O-N 3.16Å; Y762-K766 WeakPolarHBondContact OH-CE 3.3Å; Y762-K766 PolarHBondContact OH-NZ 2.86Å
763	I	60.5	Low	58.1	Low	63 Å²	63	117.3 Å²	117.3	32%	0.323	57%	0.566	S	S	.	*	H	α-helix	trans	-70.8	-41.3	174.3	-69.3	169.4	0	0	0	110.6	R759 H761 K766 N767	R759-I763 HydrophobicContact CG-CD1 3.85Å; R759-I763 WeakPolarHBondContact O-CG1 3.44Å; R759-I763 PolarHBondContact O-N 2.75Å; H761-I763 PolarHBondContact O-N 2.98Å; I763-K766 PolarHBondContact O-N 3.46Å; I763-N767 PolarHBondContact O-N 2.89Å
764	N	55.3	Low	56.1	Low	84 Å²	84	117.1 Å²	117.1	45%	0.449	57%	0.571	S	S	.	*	H	α-helix	trans	-65.6	-41.4	176.1	-71.9	-13.7	0	0	0	111.6	N760 H761 K766 N767 Q768	N760-N764 VanDerWaalsContact O-CB 3.24Å; N760-N764 WeakPolarHBondContact O-CB 3.38Å; N760-N764 PolarHBondContact O-N 2.77Å; N760-N764 PolarHBondContact O-ND2 3.28Å; H761-N764 PolarHBondContact O-N 3.45Å; N764-K766 VanDerWaalsContact C-N 3.29Å; N764-K766 PolarHBondContact O-N 2.98Å; N764-N767 PolarHBondContact O-N 3.15Å; N764-Q768 VanDerWaalsContact O-CB 3.24Å; N764-Q768 WeakPolarHBondContact O-CB 3.16Å; N764-Q768 VanDerWaalsContact O-CG 3.24Å; N764-Q768 WeakPolarHBondContact O-CG 3.26Å; N764-Q768 PolarHBondContact O-N 3.32Å
765	E	57	Low	54.6	Low	96 Å²	96	120.2 Å²	120.2	45%	0.449	59%	0.586	S	S	.	*	H	α-helix	trans	-60.5	-36.9	173.3	-75.9	173.7	121.3	0	0	112.3	H761 N769	H761-E765 IonicContact CE1-OE1 3.65Å; H761-E765 PolarHBondContact CE1-OE1 3.2Å; H761-E765 IonicContact CE1-OE2 2.78Å; H761-E765 PolarHBondContact CE1-OE2 3.4Å; H761-E765 IonicContact CG-OE2 3.45Å; H761-E765 IonicContact ND1-OE1 3.55Å; H761-E765 IonicContact ND1-OE2 3.98Å; H761-E765 PolarHBondContact ND1-OE2 3.35Å; H761-E765 WeakPolarHBondContact O-CG 3.19Å; H761-E765 PolarHBondContact O-N 3.4Å; E765-N769 PolarHBondContact O-ND2 2.99Å
766	K	51.3	Low	52.8	Low	126 Å²	126	121.9 Å²	121.9	55%	0.548	60%	0.603	S	S	.	*	H	α-helix	trans	-69.8	-36.8	174.2	-94.7	179	164.7	170.9	0	113.4	Y762 I763 N764	Y762-K766 HydrophobicContact CE1-CD 3.94Å; Y762-K766 PolarHBondContact O-N 3.02Å; Y762-K766 VanDerWaalsContact O-N 3.16Å; Y762-K766 WeakPolarHBondContact OH-CE 3.3Å; Y762-K766 PolarHBondContact OH-NZ 2.86Å; I763-K766 PolarHBondContact O-N 3.46Å; N764-K766 VanDerWaalsContact C-N 3.29Å; N764-K766 PolarHBondContact O-N 2.98Å
767	N	53.4	Low	51.5	Low	117 Å²	117	125.8 Å²	125.8	63%	0.626	62%	0.623	S	S	*	*	H	α-helix	trans	-86.2	-23.7	-177.9	-69.5	-7.5	0	0	0	113.7	I763 N764	I763-N767 PolarHBondContact O-N 2.89Å; N764-N767 PolarHBondContact O-N 3.15Å
768	Q	49.2	Very low	49.9	Very low	125 Å²	125	128.8 Å²	128.8	58%	0.584	64%	0.635	S	S	*	*	H	α-helix	trans	-79.4	-16	179.9	-75.3	177.6	-10.3	0	0	113.8	N764 H770 N771	N764-Q768 VanDerWaalsContact O-CB 3.24Å; N764-Q768 WeakPolarHBondContact O-CB 3.16Å; N764-Q768 VanDerWaalsContact O-CG 3.24Å; N764-Q768 WeakPolarHBondContact O-CG 3.26Å; N764-Q768 PolarHBondContact O-N 3.32Å; Q768-H770 PolarHBondContact O-N 3.27Å; Q768-N771 PolarHBondContact O-N 2.81Å
769	N	45.6	Very low	48.5	Very low	138 Å²	138	129.4 Å²	129.4	74%	0.738	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	0.5	173.8	-79.5	-32.5	0	0	0	114.9	E765	E765-N769 PolarHBondContact O-ND2 2.99Å
770	H	50.7	Low	47.4	Very low	172 Å²	172	128.5 Å²	128.5	80%	0.796	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	-5.2	177.1	-98.7	-67.1	0	0	0	116.3	Q768	Q768-H770 PolarHBondContact O-N 3.27Å
771	N	42.7	Very low	46.3	Very low	137 Å²	137	132 Å²	132	73%	0.733	67%	0.669	S	S	*	*			trans	-146.9	100.4	177.2	-90.6	-53.5	0	0	0	112.1	Q768	Q768-N771 PolarHBondContact O-N 2.81Å
772	H	38.7	Very low	45.6	Very low	181 Å²	181	132.4 Å²	132.4	84%	0.838	67%	0.674	S	S	*	*			trans	-105	70.7	-169.3	-147.2	-66.7	0	0	0	111.8
773	I	43.7	Very low	44.9	Very low	152 Å²	152	132.7 Å²	132.7	78%	0.779	69%	0.685	S	S	*	*			trans	-118.9	128.3	177.3	-59.8	-176.9	0	0	0	111.4
774	N	33.2	Very low	43.9	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	71%	0.705	S	S	*	*			trans	-59.1	136.5	-172.8	-46.6	-58.1	0	0	0	114
775	H	45.5	Very low	43.1	Very low	183 Å²	183	137.4 Å²	137.4	85%	0.847	72%	0.717	S	S	*	*			trans	-147.5	101.9	146.3	-97.9	-68.2	0	0	0	111.9
776	S	39.6	Very low	42.2	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	72%	0.723	S	S	*	*			trans	-78.5	133.2	169.3	-52.7	0	0	0	0	110.2
777	I	44.1	Very low	41.6	Very low	166 Å²	166	140.7 Å²	140.7	85%	0.851	74%	0.743	S	S	*	*			trans	-116.4	122.6	169	-61.8	-179.3	0	0	0	108.2
778	L	37.4	Very low	40.6	Very low	136 Å²	136	143.6 Å²	143.6	71%	0.712	75%	0.75	S	S	*	*			trans	-78.2	158.6	-174.8	-81.7	79.7	0	0	0	112.4
779	P	36.8	Very low	39.8	Very low	107 Å²	107	147.1 Å²	147.1	70%	0.695	76%	0.764	S	S	*	*			trans	-62.4	144	164.9	29.2	-35.5	0	0	0	111	D781	P779-D781 PolarHBondContact O-N 2.79Å
780	I	41.8	Very low	39.3	Very low	149 Å²	149	147.4 Å²	147.4	76%	0.764	76%	0.764	S	S	*	*			trans	-91.5	84.5	-179.9	-56	176.7	0	0	0	109.4	I782	I780-I782 HydrophobicContact CG2-CD1 4.23Å; I780-I782 HydrophobicContact CG2-CG1 3.83Å
781	D	35.8	Very low	38.4	Very low	149 Å²	149	149.2 Å²	149.2	80%	0.797	77%	0.77	S	S	*	*			trans	-83.5	107	166.9	-78.7	-50	0	0	0	110.1	P779 D783	P779-D781 PolarHBondContact O-N 2.79Å; D781-D783 PolarHBondContact O-N 3.36Å
782	I	45.2	Very low	37.9	Very low	125 Å²	125	152.5 Å²	152.5	64%	0.641	78%	0.777	S	S	*	*			trans	-91.1	84.4	174.4	-53.8	-178.1	0	0	0	108.8	I780 I784	I780-I782 HydrophobicContact CG2-CD1 4.23Å; I780-I782 HydrophobicContact CG2-CG1 3.83Å; I782-I784 HydrophobicContact CG2-CD1 4.13Å; I782-I784 HydrophobicContact CG2-CG1 4.03Å
783	D	34.6	Very low	37.9	Very low	141 Å²	141	151.6 Å²	151.6	75%	0.754	78%	0.777	S	S	*	*			trans	-77.9	135.5	167	-159	-3.6	0	0	0	110.2	D781	D781-D783 PolarHBondContact O-N 3.36Å
784	I	39.7	Very low	37.5	Very low	146 Å²	146	149.8 Å²	149.8	75%	0.749	78%	0.778	S	S	*	*			trans	-129.5	81.6	175	-58.6	-176.2	0	0	0	107.2	I782 S786	I782-I784 HydrophobicContact CG2-CD1 4.13Å; I782-I784 HydrophobicContact CG2-CG1 4.03Å; I784-S786 VanDerWaalsContact C-N 3.33Å; I784-S786 PolarHBondContact O-N 3.2Å
785	S	39.8	Very low	37.4	Very low	100 Å²	100	149.6 Å²	149.6	70%	0.699	79%	0.785	S	S	*	*			trans	-70.7	79.9	-176.9	59.1	0	0	0	0	112.7
786	S	36.9	Very low	36.9	Very low	82 Å²	82	148.7 Å²	148.7	57%	0.573	79%	0.787	S	S	*	*			trans	32.5	90.5	149.5	64.9	0	0	0	0	118.9	I784 K788	I784-S786 VanDerWaalsContact C-N 3.33Å; I784-S786 PolarHBondContact O-N 3.2Å; S786-K788 PolarHBondContact O-N 3.32Å; S786-K788 VanDerWaalsContact O-N 3.08Å
787	E	38.7	Very low	36.8	Very low	208 Å²	208	152.6 Å²	152.6	97%	0.972	79%	0.793	S	S	*	*			trans	-68.1	103	153.5	-72.6	-167.7	128	0	0	109.9
788	K	32.2	Very low	36.5	Very low	178 Å²	178	148.3 Å²	148.3	77%	0.774	78%	0.778	S	S	*	*			trans	-115.5	85.6	170.9	-74.8	179	-178.9	169	0	110	S786	S786-K788 PolarHBondContact O-N 3.32Å; S786-K788 VanDerWaalsContact O-N 3.08Å
789	F	33.5	Very low	36.7	Very low	200 Å²	200	148.2 Å²	148.2	88%	0.877	79%	0.785	S	S	*	*			trans	-137.6	144	168.9	-114.5	-95.7	0	0	0	113
790	I	35	Very low	36.9	Very low	143 Å²	143	150.4 Å²	150.4	73%	0.733	78%	0.784	S	S	*	*			trans	54.5	93.2	169.4	-35.6	-177.3	0	0	0	117.8
791	K	32.2	Very low	36.9	Very low	211 Å²	211	147.7 Å²	147.7	92%	0.917	77%	0.768	S	S	*	*				-171.3	104	118.2	-103.8	159.1	-172	172.4	0	113.1
792	K	30.6	Very low	37.1	Very low	205 Å²	205	147.4 Å²	147.4	89%	0.891	76%	0.761	S	S	*	*			trans	-137.8	119.8	166.3	177.8	-172.8	-178.7	-174.4	0	106.9
793	I	39.7	Very low	37.3	Very low	163 Å²	163	147 Å²	147	84%	0.836	76%	0.759	S	S	*	*			trans	-177.8	144.2	157.8	-99.8	152	0	0	0	108.5
794	S	35.7	Very low	38.1	Very low	113 Å²	113	144.3 Å²	144.3	79%	0.79	74%	0.744	S	S	*	*			trans	39.6	108.3	169.5	-59.7	0	0	0	0	120
795	C	30.2	Very low	38.6	Very low	129 Å²	129	140.8 Å²	140.8	87%	0.872	73%	0.726	S	S	*	*			trans	-84.4	153	147.1	-61.6	0	0	0	0	109.8
796	N	35.1	Very low	38.6	Very low	164 Å²	164	142.6 Å²	142.6	88%	0.877	72%	0.721	S	S	*	*			trans	-148.5	159.4	152.3	-130.3	-19.5	0	0	0	110.9
797	H	38	Very low	39.3	Very low	190 Å²	190	143.3 Å²	143.3	88%	0.88	72%	0.719	S	S	*	*			trans	-67	138.8	-162.3	-93.2	-134.1	0	0	0	115.8
798	S	37.8	Very low	40	Very low	76 Å²	76	139.5 Å²	139.5	53%	0.531	70%	0.699	S	S	.	*			trans	-161.6	146.4	141.4	64.4	0	0	0	0	111.7	K800	S798-K800 PolarHBondContact O-N 3.03Å
799	P	41.6	Very low	40.8	Very low	134 Å²	134	134.7 Å²	134.7	87%	0.87	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	18.4	-172.4	29.5	-35.9	0	0	0	115.6	H801	P799-H801 VanDerWaalsContact C-N 3.26Å; P799-H801 PolarHBondContact O-N 2.91Å
800	K	39.7	Very low	42	Very low	152 Å²	152	129.5 Å²	129.5	66%	0.661	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-5.3	-178.7	-64.7	178.6	179.9	175.5	0	113.8	S798 H802	S798-K800 PolarHBondContact O-N 3.03Å; K800-H802 PolarHBondContact O-N 3.5Å
801	H	42.9	Very low	43.1	Very low	92 Å²	92	127.7 Å²	127.7	43%	0.426	65%	0.654	S	S	.	*	H	α-helix	trans	-71.8	-23.1	-167.4	-153.9	-49.2	0	0	0	114.5	P799 L805	P799-H801 VanDerWaalsContact C-N 3.26Å; P799-H801 PolarHBondContact O-N 2.91Å; H801-L805 WeakPolarHBondContact O-CG 3.16Å; H801-L805 PolarHBondContact O-N 2.98Å
802	H	40.8	Very low	44.4	Very low	143 Å²	143	118.4 Å²	118.4	66%	0.662	62%	0.615	S	S	*	*	H	α-helix	trans	-73.8	-35.3	-176.8	-138.4	-57.2	0	0	0	113.2	K800 L805 K806	K800-H802 PolarHBondContact O-N 3.5Å; H802-L805 PolarHBondContact O-N 2.82Å; H802-K806 PolarHBondContact O-N 3.03Å; H802-K806 VanDerWaalsContact O-N 3.16Å
803	I	49.5	Very low	45.9	Very low	117 Å²	117	112.7 Å²	112.7	60%	0.6	60%	0.595	S	S	*	*	H	α-helix	trans	-68.5	-43.4	176.1	-59	174.4	0	0	0	110	L805 K806 N807	I803-L805 VanDerWaalsContact C-N 3.26Å; I803-L805 PolarHBondContact O-N 3.08Å; I803-K806 PolarHBondContact O-N 2.89Å; I803-N807 PolarHBondContact O-N 3.34Å
804	I	50.9	Low	47.1	Very low	84 Å²	84	111.5 Å²	111.5	43%	0.431	58%	0.583	S	S	.	*	H	α-helix	trans	-61.1	-35.7	179	-62.3	170.5	0	0	0	111.4	K808	I804-K808 HydrophobicContact CG2-CD 4.37Å; I804-K808 WeakPolarHBondContact O-CG 3.19Å; I804-K808 PolarHBondContact O-N 3.32Å; I804-K808 VanDerWaalsContact O-N 3.15Å
805	L	48.6	Very low	48.6	Very low	72 Å²	72	110 Å²	110	38%	0.377	56%	0.564	S	S	.	*	H	α-helix	trans	-73.7	-42.2	176.2	-72.2	169.5	0	0	0	112.6	H801 H802 I803 N807 K808 N809	H801-L805 WeakPolarHBondContact O-CG 3.16Å; H801-L805 PolarHBondContact O-N 2.98Å; H802-L805 PolarHBondContact O-N 2.82Å; I803-L805 VanDerWaalsContact C-N 3.26Å; I803-L805 PolarHBondContact O-N 3.08Å; L805-N807 PolarHBondContact O-N 3.23Å; L805-K808 PolarHBondContact O-N 2.91Å; L805-N809 PolarHBondContact O-N 3.46Å; L805-N809 VanDerWaalsContact O-N 3.14Å
806	K	41	Very low	50.4	Low	138 Å²	138	108.3 Å²	108.3	60%	0.6	54%	0.542	S	S	*	.	H	α-helix	trans	-57.3	-47.9	171.6	-82	-171.1	172.8	-177	0	111	H802 I803 K808 N809 I810	H802-K806 PolarHBondContact O-N 3.03Å; H802-K806 VanDerWaalsContact O-N 3.16Å; I803-K806 PolarHBondContact O-N 2.89Å; K806-K808 PolarHBondContact O-N 2.73Å; K806-N809 PolarHBondContact O-N 2.91Å; K806-I810 VanDerWaalsContact O-CG1 3.29Å; K806-I810 WeakPolarHBondContact O-CG1 3.37Å; K806-I810 PolarHBondContact O-N 3.37Å
807	N	51.2	Low	52.2	Low	98 Å²	98	108.1 Å²	108.1	52%	0.524	53%	0.533	S	S	.	.	H	α-helix	trans	-61.4	-40.7	179.9	-74.3	4.2	0	0	0	112.9	I803 L805 N809 I810 L811	I803-N807 PolarHBondContact O-N 3.34Å; L805-N807 PolarHBondContact O-N 3.23Å; N807-N809 PolarHBondContact O-N 3.04Å; N807-I810 PolarHBondContact O-N 3.34Å; N807-L811 WeakPolarHBondContact O-CB 3.42Å; N807-L811 PolarHBondContact O-N 3.21Å
808	K	52.9	Low	53.8	Low	128 Å²	128	101.3 Å²	101.3	56%	0.557	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-40.6	175.8	-75.8	174.9	179.3	-176.6	0	112.7	I804 L805 K806 S812	I804-K808 HydrophobicContact CG2-CD 4.37Å; I804-K808 WeakPolarHBondContact O-CG 3.19Å; I804-K808 PolarHBondContact O-N 3.32Å; I804-K808 VanDerWaalsContact O-N 3.15Å; L805-K808 PolarHBondContact O-N 2.91Å; K806-K808 PolarHBondContact O-N 2.73Å; K808-S812 WeakPolarHBondContact O-CB 3.19Å; K808-S812 PolarHBondContact O-N 3.45Å; K808-S812 VanDerWaalsContact O-N 3.12Å
809	N	50.8	Low	55.6	Low	77 Å²	77	98.8 Å²	98.8	41%	0.412	49%	0.491	S	S	.	.	H	α-helix	trans	-68.9	-39.8	176.6	-71	-7.2	0	0	0	112.1	L805 K806 N807 N813	L805-N809 PolarHBondContact O-N 3.46Å; L805-N809 VanDerWaalsContact O-N 3.14Å; K806-N809 PolarHBondContact O-N 2.91Å; N807-N809 PolarHBondContact O-N 3.04Å; N809-N813 WeakPolarHBondContact O-CB 3.29Å; N809-N813 PolarHBondContact O-N 2.98Å
810	I	58.7	Low	57.2	Low	90 Å²	90	98.9 Å²	98.9	46%	0.462	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-45.6	176.3	-68.1	163.7	0	0	0	110.8	K806 N807 S812 N813 K814	K806-I810 VanDerWaalsContact O-CG1 3.29Å; K806-I810 WeakPolarHBondContact O-CG1 3.37Å; K806-I810 PolarHBondContact O-N 3.37Å; N807-I810 PolarHBondContact O-N 3.34Å; I810-S812 PolarHBondContact O-N 3.06Å; I810-N813 PolarHBondContact O-N 3.26Å; I810-K814 PolarHBondContact O-N 3.11Å
811	L	57.7	Low	59.1	Low	105 Å²	105	92.6 Å²	92.6	55%	0.55	45%	0.452	S	S	.	.	H	α-helix	trans	-59.6	-49.2	178.2	-156.5	81.7	0	0	0	110.9	N807 N813 K814 E815	N807-L811 WeakPolarHBondContact O-CB 3.42Å; N807-L811 PolarHBondContact O-N 3.21Å; L811-N813 VanDerWaalsContact C-N 3.26Å; L811-N813 PolarHBondContact O-N 3.35Å; L811-K814 WeakPolarHBondContact O-CA 3.34Å; L811-K814 WeakPolarHBondContact O-CB 3.18Å; L811-K814 PolarHBondContact O-N 3.43Å; L811-E815 WeakPolarHBondContact O-CG 3.44Å; L811-E815 PolarHBondContact O-N 3.18Å
812	S	58.7	Low	60.7	Low	16 Å²	16	89.7 Å²	89.7	11%	0.112	44%	0.439	C	S	.	.	H	α-helix	trans	-61.7	-32.1	177.6	-173	0	0	0	0	113.1	H234 K808 I810 K816	H234-S812 PolarHBondContact CE1-OG 3.26Å; K808-S812 WeakPolarHBondContact O-CB 3.19Å; K808-S812 PolarHBondContact O-N 3.45Å; K808-S812 VanDerWaalsContact O-N 3.12Å; I810-S812 PolarHBondContact O-N 3.06Å; S812-K816 WeakPolarHBondContact O-CG 3.38Å; S812-K816 PolarHBondContact O-N 3.47Å; S812-K816 VanDerWaalsContact O-N 3.09Å
813	N	62.5	Low	62.8	Low	86 Å²	86	85.3 Å²	85.3	46%	0.46	43%	0.428	S	S	.	.	H	α-helix	trans	-74.9	-30.5	173.4	-76.5	-15.9	0	0	0	113.2	N809 I810 L811 K816 K817	N809-N813 WeakPolarHBondContact O-CB 3.29Å; N809-N813 PolarHBondContact O-N 2.98Å; I810-N813 PolarHBondContact O-N 3.26Å; L811-N813 VanDerWaalsContact C-N 3.26Å; L811-N813 PolarHBondContact O-N 3.35Å; N813-K816 PolarHBondContact OD1-NZ 3.06Å; N813-K817 PolarHBondContact O-N 3.47Å
814	K	64.4	Low	64.5	Low	138 Å²	138	82 Å²	82	60%	0.6	41%	0.411	S	S	*	.	H	α-helix	trans	-67.3	-44.5	168.3	-72.2	-169.8	174.7	-167.9	0	111.2	I810 L811 K816 K817 A818	I810-K814 PolarHBondContact O-N 3.11Å; L811-K814 WeakPolarHBondContact O-CA 3.34Å; L811-K814 WeakPolarHBondContact O-CB 3.18Å; L811-K814 PolarHBondContact O-N 3.43Å; K814-K816 PolarHBondContact O-N 3.3Å; K814-K817 PolarHBondContact O-N 3.41Å; K814-K817 VanDerWaalsContact O-N 3.16Å; K814-A818 PolarHBondContact O-N 3.03Å; K814-A818 VanDerWaalsContact O-N 3.12Å
815	E	67	Low	66	Low	82 Å²	82	78.5 Å²	78.5	38%	0.383	39%	0.394	S	S	.	.	H	α-helix	trans	-54.9	-50.1	175.8	-71.3	169.8	177.6	0	0	111.8	L811 K817 A818 T819	L811-E815 WeakPolarHBondContact O-CG 3.44Å; L811-E815 PolarHBondContact O-N 3.18Å; E815-K817 VanDerWaalsContact C-N 3.31Å; E815-K817 PolarHBondContact O-N 2.91Å; E815-A818 PolarHBondContact O-N 2.92Å; E815-T819 PolarHBondContact O-N 3.1Å; E815-T819 PolarHBondContact O-OG1 3.48Å
816	K	69.1	Low	67.8	Low	93 Å²	93	75.8 Å²	75.8	40%	0.404	38%	0.38	S	S	.	.	H	α-helix	trans	-53.4	-44.2	175.3	-73.2	171.2	-166.3	165.8	0	113.2	H234 S812 N813 K814 T819 K820	H234-K816 WeakPolarHBondContact CE1-CE 3.1Å; H234-K816 WeakPolarHBondContact NE2-CE 3.29Å; S812-K816 WeakPolarHBondContact O-CG 3.38Å; S812-K816 PolarHBondContact O-N 3.47Å; S812-K816 VanDerWaalsContact O-N 3.09Å; N813-K816 PolarHBondContact OD1-NZ 3.06Å; K814-K816 PolarHBondContact O-N 3.3Å; K816-T819 PolarHBondContact O-N 2.77Å; K816-K820 WeakPolarHBondContact O-CB 3.49Å; K816-K820 PolarHBondContact O-N 3.33Å
817	K	71.7	Confident	70.1	Confident	159 Å²	159	71.4 Å²	71.4	69%	0.691	37%	0.373	S	S	*	.	H	α-helix	trans	-62.8	-48.3	-179.6	-74.4	-174.5	177.1	-170.5	0	110.2	N813 K814 E815 T819 K820 T821	N813-K817 PolarHBondContact O-N 3.47Å; K814-K817 PolarHBondContact O-N 3.41Å; K814-K817 VanDerWaalsContact O-N 3.16Å; E815-K817 VanDerWaalsContact C-N 3.31Å; E815-K817 PolarHBondContact O-N 2.91Å; K817-T819 PolarHBondContact O-N 3.26Å; K817-K820 PolarHBondContact O-N 2.66Å; K817-T821 PolarHBondContact O-N 3.36Å; K817-T821 PolarHBondContact O-OG1 3.06Å; K817-T821 VanDerWaalsContact O-OG1 3.11Å
818	A	71.3	Confident	72	Confident	47 Å²	47	68.4 Å²	68.4	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-58.7	-47.6	176.2	0	0	0	0	0	112.3	K814 E815 K820 T821 L822	K814-A818 PolarHBondContact O-N 3.03Å; K814-A818 VanDerWaalsContact O-N 3.12Å; E815-A818 PolarHBondContact O-N 2.92Å; A818-K820 VanDerWaalsContact C-N 3.3Å; A818-K820 PolarHBondContact O-N 2.83Å; A818-T821 PolarHBondContact O-N 3.42Å; A818-L822 WeakPolarHBondContact O-CB 3.39Å; A818-L822 WeakPolarHBondContact O-CD1 3.38Å; A818-L822 VanDerWaalsContact O-CG 3.24Å; A818-L822 WeakPolarHBondContact O-CG 3.44Å; A818-L822 PolarHBondContact O-N 3.36Å
819	T	75.6	Confident	73.7	Confident	23 Å²	23	62.3 Å²	62.3	14%	0.141	33%	0.332	C	S	.	.	H	α-helix	trans	-62.6	-34.7	177	-52.6	0	0	0	0	112.6	I226 I230 E815 K816 K817 A823	I226-T819 HydrophobicContact CG2-CG2 4.1Å; I230-T819 HydrophobicContact CD1-CG2 3.91Å; I230-T819 WeakPolarHBondContact CD1-OG1 3.46Å; E815-T819 PolarHBondContact O-N 3.1Å; E815-T819 PolarHBondContact O-OG1 3.48Å; K816-T819 PolarHBondContact O-N 2.77Å; K817-T819 PolarHBondContact O-N 3.26Å; T819-A823 WeakPolarHBondContact O-CB 2.97Å; T819-A823 PolarHBondContact O-N 2.92Å
820	K	76.9	Confident	75.7	Confident	137 Å²	137	60.6 Å²	60.6	60%	0.596	32%	0.322	S	S	*	.	H	α-helix	trans	-64.5	-48.1	173.9	-176	-178.1	176	-176.6	0	111.4	K816 K817 A818 L822 A823 I824	K816-K820 WeakPolarHBondContact O-CB 3.49Å; K816-K820 PolarHBondContact O-N 3.33Å; K817-K820 PolarHBondContact O-N 2.66Å; A818-K820 VanDerWaalsContact C-N 3.3Å; A818-K820 PolarHBondContact O-N 2.83Å; K820-L822 VanDerWaalsContact C-N 3.32Å; K820-L822 PolarHBondContact O-N 3.02Å; K820-A823 PolarHBondContact O-N 3.07Å; K820-I824 HydrophobicContact CG-CD1 4.09Å; K820-I824 WeakPolarHBondContact O-CG1 3.43Å; K820-I824 PolarHBondContact O-N 3.4Å
821	T	78.9	Confident	77.3	Confident	20 Å²	20	59.4 Å²	59.4	12%	0.123	33%	0.326	C	S	.	.	H	α-helix	trans	-56.1	-49	176.5	-51.8	0	0	0	0	111	K817 A818 A823 I824 V825 I881 F885	K817-T821 PolarHBondContact O-N 3.36Å; K817-T821 PolarHBondContact O-OG1 3.06Å; K817-T821 VanDerWaalsContact O-OG1 3.11Å; A818-T821 PolarHBondContact O-N 3.42Å; T821-A823 PolarHBondContact O-N 3.21Å; T821-I824 WeakPolarHBondContact O-CB 3.16Å; T821-I824 PolarHBondContact O-N 3.42Å; T821-I824 VanDerWaalsContact O-N 3.08Å; T821-V825 WeakPolarHBondContact O-CG2 3.45Å; T821-V825 PolarHBondContact O-N 3.08Å; T821-I881 HydrophobicContact CG2-CG2 4.17Å; T821-F885 HydrophobicContact CG2-CB 3.52Å; T821-F885 HydrophobicContact CG2-CG 4.36Å; T821-F885 WeakPolarHBondContact OG1-CB 3.46Å
822	L	76.9	Confident	79	Confident	30 Å²	30	54.7 Å²	54.7	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-41.1	179.1	-76.2	167.2	0	0	0	112.7	I140 R144 Y223 A818 K820 I824 V825 L826	I140-L822 HydrophobicContact CG2-CD2 3.88Å; R144-L822 HydrophobicContact CB-CD1 4.26Å; R144-L822 HydrophobicContact CG-CD1 3.67Å; R144-L822 HydrophobicContact CG-CD2 4.35Å; Y223-L822 HydrophobicContact CE1-CB 3.73Å; Y223-L822 WeakPolarHBondContact OH-CB 3.35Å; Y223-L822 PolarHBondContact OH-O 2.77Å; A818-L822 WeakPolarHBondContact O-CB 3.39Å; A818-L822 WeakPolarHBondContact O-CD1 3.38Å; A818-L822 VanDerWaalsContact O-CG 3.24Å; A818-L822 WeakPolarHBondContact O-CG 3.44Å; A818-L822 PolarHBondContact O-N 3.36Å; K820-L822 VanDerWaalsContact C-N 3.32Å; K820-L822 PolarHBondContact O-N 3.02Å; L822-I824 VanDerWaalsContact C-N 3.33Å; L822-I824 PolarHBondContact O-N 2.82Å; L822-V825 PolarHBondContact O-N 2.89Å; L822-L826 PolarHBondContact O-N 3.02Å; L822-L826 VanDerWaalsContact O-N 3.1Å
823	A	83.9	Confident	80.6	Confident	51 Å²	51	54 Å²	54	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-68.5	-29.8	174.7	0	0	0	0	0	113.2	T819 K820 T821 G827	T819-A823 WeakPolarHBondContact O-CB 2.97Å; T819-A823 PolarHBondContact O-N 2.92Å; K820-A823 PolarHBondContact O-N 3.07Å; T821-A823 PolarHBondContact O-N 3.21Å; A823-G827 PolarHBondContact O-N 3.2Å; A823-G827 VanDerWaalsContact O-N 3.08Å
824	I	85.3	Confident	82.1	Confident	49 Å²	49	53.8 Å²	53.8	25%	0.251	30%	0.295	S	S	.	.	H	α-helix	trans	-70.7	-43.7	173	-67.4	165.9	0	0	0	110.4	K820 T821 L822 L826 G827 V828 F885	K820-I824 HydrophobicContact CG-CD1 4.09Å; K820-I824 WeakPolarHBondContact O-CG1 3.43Å; K820-I824 PolarHBondContact O-N 3.4Å; T821-I824 WeakPolarHBondContact O-CB 3.16Å; T821-I824 PolarHBondContact O-N 3.42Å; T821-I824 VanDerWaalsContact O-N 3.08Å; L822-I824 VanDerWaalsContact C-N 3.33Å; L822-I824 PolarHBondContact O-N 2.82Å; I824-L826 VanDerWaalsContact C-N 3.31Å; I824-L826 PolarHBondContact O-N 2.04Å; I824-G827 PolarHBondContact O-N 3.36Å; I824-G827 VanDerWaalsContact O-N 3.12Å; I824-V828 HydrophobicContact CG2-CG2 4.46Å; I824-V828 WeakPolarHBondContact O-CG2 3.48Å; I824-V828 PolarHBondContact O-N 2.83Å; I824-F885 HydrophobicContact CD1-CD1 4.33Å; I824-F885 HydrophobicContact CD1-CE1 3.78Å; I824-F885 HydrophobicContact CD1-CE2 4.15Å; I824-F885 HydrophobicContact CD1-CZ 3.68Å; I824-F885 HydrophobicContact CG2-CE2 4.24Å
825	V	83.5	Confident	83.4	Confident	10 Å²	10	48.3 Å²	48.3	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-53.8	-48.4	173.1	174.6	0	0	0	0	110.4	L137 T821 L822 G827 V828 F829 I881	L137-V825 HydrophobicContact CD2-CG1 3.7Å; T821-V825 WeakPolarHBondContact O-CG2 3.45Å; T821-V825 PolarHBondContact O-N 3.08Å; L822-V825 PolarHBondContact O-N 2.89Å; V825-G827 PolarHBondContact O-N 3.46Å; V825-V828 PolarHBondContact O-N 2.95Å; V825-F829 WeakPolarHBondContact O-CB 3.33Å; V825-F829 PolarHBondContact O-N 3.36Å; V825-I881 HydrophobicContact CG2-CD1 4.42Å; V825-I881 HydrophobicContact CG2-CG2 3.69Å
826	L	86.1	Confident	84.6	Confident	15 Å²	15	45.2 Å²	45.2	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-42.1	176	-72.7	-150.2	0	0	0	113.8	L219 Y223 L822 I824 V828 F829 L830	L219-L826 HydrophobicContact CB-CD1 4.07Å; L219-L826 HydrophobicContact CB-CD2 4.38Å; L219-L826 HydrophobicContact CD1-CD2 4.07Å; L219-L826 HydrophobicContact CD2-CD2 4Å; L219-L826 HydrophobicContact CG-CD2 4.37Å; Y223-L826 HydrophobicContact CD1-CD1 3.98Å; Y223-L826 HydrophobicContact CD1-CG 4.42Å; Y223-L826 HydrophobicContact CD2-CD1 3.32Å; Y223-L826 HydrophobicContact CD2-CG 4.12Å; Y223-L826 HydrophobicContact CE1-CD1 4.07Å; Y223-L826 HydrophobicContact CE1-CG 4.03Å; Y223-L826 HydrophobicContact CE2-CD1 3.39Å; Y223-L826 HydrophobicContact CE2-CD2 3.93Å; Y223-L826 HydrophobicContact CE2-CG 3.68Å; Y223-L826 HydrophobicContact CG-CD1 3.57Å; Y223-L826 HydrophobicContact CG-CG 4.42Å; L822-L826 PolarHBondContact O-N 3.02Å; L822-L826 VanDerWaalsContact O-N 3.1Å; I824-L826 VanDerWaalsContact C-N 3.31Å; I824-L826 PolarHBondContact O-N 2.04Å; L826-V828 VanDerWaalsContact C-N 3.34Å; L826-F829 PolarHBondContact O-N 3.29Å; L826-L830 WeakPolarHBondContact O-CB 3.48Å; L826-L830 WeakPolarHBondContact O-CG 3.24Å; L826-L830 PolarHBondContact O-N 3.21Å
827	G	88.9	Confident	85.8	Confident	45 Å²	45	41.2 Å²	41.2	46%	0.464	24%	0.242	S	C	.	.	H	α-helix	trans	-63.7	-40.6	-179.3	0	0	0	0	0	112.4	A823 I824 V825 A831	A823-G827 PolarHBondContact O-N 3.2Å; A823-G827 VanDerWaalsContact O-N 3.08Å; I824-G827 PolarHBondContact O-N 3.36Å; I824-G827 VanDerWaalsContact O-N 3.12Å; V825-G827 PolarHBondContact O-N 3.46Å; G827-A831 VanDerWaalsContact O-CB 3.25Å; G827-A831 WeakPolarHBondContact O-CB 3.32Å; G827-A831 PolarHBondContact O-N 2.89Å
828	V	91.3	Very high	86.8	Confident	35 Å²	35	34.7 Å²	34.7	21%	0.212	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-52.3	172.9	171.6	0	0	0	0	110.3	I824 V825 L826 L830 A831 C832 L877 I881	I824-V828 HydrophobicContact CG2-CG2 4.46Å; I824-V828 WeakPolarHBondContact O-CG2 3.48Å; I824-V828 PolarHBondContact O-N 2.83Å; V825-V828 PolarHBondContact O-N 2.95Å; L826-V828 VanDerWaalsContact C-N 3.34Å; V828-L830 PolarHBondContact O-N 3.29Å; V828-A831 PolarHBondContact O-N 2.87Å; V828-A831 VanDerWaalsContact O-N 3.08Å; V828-C832 PolarHBondContact O-N 3.16Å; V828-L877 HydrophobicContact CG1-CB 4.32Å; V828-L877 HydrophobicContact CG1-CD1 3.53Å; V828-I881 HydrophobicContact CB-CD1 4.36Å; V828-I881 HydrophobicContact CG1-CD1 4.33Å; V828-I881 HydrophobicContact CG2-CD1 4.25Å
829	F	89.3	Confident	87.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-52.2	-51.5	-179.5	169.8	-101.4	0	0	0	113	I134 L137 F212 L219 V825 L826 C832 W833 N874	I134-F829 HydrophobicContact CB-CE2 4.28Å; I134-F829 HydrophobicContact CB-CZ 4.17Å; I134-F829 HydrophobicContact CG1-CE2 3.67Å; I134-F829 HydrophobicContact CG1-CZ 3.77Å; I134-F829 HydrophobicContact CG2-CE2 4.26Å; I134-F829 HydrophobicContact CG2-CZ 3.66Å; L137-F829 HydrophobicContact CD1-CB 4.21Å; L137-F829 HydrophobicContact CD1-CD2 3.39Å; L137-F829 HydrophobicContact CD1-CE2 3.92Å; L137-F829 HydrophobicContact CD1-CG 3.77Å; F212-F829 HydrophobicContact CD2-CE1 4.37Å; F212-F829 AromaticContact CD2-CZ 3.98Å; F212-F829 HydrophobicContact CD2-CZ 3.98Å; F212-F829 AromaticContact CE2-CE1 3.94Å; F212-F829 HydrophobicContact CE2-CE1 3.94Å; F212-F829 AromaticContact CE2-CZ 3.92Å; F212-F829 HydrophobicContact CE2-CZ 3.92Å; L219-F829 HydrophobicContact CD1-CD1 4.18Å; L219-F829 HydrophobicContact CD1-CE1 3.92Å; V825-F829 WeakPolarHBondContact O-CB 3.33Å; V825-F829 PolarHBondContact O-N 3.36Å; L826-F829 PolarHBondContact O-N 3.29Å; F829-C832 PolarHBondContact O-N 2.78Å; F829-W833 AromaticContact CD2-CD1 3.45Å; F829-W833 VanDerWaalsContact CD2-CD1 3.45Å; F829-W833 HydrophobicContact CD2-CG 4.46Å; F829-W833 HydrophobicContact CE2-CB 4.44Å; F829-W833 AromaticContact CE2-CD1 3.29Å; F829-W833 HydrophobicContact CE2-CG 4.01Å; F829-W833 AromaticContact CE2-NE1 3.89Å; F829-W833 PolarHBondContact O-N 3.31Å; F829-N874 WeakPolarHBondContact CA-OD1 3.47Å
830	L	92	Very high	88.4	Confident	41 Å²	41	32.5 Å²	32.5	22%	0.215	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-36.2	178.9	-67.6	174.7	0	0	0	111.9	F212 A216 I220 L826 V828 C832 L834	F212-L830 HydrophobicContact CE2-CD2 4.24Å; F212-L830 HydrophobicContact CZ-CD2 4.06Å; A216-L830 HydrophobicContact CB-CD2 3.81Å; I220-L830 HydrophobicContact CD1-CD1 4.19Å; I220-L830 HydrophobicContact CG1-CD1 4.19Å; L826-L830 WeakPolarHBondContact O-CB 3.48Å; L826-L830 WeakPolarHBondContact O-CG 3.24Å; L826-L830 PolarHBondContact O-N 3.21Å; V828-L830 PolarHBondContact O-N 3.29Å; L830-C832 VanDerWaalsContact C-N 3.34Å; L830-L834 WeakPolarHBondContact O-CB 3.15Å; L830-L834 PolarHBondContact O-N 3.44Å; L830-L834 VanDerWaalsContact O-N 3.12Å
831	A	91.7	Very high	89.1	Confident	65 Å²	65	27.2 Å²	27.2	54%	0.537	18%	0.175	S	C	.	.	H	α-helix	trans	-68.6	-32.2	177	0	0	0	0	0	112.9	G827 V828 P835	G827-A831 VanDerWaalsContact O-CB 3.25Å; G827-A831 WeakPolarHBondContact O-CB 3.32Å; G827-A831 PolarHBondContact O-N 2.89Å; V828-A831 PolarHBondContact O-N 2.87Å; V828-A831 VanDerWaalsContact O-N 3.08Å; A831-P835 WeakPolarHBondContact O-CD 3.5Å
832	C	93.4	Very high	89.6	Confident	7 Å²	7	26.4 Å²	26.4	5%	0.047	17%	0.17	C	C	.	.	H	α-helix	trans	-76.9	-47.6	178.1	-78.6	0	0	0	0	113	V828 F829 L830 L870 N874	V828-C832 PolarHBondContact O-N 3.16Å; F829-C832 PolarHBondContact O-N 2.78Å; L830-C832 VanDerWaalsContact C-N 3.34Å; C832-L870 WeakPolarHBondContact CB-O 3.48Å; C832-L870 PolarHBondContact SG-O 3.45Å; C832-L870 VanDerWaalsContact SG-O 3.35Å; C832-N874 HydrophobicContact CB-CB 3.93Å
833	W	93.6	Very high	90.1	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-92.1	-29.1	-169.9	-75.3	106.6	0	0	0	115.2	C130 F212 F829 P835 F836 F837 G871 Y872	C130-W833 HydrophobicContact CB-CH2 3.94Å; C130-W833 HydrophobicContact CB-CZ2 4.37Å; C130-W833 HydrophobicContact CB-CZ3 4.49Å; C130-W833 WeakPolarHBondContact SG-CH2 3.29Å; F212-W833 HydrophobicContact CD2-CB 3.86Å; F212-W833 HydrophobicContact CE2-CB 3.53Å; F212-W833 HydrophobicContact CZ-CB 4.36Å; F829-W833 AromaticContact CD2-CD1 3.45Å; F829-W833 VanDerWaalsContact CD2-CD1 3.45Å; F829-W833 HydrophobicContact CD2-CG 4.46Å; F829-W833 HydrophobicContact CE2-CB 4.44Å; F829-W833 AromaticContact CE2-CD1 3.29Å; F829-W833 HydrophobicContact CE2-CG 4.01Å; F829-W833 AromaticContact CE2-NE1 3.89Å; F829-W833 PolarHBondContact O-N 3.31Å; W833-P835 VanDerWaalsContact C-CD 3.47Å; W833-F836 AromaticContact CE3-CD1 3.83Å; W833-F836 HydrophobicContact CE3-CD1 3.83Å; W833-F836 HydrophobicContact CE3-CE1 4.46Å; W833-F836 AromaticContact CZ3-CD1 3.75Å; W833-F836 HydrophobicContact CZ3-CD1 3.75Å; W833-F836 AromaticContact CZ3-CE1 3.99Å; W833-F836 HydrophobicContact CZ3-CE1 3.99Å; W833-F836 HydrophobicContact CZ3-CG 4.48Å; W833-F836 PolarHBondContact O-N 3.35Å; W833-F837 HydrophobicContact CB-CD2 4.08Å; W833-F837 HydrophobicContact CB-CE2 4.2Å; W833-F837 HydrophobicContact CD2-CE2 4.04Å; W833-F837 HydrophobicContact CE3-CD2 4.06Å; W833-F837 AromaticContact CE3-CE2 3.42Å; W833-F837 HydrophobicContact CE3-CE2 3.42Å; W833-F837 VanDerWaalsContact CE3-CE2 3.42Å; W833-F837 HydrophobicContact CE3-CZ 4.25Å; W833-F837 HydrophobicContact CG-CE2 4.4Å; W833-F837 HydrophobicContact CZ3-CE2 4.13Å; W833-F837 WeakPolarHBondContact O-CD2 3.45Å; W833-F837 PolarHBondContact O-N 2.85Å; W833-F837 VanDerWaalsContact O-N 3.11Å; W833-G871 WeakPolarHBondContact CZ2-O 3.45Å; W833-Y872 HydrophobicContact CH2-CD1 4.24Å; W833-Y872 HydrophobicContact CH2-CE1 4.47Å
834	L	93.6	Very high	90.3	Very high	81 Å²	81	23 Å²	23	42%	0.424	15%	0.145	S	C	.	.	H	α-helix	trans	-56.7	-39.4	-179.2	-179.1	63.9	0	0	0	113.8	F212 Y213 L830 S838	F212-L834 HydrophobicContact CE1-CB 4.32Å; F212-L834 HydrophobicContact CE1-CD1 3.77Å; F212-L834 HydrophobicContact CZ-CB 3.94Å; F212-L834 HydrophobicContact CZ-CD1 4.16Å; Y213-L834 HydrophobicContact CE1-CD1 4.39Å; L830-L834 WeakPolarHBondContact O-CB 3.15Å; L830-L834 PolarHBondContact O-N 3.44Å; L830-L834 VanDerWaalsContact O-N 3.12Å; L834-S838 VanDerWaalsContact O-CB 3.29Å; L834-S838 WeakPolarHBondContact O-CB 3.36Å; L834-S838 PolarHBondContact O-N 3.04Å; L834-S838 PolarHBondContact O-OG 2.9Å
835	P	92.1	Very high	90.5	Very high	23 Å²	23	23.2 Å²	23.2	15%	0.149	15%	0.146	C	C	.	.	H	α-helix	trans	-60	-50.2	176.9	-26.4	37.8	0	0	0	112.9	M742 A831 W833 S838 I839 C867 L870	M742-P835 HydrophobicContact CE-CB 3.97Å; A831-P835 WeakPolarHBondContact O-CD 3.5Å; W833-P835 VanDerWaalsContact C-CD 3.47Å; P835-S838 WeakPolarHBondContact O-CB 3.39Å; P835-S838 PolarHBondContact O-N 2.9Å; P835-I839 WeakPolarHBondContact O-CG1 3.29Å; P835-I839 PolarHBondContact O-N 3.31Å; P835-C867 HydrophobicContact CB-CB 4.18Å; P835-L870 HydrophobicContact CG-CD2 4.08Å
836	F	92.3	Very high	90.6	Very high	16 Å²	16	23.1 Å²	23.1	7%	0.07	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-51.8	179.2	174.6	-110	0	0	0	112	W833 S838 I839 N840 M864 C867 T868	W833-F836 AromaticContact CE3-CD1 3.83Å; W833-F836 HydrophobicContact CE3-CD1 3.83Å; W833-F836 HydrophobicContact CE3-CE1 4.46Å; W833-F836 AromaticContact CZ3-CD1 3.75Å; W833-F836 HydrophobicContact CZ3-CD1 3.75Å; W833-F836 AromaticContact CZ3-CE1 3.99Å; W833-F836 HydrophobicContact CZ3-CE1 3.99Å; W833-F836 HydrophobicContact CZ3-CG 4.48Å; W833-F836 PolarHBondContact O-N 3.35Å; F836-S838 VanDerWaalsContact C-N 3.25Å; F836-S838 PolarHBondContact O-N 3.14Å; F836-I839 PolarHBondContact O-N 2.97Å; F836-I839 VanDerWaalsContact O-N 3.09Å; F836-N840 WeakPolarHBondContact CE1-ND2 3.29Å; F836-N840 WeakPolarHBondContact CZ-ND2 3.18Å; F836-N840 PolarHBondContact O-N 3.35Å; F836-M864 HydrophobicContact CD2-SD 3.86Å; F836-M864 HydrophobicContact CE2-SD 3.73Å; F836-C867 HydrophobicContact CB-CB 4.18Å; F836-T868 WeakPolarHBondContact CD2-OG1 3.24Å; F836-T868 HydrophobicContact CE2-CG2 4.18Å; F836-T868 VanDerWaalsContact CE2-OG1 3.3Å; F836-T868 WeakPolarHBondContact CE2-OG1 3.08Å
837	F	93.3	Very high	90.5	Very high	10 Å²	10	26 Å²	26	4%	0.044	16%	0.161	C	C	.	.	H	α-helix	trans	-70.9	-17.6	179.1	-71.4	-70.7	0	0	0	113.9	I134 S211 F212 Y213 W833 I841	I134-F837 HydrophobicContact CD1-CE2 3.98Å; I134-F837 HydrophobicContact CD1-CZ 4.05Å; S211-F837 VanDerWaalsContact OG-CE1 3.26Å; S211-F837 WeakPolarHBondContact OG-CE1 3.45Å; F212-F837 HydrophobicContact CB-CB 4.11Å; F212-F837 HydrophobicContact CB-CD1 3.79Å; F212-F837 HydrophobicContact CB-CD2 3.34Å; F212-F837 HydrophobicContact CB-CE1 3.99Å; F212-F837 HydrophobicContact CB-CE2 3.55Å; F212-F837 HydrophobicContact CB-CG 3.46Å; F212-F837 VanDerWaalsContact CB-CG 3.46Å; F212-F837 HydrophobicContact CB-CZ 3.87Å; F212-F837 HydrophobicContact CD1-CB 3.56Å; F212-F837 AromaticContact CD1-CD2 3.84Å; F212-F837 HydrophobicContact CD1-CD2 3.84Å; F212-F837 AromaticContact CD1-CG 3.85Å; F212-F837 HydrophobicContact CD1-CG 3.85Å; F212-F837 AromaticContact CD2-CD2 3.55Å; F212-F837 HydrophobicContact CD2-CD2 3.55Å; F212-F837 AromaticContact CD2-CE2 3.89Å; F212-F837 HydrophobicContact CD2-CE2 3.89Å; F212-F837 HydrophobicContact CD2-CG 4.35Å; F212-F837 HydrophobicContact CE1-CB 4.2Å; F212-F837 HydrophobicContact CE2-CD2 4.32Å; F212-F837 HydrophobicContact CG-CB 3.91Å; F212-F837 HydrophobicContact CG-CD1 4.44Å; F212-F837 AromaticContact CG-CD2 3.27Å; F212-F837 HydrophobicContact CG-CD2 3.27Å; F212-F837 AromaticContact CG-CE2 3.84Å; F212-F837 HydrophobicContact CG-CE2 3.84Å; F212-F837 AromaticContact CG-CG 3.62Å; F212-F837 HydrophobicContact CG-CG 3.62Å; Y213-F837 HydrophobicContact CE2-CB 3.88Å; Y213-F837 WeakPolarHBondContact CE2-O 3.44Å; Y213-F837 PolarHBondContact OH-O 3.15Å; W833-F837 HydrophobicContact CB-CD2 4.08Å; W833-F837 HydrophobicContact CB-CE2 4.2Å; W833-F837 HydrophobicContact CD2-CE2 4.04Å; W833-F837 HydrophobicContact CE3-CD2 4.06Å; W833-F837 AromaticContact CE3-CE2 3.42Å; W833-F837 HydrophobicContact CE3-CE2 3.42Å; W833-F837 VanDerWaalsContact CE3-CE2 3.42Å; W833-F837 HydrophobicContact CE3-CZ 4.25Å; W833-F837 HydrophobicContact CG-CE2 4.4Å; W833-F837 HydrophobicContact CZ3-CE2 4.13Å; W833-F837 WeakPolarHBondContact O-CD2 3.45Å; W833-F837 PolarHBondContact O-N 2.85Å; W833-F837 VanDerWaalsContact O-N 3.11Å; F837-I841 VanDerWaalsContact O-CG1 3.29Å; F837-I841 WeakPolarHBondContact O-CG1 3.41Å; F837-I841 PolarHBondContact O-N 3.23Å
838	S	92.3	Very high	90.4	Very high	22 Å²	22	31.8 Å²	31.8	15%	0.154	17%	0.17	C	C	.	.	H	α-helix	trans	-72.2	-42.8	167.9	-60.1	0	0	0	0	111	Y213 Y745 L834 P835 F836 T842	Y213-S838 WeakPolarHBondContact OH-CA 3.23Å; Y213-S838 PolarHBondContact OH-N 3.42Å; Y745-S838 PolarHBondContact OH-O 3.34Å; L834-S838 VanDerWaalsContact O-CB 3.29Å; L834-S838 WeakPolarHBondContact O-CB 3.36Å; L834-S838 PolarHBondContact O-N 3.04Å; L834-S838 PolarHBondContact O-OG 2.9Å; P835-S838 WeakPolarHBondContact O-CB 3.39Å; P835-S838 PolarHBondContact O-N 2.9Å; F836-S838 VanDerWaalsContact C-N 3.25Å; F836-S838 PolarHBondContact O-N 3.14Å; S838-T842 WeakPolarHBondContact O-CB 3.29Å; S838-T842 PolarHBondContact O-N 2.88Å; S838-T842 VanDerWaalsContact O-N 3.08Å; S838-T842 PolarHBondContact O-OG1 3.45Å
839	I	90.7	Very high	90	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.6	-45.7	178.2	-69.5	170.9	0	0	0	110.3	M742 Y745 P835 F836 I841 T842 L843 A860 L863 M864 C867	M742-I839 HydrophobicContact SD-CD1 4.45Å; Y745-I839 HydrophobicContact CE1-CG1 4.17Å; Y745-I839 HydrophobicContact CE2-CG1 4.27Å; Y745-I839 WeakPolarHBondContact OH-CA 3.46Å; Y745-I839 PolarHBondContact OH-N 3.06Å; P835-I839 WeakPolarHBondContact O-CG1 3.29Å; P835-I839 PolarHBondContact O-N 3.31Å; F836-I839 PolarHBondContact O-N 2.97Å; F836-I839 VanDerWaalsContact O-N 3.09Å; I839-I841 PolarHBondContact O-N 2.86Å; I839-T842 CarbonylContact O-C 3.54Å; I839-T842 WeakPolarHBondContact O-CA 3.48Å; I839-T842 WeakPolarHBondContact O-CB 3.44Å; I839-T842 PolarHBondContact O-N 3.09Å; I839-L843 HydrophobicContact CG2-CD1 4.16Å; I839-L843 HydrophobicContact CG2-CG 4.38Å; I839-L843 PolarHBondContact O-N 3.12Å; I839-A860 HydrophobicContact CG2-CB 3.98Å; I839-A860 WeakPolarHBondContact CG2-O 3.44Å; I839-L863 HydrophobicContact CD1-CB 3.57Å; I839-M864 HydrophobicContact CG2-CE 3.48Å; I839-M864 VanDerWaalsContact CG2-CE 3.48Å; I839-M864 HydrophobicContact CG2-SD 4.31Å; I839-C867 HydrophobicContact CD1-CB 3.85Å; I839-C867 WeakPolarHBondContact CD1-SG 3.39Å
840	N	91.2	Very high	89.5	Confident	24 Å²	24	37.2 Å²	37.2	13%	0.128	21%	0.209	C	C	.	.	H	α-helix	trans	-58.5	-48.2	177.2	-72.9	-20.3	0	0	0	112.7	I204 S208 F836 T842 L843 G844 M864	I204-N840 HydrophobicContact CG2-CB 4.13Å; I204-N840 WeakPolarHBondContact CG2-O 3.47Å; S208-N840 WeakPolarHBondContact OG-CB 3.21Å; F836-N840 WeakPolarHBondContact CE1-ND2 3.29Å; F836-N840 WeakPolarHBondContact CZ-ND2 3.18Å; F836-N840 PolarHBondContact O-N 3.35Å; N840-T842 PolarHBondContact O-N 3.3Å; N840-L843 PolarHBondContact O-N 2.89Å; N840-G844 PolarHBondContact O-N 2.93Å; N840-M864 VanDerWaalsContact OD1-CE 3.22Å; N840-M864 WeakPolarHBondContact OD1-CE 3.43Å
841	I	91.4	Very high	88.5	Confident	26 Å²	26	37.5 Å²	37.5	13%	0.133	21%	0.211	C	C	.	.	H	α-helix	trans	-57.6	-40.6	173.6	-71.6	-69.4	0	0	0	110.9	I205 L209 Y213 F837 I839 G844 L845	I205-I841 HydrophobicContact CB-CD1 4.47Å; I205-I841 HydrophobicContact CG2-CD1 4.2Å; L209-I841 HydrophobicContact CD2-CD1 4.45Å; L209-I841 HydrophobicContact CG-CD1 4.26Å; Y213-I841 HydrophobicContact CD2-CG1 4.37Å; Y213-I841 HydrophobicContact CE2-CD1 4.18Å; Y213-I841 HydrophobicContact CE2-CG1 3.49Å; Y213-I841 VanDerWaalsContact CE2-CG1 3.49Å; F837-I841 VanDerWaalsContact O-CG1 3.29Å; F837-I841 WeakPolarHBondContact O-CG1 3.41Å; F837-I841 PolarHBondContact O-N 3.23Å; I839-I841 PolarHBondContact O-N 2.86Å; I841-G844 PolarHBondContact O-N 3.35Å; I841-L845 HydrophobicContact CG2-CD1 3.85Å; I841-L845 HydrophobicContact CG2-CG 4.44Å; I841-L845 WeakPolarHBondContact O-CB 3.3Å; I841-L845 VanDerWaalsContact O-CG 3.23Å; I841-L845 WeakPolarHBondContact O-CG 3.49Å; I841-L845 PolarHBondContact O-N 3.09Å
842	T	88.5	Confident	87.5	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-68.7	-39.5	179.9	-58	0	0	0	0	112.5	Y745 F749 S838 I839 N840 L845 C846 I856	Y745-T842 HydrophobicContact CE2-CG2 4.08Å; Y745-T842 PolarHBondContact OH-OG1 2.62Å; F749-T842 HydrophobicContact CD2-CG2 4.15Å; F749-T842 WeakPolarHBondContact CD2-OG1 3.39Å; F749-T842 HydrophobicContact CE2-CG2 4.4Å; F749-T842 WeakPolarHBondContact CE2-OG1 3.2Å; S838-T842 WeakPolarHBondContact O-CB 3.29Å; S838-T842 PolarHBondContact O-N 2.88Å; S838-T842 VanDerWaalsContact O-N 3.08Å; S838-T842 PolarHBondContact O-OG1 3.45Å; I839-T842 CarbonylContact O-C 3.54Å; I839-T842 WeakPolarHBondContact O-CA 3.48Å; I839-T842 WeakPolarHBondContact O-CB 3.44Å; I839-T842 PolarHBondContact O-N 3.09Å; N840-T842 PolarHBondContact O-N 3.3Å; T842-L845 CarbonylContact O-C 3.58Å; T842-L845 PolarHBondContact O-N 2.03Å; T842-C846 WeakPolarHBondContact O-CB 3.35Å; T842-C846 PolarHBondContact O-N 2.92Å; T842-C846 PolarHBondContact O-SG 3.48Å; T842-I856 HydrophobicContact CG2-CG2 3.47Å; T842-I856 VanDerWaalsContact CG2-CG2 3.47Å
843	L	87.4	Confident	86.1	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-42.4	174.4	-68.9	179.1	0	0	0	111.9	I839 N840 L845 C846 I847 A860 N861 M864	I839-L843 HydrophobicContact CG2-CD1 4.16Å; I839-L843 HydrophobicContact CG2-CG 4.38Å; I839-L843 PolarHBondContact O-N 3.12Å; N840-L843 PolarHBondContact O-N 2.89Å; L843-L845 VanDerWaalsContact C-N 3.29Å; L843-L845 PolarHBondContact O-N 2.93Å; L843-C846 WeakPolarHBondContact O-CB 3.47Å; L843-C846 PolarHBondContact O-N 3.11Å; L843-C846 VanDerWaalsContact O-N 3.12Å; L843-I847 VanDerWaalsContact O-CG1 3.31Å; L843-I847 WeakPolarHBondContact O-CG1 3.32Å; L843-I847 PolarHBondContact O-N 3.42Å; L843-A860 HydrophobicContact CD2-CB 3.58Å; L843-A860 HydrophobicContact CG-CB 3.97Å; L843-N861 VanDerWaalsContact CD2-OD1 3.29Å; L843-N861 WeakPolarHBondContact CD2-OD1 3.21Å; L843-M864 HydrophobicContact CD1-CE 3.41Å; L843-M864 VanDerWaalsContact CD1-CE 3.41Å
844	G	88.5	Confident	84.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-42.8	171.4	0	0	0	0	0	112	A201 N840 I841 I847 Y848	A201-G844 WeakPolarHBondContact CB-O 3.24Å; N840-G844 PolarHBondContact O-N 2.93Å; I841-G844 PolarHBondContact O-N 3.35Å; G844-I847 PolarHBondContact O-N 3.07Å; G844-Y848 VanDerWaalsContact O-CB 3.23Å; G844-Y848 WeakPolarHBondContact O-CB 3.2Å; G844-Y848 PolarHBondContact O-N 3.39Å
845	L	88.6	Confident	83.9	Confident	53 Å²	53	51 Å²	51	28%	0.277	26%	0.262	S	S	.	.	H	α-helix	trans	-69.4	-33.5	173.9	-70.7	171	0	0	0	113.2	I205 I841 T842 L843 L849 L851	I205-L845 HydrophobicContact CD1-CD2 4.22Å; I205-L845 HydrophobicContact CD1-CG 4.43Å; I841-L845 HydrophobicContact CG2-CD1 3.85Å; I841-L845 HydrophobicContact CG2-CG 4.44Å; I841-L845 WeakPolarHBondContact O-CB 3.3Å; I841-L845 VanDerWaalsContact O-CG 3.23Å; I841-L845 WeakPolarHBondContact O-CG 3.49Å; I841-L845 PolarHBondContact O-N 3.09Å; T842-L845 CarbonylContact O-C 3.58Å; T842-L845 PolarHBondContact O-N 2.03Å; L843-L845 VanDerWaalsContact C-N 3.29Å; L843-L845 PolarHBondContact O-N 2.93Å; L845-L849 HydrophobicContact CD2-CD1 4Å; L845-L849 VanDerWaalsContact O-CB 3.27Å; L845-L849 WeakPolarHBondContact O-CB 3.38Å; L845-L849 PolarHBondContact O-N 3.17Å; L845-L851 HydrophobicContact CB-CD1 4.28Å
846	C	87.1	Confident	83.4	Confident	8 Å²	8	50.1 Å²	50.1	5%	0.054	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-50	171.9	-73.2	0	0	0	0	110.7	T842 L843 Y848 G850 C857	T842-C846 WeakPolarHBondContact O-CB 3.35Å; T842-C846 PolarHBondContact O-N 2.92Å; T842-C846 PolarHBondContact O-SG 3.48Å; L843-C846 WeakPolarHBondContact O-CB 3.47Å; L843-C846 PolarHBondContact O-N 3.11Å; L843-C846 VanDerWaalsContact O-N 3.12Å; C846-Y848 VanDerWaalsContact C-N 3.34Å; C846-Y848 PolarHBondContact O-N 2.83Å; C846-G850 WeakPolarHBondContact O-CA 3.4Å; C846-G850 PolarHBondContact O-N 3.47Å; C846-C857 HydrophobicContact CB-CB 3.89Å; C846-C857 WeakPolarHBondContact CB-SG 3.21Å; C846-C857 WeakPolarHBondContact SG-CB 3.44Å; C846-C857 CovalentContact SG-SG 2.03Å; C846-C857 PolarHBondContact SG-SG 3.14Å
847	I	84.1	Confident	83	Confident	75 Å²	75	49.8 Å²	49.8	39%	0.385	26%	0.256	S	S	.	.	H	α-helix	trans	-66.2	-36.1	179.9	-59.4	162.1	0	0	0	111.2	A201 I204 L843 G844	A201-I847 HydrophobicContact CB-CB 3.93Å; A201-I847 HydrophobicContact CB-CG2 3.84Å; I204-I847 HydrophobicContact CD1-CD1 3.94Å; L843-I847 VanDerWaalsContact O-CG1 3.31Å; L843-I847 WeakPolarHBondContact O-CG1 3.32Å; L843-I847 PolarHBondContact O-N 3.42Å; G844-I847 PolarHBondContact O-N 3.07Å
848	Y	85.2	Confident	82.6	Confident	167 Å²	167	53.7 Å²	53.7	66%	0.655	27%	0.274	S	S	*	.	H	α-helix	trans	-79.7	-31.9	-179.1	-171.8	-111.5	0	0	0	114.6	G844 C846	G844-Y848 VanDerWaalsContact O-CB 3.23Å; G844-Y848 WeakPolarHBondContact O-CB 3.2Å; G844-Y848 PolarHBondContact O-N 3.39Å; C846-Y848 VanDerWaalsContact C-N 3.34Å; C846-Y848 PolarHBondContact O-N 2.83Å
849	L	84.4	Confident	82.1	Confident	95 Å²	95	54.3 Å²	54.3	50%	0.497	27%	0.273	S	S	.	.	H	α-helix	trans	-118.2	-6.5	-172	-58.6	174.7	0	0	0	115	L845 L851	L845-L849 HydrophobicContact CD2-CD1 4Å; L845-L849 VanDerWaalsContact O-CB 3.27Å; L845-L849 WeakPolarHBondContact O-CB 3.38Å; L845-L849 PolarHBondContact O-N 3.17Å; L849-L851 HydrophobicContact CB-CD1 4.4Å; L849-L851 HydrophobicContact CB-CD2 4.03Å; L849-L851 HydrophobicContact CB-CG 3.89Å; L849-L851 HydrophobicContact CD1-CD1 4.3Å
850	G	77.5	Confident	81.8	Confident	53 Å²	53	54.3 Å²	54.3	55%	0.546	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	43.5	-179.1	0	0	0	0	0	114.2	C846 D852	C846-G850 WeakPolarHBondContact O-CA 3.4Å; C846-G850 PolarHBondContact O-N 3.47Å; G850-D852 PolarHBondContact O-N 3.11Å; G850-D852 VanDerWaalsContact O-N 3.09Å
851	L	72.1	Confident	81.4	Confident	47 Å²	47	57.5 Å²	57.5	25%	0.246	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-77.1	13.2	-170.5	-62.5	177.7	0	0	0	115.7	L752 L845 L849 Q853 Y854	L752-L851 HydrophobicContact CD1-CD1 4.28Å; L752-L851 HydrophobicContact CD1-CD2 4.49Å; L845-L851 HydrophobicContact CB-CD1 4.28Å; L849-L851 HydrophobicContact CB-CD1 4.4Å; L849-L851 HydrophobicContact CB-CD2 4.03Å; L849-L851 HydrophobicContact CB-CG 3.89Å; L849-L851 HydrophobicContact CD1-CD1 4.3Å; L851-Q853 PolarHBondContact O-N 3.44Å; L851-Q853 VanDerWaalsContact O-N 3.09Å; L851-Y854 PolarHBondContact O-N 3.28Å
852	D	70.5	Confident	80.9	Confident	102 Å²	102	60.2 Å²	60.2	55%	0.545	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-61	-24.9	-170.5	-61.3	-55.4	0	0	0	114.1	G850 Y854 N855 C857	G850-D852 PolarHBondContact O-N 3.11Å; G850-D852 VanDerWaalsContact O-N 3.09Å; D852-Y854 PolarHBondContact O-N 2.96Å; D852-N855 PolarHBondContact O-N 3.48Å; D852-C857 PolarHBondContact OD1-SG 3.42Å
853	Q	63.8	Low	80.8	Confident	164 Å²	164	60.1 Å²	60.1	77%	0.766	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-52.3	-17.8	178.3	-163.6	-176.2	30.2	0	0	114.6	L851	L851-Q853 PolarHBondContact O-N 3.44Å; L851-Q853 VanDerWaalsContact O-N 3.09Å
854	Y	65.5	Low	80.8	Confident	96 Å²	96	61.4 Å²	61.4	38%	0.376	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-106.4	1.4	-178.9	-65.1	-92.8	0	0	0	114.1	K748 L752 L851 D852 I856	K748-Y854 WeakPolarHBondContact CD-O 3.43Å; K748-Y854 PolarHBondContact NZ-O 3.39Å; L752-Y854 HydrophobicContact CD1-CD2 4.23Å; L752-Y854 HydrophobicContact CD1-CG 4.27Å; L752-Y854 HydrophobicContact CD2-CD1 3.81Å; L752-Y854 HydrophobicContact CD2-CD2 3.8Å; L752-Y854 HydrophobicContact CD2-CE1 3.76Å; L752-Y854 HydrophobicContact CD2-CE2 3.78Å; L752-Y854 HydrophobicContact CD2-CG 3.83Å; L752-Y854 HydrophobicContact CG-CD1 4.28Å; L752-Y854 HydrophobicContact CG-CD2 4.36Å; L752-Y854 HydrophobicContact CG-CG 4.11Å; L851-Y854 PolarHBondContact O-N 3.28Å; D852-Y854 PolarHBondContact O-N 2.96Å; Y854-I856 PolarHBondContact O-N 2.99Å; Y854-I856 VanDerWaalsContact O-N 3.15Å
855	N	75.9	Confident	80.8	Confident	77 Å²	77	63 Å²	63	41%	0.412	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	18.5	-170.8	-54.7	66.7	0	0	0	114	D852 C857 E858 Y859	D852-N855 PolarHBondContact O-N 3.48Å; N855-C857 VanDerWaalsContact C-N 3.33Å; N855-E858 HydrophobicContact CB-CB 4.19Å; N855-E858 WeakPolarHBondContact CB-OE2 3.34Å; N855-E858 PolarHBondContact ND2-OE2 3.23Å; N855-E858 VanDerWaalsContact O-CB 3.29Å; N855-E858 WeakPolarHBondContact O-CB 3.02Å; N855-E858 PolarHBondContact O-N 3.47Å; N855-Y859 WeakPolarHBondContact O-CD2 3.37Å; N855-Y859 PolarHBondContact O-N 3.25Å
856	I	81.5	Confident	80.7	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-70.3	-35.8	-176.5	-74	164.7	0	0	0	111	Y745 K748 L752 T842 Y854 E858 Y859 A860	Y745-I856 HydrophobicContact CD2-CG2 4.49Å; Y745-I856 HydrophobicContact CE2-CG2 4.37Å; K748-I856 HydrophobicContact CB-CD1 3.83Å; K748-I856 HydrophobicContact CB-CG1 3.61Å; K748-I856 HydrophobicContact CD-CG1 3.96Å; K748-I856 HydrophobicContact CG-CG1 4.44Å; L752-I856 HydrophobicContact CB-CD1 4.12Å; L752-I856 HydrophobicContact CD1-CD1 3.4Å; L752-I856 HydrophobicContact CG-CD1 3.53Å; T842-I856 HydrophobicContact CG2-CG2 3.47Å; T842-I856 VanDerWaalsContact CG2-CG2 3.47Å; Y854-I856 PolarHBondContact O-N 2.99Å; Y854-I856 VanDerWaalsContact O-N 3.15Å; I856-E858 VanDerWaalsContact C-N 3.28Å; I856-E858 PolarHBondContact O-N 2.83Å; I856-Y859 PolarHBondContact O-N 3.24Å; I856-A860 WeakPolarHBondContact O-CB 3.03Å; I856-A860 PolarHBondContact O-N 3.21Å
857	C	83.7	Confident	80.9	Confident	9 Å²	9	62 Å²	62	6%	0.061	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-33.9	174.6	-38.4	0	0	0	0	111.3	C846 D852 N855 A860 N861	C846-C857 HydrophobicContact CB-CB 3.89Å; C846-C857 WeakPolarHBondContact CB-SG 3.21Å; C846-C857 WeakPolarHBondContact SG-CB 3.44Å; C846-C857 CovalentContact SG-SG 2.03Å; C846-C857 PolarHBondContact SG-SG 3.14Å; D852-C857 PolarHBondContact OD1-SG 3.42Å; N855-C857 VanDerWaalsContact C-N 3.33Å; C857-A860 PolarHBondContact O-N 3.16Å; C857-N861 PolarHBondContact O-N 3.32Å
858	E	84.1	Confident	81.3	Confident	93 Å²	93	59.4 Å²	59.4	44%	0.435	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-50.6	173.3	-162.6	-160.1	145.6	0	0	111.7	N855 I856 A860 N861 Q862	N855-E858 HydrophobicContact CB-CB 4.19Å; N855-E858 WeakPolarHBondContact CB-OE2 3.34Å; N855-E858 PolarHBondContact ND2-OE2 3.23Å; N855-E858 VanDerWaalsContact O-CB 3.29Å; N855-E858 WeakPolarHBondContact O-CB 3.02Å; N855-E858 PolarHBondContact O-N 3.47Å; I856-E858 VanDerWaalsContact C-N 3.28Å; I856-E858 PolarHBondContact O-N 2.83Å; E858-A860 VanDerWaalsContact C-N 3.34Å; E858-A860 PolarHBondContact O-N 3.15Å; E858-N861 PolarHBondContact O-N 3.27Å; E858-Q862 WeakPolarHBondContact O-CG 3.35Å; E858-Q862 PolarHBondContact O-N 3.36Å; E858-Q862 PolarHBondContact OE1-NE2 3.28Å
859	Y	83	Confident	81.7	Confident	34 Å²	34	52.6 Å²	52.6	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-39.8	174.6	-70.1	-78.7	0	0	0	112.2	L741 Q744 K748 N855 I856 N861 Q862 L863	L741-Y859 HydrophobicContact CD2-CD1 3.82Å; L741-Y859 HydrophobicContact CD2-CE1 3.79Å; Q744-Y859 HydrophobicContact CB-CD1 4.34Å; Q744-Y859 HydrophobicContact CB-CE1 3.8Å; Q744-Y859 VanDerWaalsContact OE1-CE1 3.3Å; Q744-Y859 PolarHBondContact OE1-OH 3.02Å; K748-Y859 HydrophobicContact CD-CD2 4.11Å; K748-Y859 HydrophobicContact CD-CE2 3.7Å; N855-Y859 WeakPolarHBondContact O-CD2 3.37Å; N855-Y859 PolarHBondContact O-N 3.25Å; I856-Y859 PolarHBondContact O-N 3.24Å; Y859-N861 VanDerWaalsContact C-N 3.32Å; Y859-N861 PolarHBondContact O-N 3.43Å; Y859-Q862 PolarHBondContact O-N 3.05Å; Y859-L863 VanDerWaalsContact O-CB 3.25Å; Y859-L863 WeakPolarHBondContact O-CB 3.24Å; Y859-L863 WeakPolarHBondContact O-CD1 3.4Å; Y859-L863 VanDerWaalsContact O-CG 3.22Å; Y859-L863 WeakPolarHBondContact O-CG 3.44Å; Y859-L863 PolarHBondContact O-N 3.07Å
860	A	84.4	Confident	82	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-44.4	178.6	0	0	0	0	0	111.2	Y745 I839 L843 I856 C857 E858 L863 M864	Y745-A860 HydrophobicContact CE2-CB 4.19Å; I839-A860 HydrophobicContact CG2-CB 3.98Å; I839-A860 WeakPolarHBondContact CG2-O 3.44Å; L843-A860 HydrophobicContact CD2-CB 3.58Å; L843-A860 HydrophobicContact CG-CB 3.97Å; I856-A860 WeakPolarHBondContact O-CB 3.03Å; I856-A860 PolarHBondContact O-N 3.21Å; C857-A860 PolarHBondContact O-N 3.16Å; E858-A860 VanDerWaalsContact C-N 3.34Å; E858-A860 PolarHBondContact O-N 3.15Å; A860-L863 PolarHBondContact O-N 2.93Å; A860-M864 PolarHBondContact O-N 3.24Å
861	N	81.7	Confident	82.7	Confident	92 Å²	92	48.5 Å²	48.5	49%	0.492	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-46.8	174.2	-71.5	-14.1	0	0	0	112.3	L843 C857 E858 Y859 L863 M864	L843-N861 VanDerWaalsContact CD2-OD1 3.29Å; L843-N861 WeakPolarHBondContact CD2-OD1 3.21Å; C857-N861 PolarHBondContact O-N 3.32Å; E858-N861 PolarHBondContact O-N 3.27Å; Y859-N861 VanDerWaalsContact C-N 3.32Å; Y859-N861 PolarHBondContact O-N 3.43Å; N861-L863 PolarHBondContact O-N 3.07Å; N861-M864 WeakPolarHBondContact O-CB 3.3Å; N861-M864 PolarHBondContact O-N 2.64Å
862	Q	82.1	Confident	83.8	Confident	83 Å²	83	46.5 Å²	46.5	39%	0.388	23%	0.233	S	C	.	.	H	α-helix	trans	-59.8	-28.7	177.4	-71.1	171.9	18.1	0	0	113.3	L741 E858 Y859	L741-Q862 HydrophobicContact CD1-CB 4.37Å; E858-Q862 WeakPolarHBondContact O-CG 3.35Å; E858-Q862 PolarHBondContact O-N 3.36Å; E858-Q862 PolarHBondContact OE1-NE2 3.28Å; Y859-Q862 PolarHBondContact O-N 3.05Å
863	L	86.8	Confident	84.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-94.2	-14.6	-177.7	-72.9	167	0	0	0	114.3	N738 L741 M742 Y745 I839 Y859 A860 N861 S866 C867	N738-L863 WeakPolarHBondContact O-CD2 3.41Å; L741-L863 HydrophobicContact CB-CD1 4.23Å; L741-L863 HydrophobicContact CB-CD2 3.58Å; L741-L863 HydrophobicContact CB-CG 4.01Å; M742-L863 HydrophobicContact CB-CD2 4.48Å; M742-L863 HydrophobicContact CG-CD1 4.33Å; M742-L863 HydrophobicContact CG-CD2 3.7Å; M742-L863 HydrophobicContact SD-CB 4.35Å; M742-L863 HydrophobicContact SD-CD1 3.73Å; M742-L863 HydrophobicContact SD-CD2 3.81Å; M742-L863 HydrophobicContact SD-CG 4.18Å; Y745-L863 HydrophobicContact CD1-CD1 4.37Å; Y745-L863 HydrophobicContact CD2-CD1 4.41Å; Y745-L863 HydrophobicContact CG-CD1 3.86Å; I839-L863 HydrophobicContact CD1-CB 3.57Å; Y859-L863 VanDerWaalsContact O-CB 3.25Å; Y859-L863 WeakPolarHBondContact O-CB 3.24Å; Y859-L863 WeakPolarHBondContact O-CD1 3.4Å; Y859-L863 VanDerWaalsContact O-CG 3.22Å; Y859-L863 WeakPolarHBondContact O-CG 3.44Å; Y859-L863 PolarHBondContact O-N 3.07Å; A860-L863 PolarHBondContact O-N 2.93Å; N861-L863 PolarHBondContact O-N 3.07Å; L863-S866 PolarHBondContact O-N 2.88Å; L863-C867 PolarHBondContact O-N 3.03Å; L863-C867 VanDerWaalsContact O-N 3.1Å; L863-C867 PolarHBondContact O-SG 3.08Å
864	M	87.4	Confident	86.2	Confident	38 Å²	38	36.4 Å²	36.4	19%	0.187	18%	0.184	C	C	.	.	H	α-helix	trans	-52.8	-64.1	-171.7	177.9	54.4	77.8	0	0	111.8	F836 I839 N840 L843 A860 N861 S866 C867 T868	F836-M864 HydrophobicContact CD2-SD 3.86Å; F836-M864 HydrophobicContact CE2-SD 3.73Å; I839-M864 HydrophobicContact CG2-CE 3.48Å; I839-M864 VanDerWaalsContact CG2-CE 3.48Å; I839-M864 HydrophobicContact CG2-SD 4.31Å; N840-M864 VanDerWaalsContact OD1-CE 3.22Å; N840-M864 WeakPolarHBondContact OD1-CE 3.43Å; L843-M864 HydrophobicContact CD1-CE 3.41Å; L843-M864 VanDerWaalsContact CD1-CE 3.41Å; A860-M864 PolarHBondContact O-N 3.24Å; N861-M864 WeakPolarHBondContact O-CB 3.3Å; N861-M864 PolarHBondContact O-N 2.64Å; M864-S866 VanDerWaalsContact C-N 3.28Å; M864-S866 PolarHBondContact O-N 2.76Å; M864-C867 CarbonylContact O-C 3.58Å; M864-C867 WeakPolarHBondContact O-CA 3.4Å; M864-C867 PolarHBondContact O-N 3.5Å; M864-T868 PolarHBondContact O-N 3.17Å; M864-T868 PolarHBondContact O-OG1 2.79Å; M864-T868 VanDerWaalsContact O-OG1 3.06Å
865	S	87.5	Confident	87.6	Confident	33 Å²	33	31.9 Å²	31.9	23%	0.231	17%	0.166	C	C	.	.	H	α-helix	trans	-44.6	-52.1	180	135.7	0	0	0	0	112.4	E106 C867 T868 W869	E106-S865 PolarHBondContact OE1-OG 2.96Å; E106-S865 WeakPolarHBondContact OE2-CB 3.44Å; E106-S865 PolarHBondContact OE2-OG 3.07Å; S865-C867 VanDerWaalsContact C-N 3.28Å; S865-C867 PolarHBondContact O-N 2.89Å; S865-T868 PolarHBondContact O-N 3.29Å; S865-W869 VanDerWaalsContact O-CD1 3.28Å; S865-W869 PolarHBondContact O-N 3.47Å
866	S	86.8	Confident	88.4	Confident	36 Å²	36	29 Å²	29	25%	0.252	15%	0.152	S	C	.	.	H	α-helix	trans	-70.7	-24	-175.5	-67.1	0	0	0	0	113.3	N738 L863 M864 L870	N738-S866 PolarHBondContact ND2-OG 2.94Å; L863-S866 PolarHBondContact O-N 2.88Å; M864-S866 VanDerWaalsContact C-N 3.28Å; M864-S866 PolarHBondContact O-N 2.76Å; S866-L870 VanDerWaalsContact O-CB 3.3Å; S866-L870 WeakPolarHBondContact O-CB 3.23Å; S866-L870 PolarHBondContact O-N 3.34Å
867	C	92.1	Very high	89	Confident	4 Å²	4	31.2 Å²	31.2	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-84.2	-36.4	173.8	-67	0	0	0	0	112	M742 P835 F836 I839 L863 M864 S865 L870 G871	M742-C867 VanDerWaalsContact SD-SG 3.7Å; P835-C867 HydrophobicContact CB-CB 4.18Å; F836-C867 HydrophobicContact CB-CB 4.18Å; I839-C867 HydrophobicContact CD1-CB 3.85Å; I839-C867 WeakPolarHBondContact CD1-SG 3.39Å; L863-C867 PolarHBondContact O-N 3.03Å; L863-C867 VanDerWaalsContact O-N 3.1Å; L863-C867 PolarHBondContact O-SG 3.08Å; M864-C867 CarbonylContact O-C 3.58Å; M864-C867 WeakPolarHBondContact O-CA 3.4Å; M864-C867 PolarHBondContact O-N 3.5Å; S865-C867 VanDerWaalsContact C-N 3.28Å; S865-C867 PolarHBondContact O-N 2.89Å; C867-L870 PolarHBondContact O-N 3.03Å; C867-G871 PolarHBondContact O-N 2.98Å
868	T	92.1	Very high	89.3	Confident	21 Å²	21	30.8 Å²	30.8	13%	0.129	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-50.5	171	-51	0	0	0	0	110.7	F836 M864 S865 L870 G871 Y872	F836-T868 WeakPolarHBondContact CD2-OG1 3.24Å; F836-T868 HydrophobicContact CE2-CG2 4.18Å; F836-T868 VanDerWaalsContact CE2-OG1 3.3Å; F836-T868 WeakPolarHBondContact CE2-OG1 3.08Å; M864-T868 PolarHBondContact O-N 3.17Å; M864-T868 PolarHBondContact O-OG1 2.79Å; M864-T868 VanDerWaalsContact O-OG1 3.06Å; S865-T868 PolarHBondContact O-N 3.29Å; T868-L870 VanDerWaalsContact C-N 3.3Å; T868-L870 PolarHBondContact O-N 3.33Å; T868-G871 WeakPolarHBondContact O-CA 3.35Å; T868-G871 PolarHBondContact O-N 3.46Å; T868-Y872 HydrophobicContact CG2-CD2 4.36Å; T868-Y872 HydrophobicContact CG2-CE1 4.17Å; T868-Y872 HydrophobicContact CG2-CE2 3.7Å; T868-Y872 PolarHBondContact O-N 3.18Å
869	W	92	Very high	89.7	Confident	23 Å²	23	26.8 Å²	26.8	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-63.3	-33.5	176.3	-81.3	109	0	0	0	113.3	L52 A102 T103 S865 G871 Y872 I873	L52-W869 HydrophobicContact CB-CH2 3.9Å; L52-W869 HydrophobicContact CB-CZ2 4.07Å; L52-W869 HydrophobicContact CB-CZ3 4.43Å; L52-W869 HydrophobicContact CD1-CZ2 3.86Å; L52-W869 HydrophobicContact CD2-CD2 3.74Å; L52-W869 HydrophobicContact CD2-CE3 3.88Å; L52-W869 HydrophobicContact CD2-CG 4.36Å; L52-W869 HydrophobicContact CD2-CH2 4.05Å; L52-W869 HydrophobicContact CD2-CZ2 3.91Å; L52-W869 HydrophobicContact CD2-CZ3 4.03Å; L52-W869 HydrophobicContact CG-CH2 4.36Å; L52-W869 HydrophobicContact CG-CZ2 4.14Å; A102-W869 HydrophobicContact CB-CZ2 4.37Å; T103-W869 VanDerWaalsContact OG1-CH2 3.31Å; T103-W869 WeakPolarHBondContact OG1-CH2 3Å; T103-W869 WeakPolarHBondContact OG1-CZ2 3.41Å; S865-W869 VanDerWaalsContact O-CD1 3.28Å; S865-W869 PolarHBondContact O-N 3.47Å; W869-G871 VanDerWaalsContact C-N 3.34Å; W869-Y872 HydrophobicContact CD2-CD2 4.21Å; W869-Y872 AromaticContact CE3-CD2 3.93Å; W869-Y872 HydrophobicContact CE3-CD2 3.93Å; W869-Y872 HydrophobicContact CZ3-CD2 4.1Å; W869-Y872 PolarHBondContact O-N 3.44Å; W869-I873 VanDerWaalsContact O-CG1 3.27Å; W869-I873 WeakPolarHBondContact O-CG1 3.28Å; W869-I873 PolarHBondContact O-N 3.29Å
870	L	91.6	Very high	90.2	Very high	63 Å²	63	29.2 Å²	29.2	33%	0.33	16%	0.158	S	C	.	.	H	α-helix	trans	-66.7	-34.6	172.1	-178	65.3	0	0	0	112.4	C832 P835 S866 C867 T868	C832-L870 WeakPolarHBondContact CB-O 3.48Å; C832-L870 PolarHBondContact SG-O 3.45Å; C832-L870 VanDerWaalsContact SG-O 3.35Å; P835-L870 HydrophobicContact CG-CD2 4.08Å; S866-L870 VanDerWaalsContact O-CB 3.3Å; S866-L870 WeakPolarHBondContact O-CB 3.23Å; S866-L870 PolarHBondContact O-N 3.34Å; C867-L870 PolarHBondContact O-N 3.03Å; T868-L870 VanDerWaalsContact C-N 3.3Å; T868-L870 PolarHBondContact O-N 3.33Å
871	G	92.7	Very high	90.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.6	-52.1	168.7	0	0	0	0	0	111.8	W833 C867 T868 W869 I873 N874	W833-G871 WeakPolarHBondContact CZ2-O 3.45Å; C867-G871 PolarHBondContact O-N 2.98Å; T868-G871 WeakPolarHBondContact O-CA 3.35Å; T868-G871 PolarHBondContact O-N 3.46Å; W869-G871 VanDerWaalsContact C-N 3.34Å; G871-I873 VanDerWaalsContact C-N 3.28Å; G871-I873 PolarHBondContact O-N 2.92Å; G871-N874 WeakPolarHBondContact O-CB 3.42Å; G871-N874 PolarHBondContact O-N 3.16Å
872	Y	94.3	Very high	91	Very high	5 Å²	5	26.1 Å²	26.1	2%	0.02	14%	0.14	C	C	.	.	H	α-helix	trans	-60.4	-32.7	178.4	-64.7	-15.8	0	0	0	113.9	L94 V98 M99 A102 D126 W833 T868 W869 N874 S875	L94-Y872 HydrophobicContact CD1-CD1 4.46Å; L94-Y872 HydrophobicContact CD1-CE1 4.07Å; L94-Y872 HydrophobicContact CD2-CD1 3.94Å; L94-Y872 HydrophobicContact CD2-CE1 4.37Å; L94-Y872 HydrophobicContact CG-CD1 4.47Å; V98-Y872 WeakPolarHBondContact CG1-OH 3.3Å; M99-Y872 HydrophobicContact CE-CG 4.26Å; M99-Y872 HydrophobicContact CG-CD2 4.26Å; A102-Y872 HydrophobicContact CB-CE2 3.83Å; D126-Y872 VanDerWaalsContact OD1-CE1 3.22Å; D126-Y872 WeakPolarHBondContact OD1-CE1 3.31Å; D126-Y872 PolarHBondContact OD1-OH 3.26Å; W833-Y872 HydrophobicContact CH2-CD1 4.24Å; W833-Y872 HydrophobicContact CH2-CE1 4.47Å; T868-Y872 HydrophobicContact CG2-CD2 4.36Å; T868-Y872 HydrophobicContact CG2-CE1 4.17Å; T868-Y872 HydrophobicContact CG2-CE2 3.7Å; T868-Y872 PolarHBondContact O-N 3.18Å; W869-Y872 HydrophobicContact CD2-CD2 4.21Å; W869-Y872 AromaticContact CE3-CD2 3.93Å; W869-Y872 HydrophobicContact CE3-CD2 3.93Å; W869-Y872 HydrophobicContact CZ3-CD2 4.1Å; W869-Y872 PolarHBondContact O-N 3.44Å; Y872-N874 PolarHBondContact O-N 3.38Å; Y872-S875 PolarHBondContact O-N 2.91Å; Y872-S875 VanDerWaalsContact O-N 3.15Å
873	I	92.5	Very high	91.3	Very high	53 Å²	53	24.1 Å²	24.1	27%	0.272	13%	0.134	S	C	.	.	H	α-helix	trans	-59.5	-25.7	173.2	-77.1	165.7	0	0	0	112.3	W869 G871 S875 A876 L877	W869-I873 VanDerWaalsContact O-CG1 3.27Å; W869-I873 WeakPolarHBondContact O-CG1 3.28Å; W869-I873 PolarHBondContact O-N 3.29Å; G871-I873 VanDerWaalsContact C-N 3.28Å; G871-I873 PolarHBondContact O-N 2.92Å; I873-S875 VanDerWaalsContact C-N 3.3Å; I873-S875 PolarHBondContact O-N 2.98Å; I873-A876 WeakPolarHBondContact O-CB 3.46Å; I873-A876 PolarHBondContact O-N 3.19Å; I873-A876 VanDerWaalsContact O-N 3.16Å; I873-L877 HydrophobicContact CG2-CD1 3.83Å; I873-L877 HydrophobicContact CG2-CG 4.06Å; I873-L877 WeakPolarHBondContact O-CG 3.37Å; I873-L877 PolarHBondContact O-N 3.46Å
874	N	92.8	Very high	91.4	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-57.3	-42.3	174.6	-177.3	81.2	0	0	0	112.3	F829 C832 G871 Y872 A876 L877 N878	F829-N874 WeakPolarHBondContact CA-OD1 3.47Å; C832-N874 HydrophobicContact CB-CB 3.93Å; G871-N874 WeakPolarHBondContact O-CB 3.42Å; G871-N874 PolarHBondContact O-N 3.16Å; Y872-N874 PolarHBondContact O-N 3.38Å; N874-A876 VanDerWaalsContact C-N 3.31Å; N874-A876 PolarHBondContact O-N 2.85Å; N874-L877 PolarHBondContact O-N 3.25Å; N874-L877 VanDerWaalsContact O-N 3.12Å; N874-N878 PolarHBondContact O-N 2.98Å
875	S	94.5	Very high	91.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.5	-31.5	178.9	-60.7	0	0	0	0	112.4	N63 D91 Y872 I873	N63-S875 PolarHBondContact ND2-O 2.95Å; D91-S875 VanDerWaalsContact CG-CB 3.42Å; D91-S875 VanDerWaalsContact CG-OG 3.27Å; D91-S875 VanDerWaalsContact OD1-CB 3.31Å; D91-S875 WeakPolarHBondContact OD1-CB 3.4Å; D91-S875 PolarHBondContact OD1-OG 2.79Å; Y872-S875 PolarHBondContact O-N 2.91Å; Y872-S875 VanDerWaalsContact O-N 3.15Å; I873-S875 VanDerWaalsContact C-N 3.3Å; I873-S875 PolarHBondContact O-N 2.98Å
876	A	92.8	Very high	91.3	Very high	16 Å²	16	31.8 Å²	31.8	13%	0.132	17%	0.168	C	C	.	.	H	α-helix	trans	-72.9	-31.7	171.5	0	0	0	0	0	112.9	T59 I873 N874	T59-A876 WeakPolarHBondContact OG1-CB 3.32Å; I873-A876 WeakPolarHBondContact O-CB 3.46Å; I873-A876 PolarHBondContact O-N 3.19Å; I873-A876 VanDerWaalsContact O-N 3.16Å; N874-A876 VanDerWaalsContact C-N 3.31Å; N874-A876 PolarHBondContact O-N 2.85Å
877	L	93.4	Very high	91.3	Very high	51 Å²	51	36.2 Å²	36.2	27%	0.267	19%	0.186	S	C	.	.	H	α-helix	trans	-75.2	-25.4	-179.7	-71.1	172	0	0	0	113.2	V828 I873 N874 I880 I881	V828-L877 HydrophobicContact CG1-CB 4.32Å; V828-L877 HydrophobicContact CG1-CD1 3.53Å; I873-L877 HydrophobicContact CG2-CD1 3.83Å; I873-L877 HydrophobicContact CG2-CG 4.06Å; I873-L877 WeakPolarHBondContact O-CG 3.37Å; I873-L877 PolarHBondContact O-N 3.46Å; N874-L877 PolarHBondContact O-N 3.25Å; N874-L877 VanDerWaalsContact O-N 3.12Å; L877-I880 HydrophobicContact CD2-CD1 4.34Å; L877-I880 WeakPolarHBondContact O-CB 3.23Å; L877-I880 PolarHBondContact O-N 2.04Å; L877-I880 VanDerWaalsContact O-N 3.1Å; L877-I881 HydrophobicContact CB-CD1 4.34Å; L877-I881 WeakPolarHBondContact O-CG1 3.38Å; L877-I881 PolarHBondContact O-N 2.85Å
878	N	91.2	Very high	91.1	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-52.3	-56.5	-179.9	-82.7	-25.6	0	0	0	113	D91 N874 I880 I881 Y882	D91-N878 PolarHBondContact OD2-ND2 2.86Å; N874-N878 PolarHBondContact O-N 2.98Å; N878-I880 VanDerWaalsContact C-N 3.3Å; N878-I880 PolarHBondContact O-N 2.88Å; N878-I881 PolarHBondContact O-N 2.76Å; N878-Y882 HydrophobicContact CB-CE2 4.2Å; N878-Y882 WeakPolarHBondContact O-CD2 3.27Å; N878-Y882 WeakPolarHBondContact O-CE2 3.43Å; N878-Y882 PolarHBondContact O-N 3.07Å; N878-Y882 VanDerWaalsContact O-N 3.1Å
879	P	93.2	Very high	91.1	Very high	8 Å²	8	39 Å²	39	5%	0.052	20%	0.197	C	C	.	.	H	α-helix	trans	-58.3	-34.6	174	-25.9	34.5	0	0	0	114.9	G62 N63 V66 Y882 T883	G62-P879 WeakPolarHBondContact O-CG 3.46Å; N63-P879 WeakPolarHBondContact OD1-CG 3.38Å; V66-P879 HydrophobicContact CG2-CB 4.25Å; V66-P879 HydrophobicContact CG2-CG 4.11Å; P879-Y882 PolarHBondContact O-N 3Å; P879-T883 WeakPolarHBondContact O-CG2 3.24Å; P879-T883 PolarHBondContact O-N 3.28Å; P879-T883 PolarHBondContact O-OG1 3.07Å
880	I	93	Very high	91.1	Very high	85 Å²	85	43.2 Å²	43.2	44%	0.436	21%	0.213	S	C	.	.	H	α-helix	trans	-68.7	-41.3	179.4	-61.9	173.1	0	0	0	110.2	L877 N878 T883 I884	L877-I880 HydrophobicContact CD2-CD1 4.34Å; L877-I880 WeakPolarHBondContact O-CB 3.23Å; L877-I880 PolarHBondContact O-N 2.04Å; L877-I880 VanDerWaalsContact O-N 3.1Å; N878-I880 VanDerWaalsContact C-N 3.3Å; N878-I880 PolarHBondContact O-N 2.88Å; I880-T883 PolarHBondContact O-N 3.33Å; I880-T883 PolarHBondContact O-OG1 3.12Å; I880-T883 VanDerWaalsContact O-OG1 3.07Å; I880-I884 HydrophobicContact CG2-CD1 3.76Å; I880-I884 VanDerWaalsContact O-CG1 3.28Å; I880-I884 WeakPolarHBondContact O-CG1 3.22Å; I880-I884 PolarHBondContact O-N 3.26Å; I880-I884 VanDerWaalsContact O-N 3.11Å
881	I	91.9	Very high	91	Very high	11 Å²	11	43.5 Å²	43.5	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-40.5	175.5	-64.3	163.2	0	0	0	110.6	T821 V825 V828 L877 N878 F885	T821-I881 HydrophobicContact CG2-CG2 4.17Å; V825-I881 HydrophobicContact CG2-CD1 4.42Å; V825-I881 HydrophobicContact CG2-CG2 3.69Å; V828-I881 HydrophobicContact CB-CD1 4.36Å; V828-I881 HydrophobicContact CG1-CD1 4.33Å; V828-I881 HydrophobicContact CG2-CD1 4.25Å; L877-I881 HydrophobicContact CB-CD1 4.34Å; L877-I881 WeakPolarHBondContact O-CG1 3.38Å; L877-I881 PolarHBondContact O-N 2.85Å; N878-I881 PolarHBondContact O-N 2.76Å; I881-F885 HydrophobicContact CG2-CD2 3.99Å; I881-F885 WeakPolarHBondContact O-CB 3.4Å; I881-F885 WeakPolarHBondContact O-CD2 3.24Å; I881-F885 PolarHBondContact O-N 3.13Å
882	Y	89.5	Confident	91	Very high	17 Å²	17	43.7 Å²	43.7	7%	0.067	22%	0.216	C	C	.	.	H	α-helix	trans	-65	-43.7	176.8	-60.3	-45.1	0	0	0	112.9	V66 I84 N878 P879 N886 F889	V66-Y882 HydrophobicContact CG1-CD2 4.49Å; V66-Y882 HydrophobicContact CG1-CE2 4.44Å; V66-Y882 HydrophobicContact CG2-CD2 3.86Å; V66-Y882 HydrophobicContact CG2-CE2 4.31Å; I84-Y882 HydrophobicContact CD1-CE1 4.02Å; I84-Y882 HydrophobicContact CG1-CE1 4.5Å; I84-Y882 HydrophobicContact CG2-CD2 4.43Å; I84-Y882 HydrophobicContact CG2-CE1 4.33Å; I84-Y882 HydrophobicContact CG2-CE2 3.7Å; N878-Y882 HydrophobicContact CB-CE2 4.2Å; N878-Y882 WeakPolarHBondContact O-CD2 3.27Å; N878-Y882 WeakPolarHBondContact O-CE2 3.43Å; N878-Y882 PolarHBondContact O-N 3.07Å; N878-Y882 VanDerWaalsContact O-N 3.1Å; P879-Y882 PolarHBondContact O-N 3Å; Y882-N886 CarbonylContact O-C 3.57Å; Y882-N886 WeakPolarHBondContact O-CA 3.24Å; Y882-N886 WeakPolarHBondContact O-CB 3.35Å; Y882-N886 PolarHBondContact O-N 3.3Å; Y882-N886 VanDerWaalsContact O-O 3.08Å; Y882-F889 HydrophobicContact CG-CD2 4.41Å
883	T	89.4	Confident	90.9	Very high	41 Å²	41	44.2 Å²	44.2	25%	0.252	22%	0.218	S	C	.	.	H	α-helix	trans	-68.8	-33.3	179.7	47.4	0	0	0	0	113.7	P879 I880 R890 F893	P879-T883 WeakPolarHBondContact O-CG2 3.24Å; P879-T883 PolarHBondContact O-N 3.28Å; P879-T883 PolarHBondContact O-OG1 3.07Å; I880-T883 PolarHBondContact O-N 3.33Å; I880-T883 PolarHBondContact O-OG1 3.12Å; I880-T883 VanDerWaalsContact O-OG1 3.07Å; T883-R890 WeakPolarHBondContact O-CG 3.43Å; T883-F893 HydrophobicContact CG2-CB 4.46Å; T883-F893 HydrophobicContact CG2-CD2 3.31Å; T883-F893 HydrophobicContact CG2-CE2 3.56Å; T883-F893 HydrophobicContact CG2-CG 3.93Å; T883-F893 HydrophobicContact CG2-CZ 4.36Å
884	I	89.6	Confident	90.8	Very high	112 Å²	112	44 Å²	44	57%	0.574	22%	0.216	S	C	*	.	H	α-helix	trans	-76.8	-43.1	176.8	-64.7	169.9	0	0	0	111.7	I880	I880-I884 HydrophobicContact CG2-CD1 3.76Å; I880-I884 VanDerWaalsContact O-CG1 3.28Å; I880-I884 WeakPolarHBondContact O-CG1 3.22Å; I880-I884 PolarHBondContact O-N 3.26Å; I880-I884 VanDerWaalsContact O-N 3.11Å
885	F	85.8	Confident	90.7	Very high	81 Å²	81	49.3 Å²	49.3	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-113.6	-7.9	-165.9	-62.2	-74.7	0	0	0	115.7	T821 I824 I881	T821-F885 HydrophobicContact CG2-CB 3.52Å; T821-F885 HydrophobicContact CG2-CG 4.36Å; T821-F885 WeakPolarHBondContact OG1-CB 3.46Å; I824-F885 HydrophobicContact CD1-CD1 4.33Å; I824-F885 HydrophobicContact CD1-CE1 3.78Å; I824-F885 HydrophobicContact CD1-CE2 4.15Å; I824-F885 HydrophobicContact CD1-CZ 3.68Å; I824-F885 HydrophobicContact CG2-CE2 4.24Å; I881-F885 HydrophobicContact CG2-CD2 3.99Å; I881-F885 WeakPolarHBondContact O-CB 3.4Å; I881-F885 WeakPolarHBondContact O-CD2 3.24Å; I881-F885 PolarHBondContact O-N 3.13Å
886	N	85.5	Confident	90.5	Very high	38 Å²	38	51 Å²	51	20%	0.203	25%	0.248	C	C	.	.			trans	-118.9	106.8	170.5	-170.5	-22.5	0	0	0	111.2	Y882 E888 F889 R890	Y882-N886 CarbonylContact O-C 3.57Å; Y882-N886 WeakPolarHBondContact O-CA 3.24Å; Y882-N886 WeakPolarHBondContact O-CB 3.35Å; Y882-N886 PolarHBondContact O-N 3.3Å; Y882-N886 VanDerWaalsContact O-O 3.08Å; N886-E888 VanDerWaalsContact C-N 3.28Å; N886-E888 PolarHBondContact O-N 3.26Å; N886-E888 WeakPolarHBondContact OD1-CB 3.27Å; N886-E888 PolarHBondContact OD1-N 2.94Å; N886-F889 HydrophobicContact CB-CB 4.33Å; N886-F889 HydrophobicContact CB-CD2 4.14Å; N886-F889 WeakPolarHBondContact ND2-CD2 3.32Å; N886-F889 PolarHBondContact O-N 3.4Å; N886-R890 PolarHBondContact O-N 3Å
887	M	87.1	Confident	90.4	Very high	130 Å²	130	53.5 Å²	53.5	64%	0.64	26%	0.259	S	S	*	.	H	α-helix	trans	-61	-32.7	-179.8	-166.3	-178	86.6	0	0	113.3	R890 I891	M887-R890 PolarHBondContact O-N 3.19Å; M887-I891 HydrophobicContact CE-CD1 4.22Å; M887-I891 HydrophobicContact CG-CD1 4.06Å; M887-I891 WeakPolarHBondContact O-CD1 3.05Å; M887-I891 VanDerWaalsContact O-CG1 3.27Å; M887-I891 WeakPolarHBondContact O-CG1 3.32Å; M887-I891 PolarHBondContact O-N 3.45Å
888	E	89	Confident	90.2	Very high	82 Å²	82	58.5 Å²	58.5	38%	0.383	28%	0.28	S	S	.	.	H	α-helix	trans	-71.7	-43.2	-178.3	-57.8	175.5	141.8	0	0	110.4	L76 N886 I891 A892	L76-E888 HydrophobicContact CD2-CB 3.7Å; N886-E888 VanDerWaalsContact C-N 3.28Å; N886-E888 PolarHBondContact O-N 3.26Å; N886-E888 WeakPolarHBondContact OD1-CB 3.27Å; N886-E888 PolarHBondContact OD1-N 2.94Å; E888-I891 PolarHBondContact O-N 3.02Å; E888-A892 PolarHBondContact O-N 3.32Å
889	F	90.4	Very high	89.7	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-42	169.9	-86	-66.8	0	0	0	111.9	V66 V70 L76 I84 Y882 N886 I891 A892 F893	V66-F889 HydrophobicContact CG1-CE1 4.12Å; V66-F889 HydrophobicContact CG1-CZ 4.34Å; V70-F889 HydrophobicContact CG2-CE1 3.7Å; V70-F889 HydrophobicContact CG2-CZ 3.69Å; L76-F889 HydrophobicContact CD1-CD1 3.9Å; L76-F889 HydrophobicContact CD1-CE1 4.01Å; L76-F889 HydrophobicContact CD1-CG 4.48Å; I84-F889 HydrophobicContact CD1-CE2 4.09Å; I84-F889 HydrophobicContact CG2-CE2 4.4Å; I84-F889 HydrophobicContact CG2-CZ 4.04Å; Y882-F889 HydrophobicContact CG-CD2 4.41Å; N886-F889 HydrophobicContact CB-CB 4.33Å; N886-F889 HydrophobicContact CB-CD2 4.14Å; N886-F889 WeakPolarHBondContact ND2-CD2 3.32Å; N886-F889 PolarHBondContact O-N 3.4Å; F889-I891 VanDerWaalsContact C-N 3.32Å; F889-I891 PolarHBondContact O-N 3.01Å; F889-A892 PolarHBondContact O-N 3.09Å; F889-F893 HydrophobicContact CD1-CE1 4.01Å; F889-F893 WeakPolarHBondContact O-CB 3.48Å; F889-F893 WeakPolarHBondContact O-CD1 3.35Å; F889-F893 PolarHBondContact O-N 3Å
890	R	91.9	Very high	88.4	Confident	112 Å²	112	74.8 Å²	74.8	42%	0.423	35%	0.354	S	S	.	.	H	α-helix	trans	-58.6	-44	177.6	-158.1	-167.3	82.6	-171.5	3.9	111.9	T883 N886 M887 F893 Q894	T883-R890 WeakPolarHBondContact O-CG 3.43Å; N886-R890 PolarHBondContact O-N 3Å; M887-R890 PolarHBondContact O-N 3.19Å; R890-F893 PolarHBondContact O-N 2.76Å; R890-Q894 VanDerWaalsContact NE-OE1 3.11Å; R890-Q894 WeakPolarHBondContact O-CG 3.47Å; R890-Q894 PolarHBondContact O-N 2.87Å
891	I	91.3	Very high	88.1	Confident	70 Å²	70	74.3 Å²	74.3	36%	0.359	35%	0.35	S	S	.	.	H	α-helix	trans	-65.1	-42.1	176.2	-69.6	164.6	0	0	0	111	M887 E888 F889 F893 Q894 K895	M887-I891 HydrophobicContact CE-CD1 4.22Å; M887-I891 HydrophobicContact CG-CD1 4.06Å; M887-I891 WeakPolarHBondContact O-CD1 3.05Å; M887-I891 VanDerWaalsContact O-CG1 3.27Å; M887-I891 WeakPolarHBondContact O-CG1 3.32Å; M887-I891 PolarHBondContact O-N 3.45Å; E888-I891 PolarHBondContact O-N 3.02Å; F889-I891 VanDerWaalsContact C-N 3.32Å; F889-I891 PolarHBondContact O-N 3.01Å; I891-F893 PolarHBondContact O-N 2.86Å; I891-Q894 PolarHBondContact O-N 3.17Å; I891-K895 WeakPolarHBondContact O-CG 3.25Å; I891-K895 PolarHBondContact O-N 3.17Å
892	A	92	Very high	87.9	Confident	3 Å²	3	77.6 Å²	77.6	3%	0.025	37%	0.365	C	S	.	.	H	α-helix	trans	-63.6	-39	175.9	0	0	0	0	0	112.6	E73 L76 E888 F889 K895 L896	E73-A892 HydrophobicContact CB-CB 4.37Å; L76-A892 HydrophobicContact CD1-CB 3.6Å; E888-A892 PolarHBondContact O-N 3.32Å; F889-A892 PolarHBondContact O-N 3.09Å; A892-K895 PolarHBondContact O-N 3.18Å; A892-L896 WeakPolarHBondContact O-CB 3.18Å; A892-L896 WeakPolarHBondContact O-CG 3.49Å; A892-L896 PolarHBondContact O-N 3.32Å
893	F	92	Very high	87.8	Confident	16 Å²	16	80.9 Å²	80.9	7%	0.07	38%	0.382	C	S	.	.	H	α-helix	trans	-65.9	-43.4	175.1	-82.1	44.1	0	0	0	111.2	L65 V66 S69 T883 F889 R890 I891 K895 L896 L897	L65-F893 HydrophobicContact CB-CD2 4.22Å; L65-F893 HydrophobicContact CB-CE1 4.1Å; L65-F893 HydrophobicContact CB-CE2 3.73Å; L65-F893 HydrophobicContact CB-CZ 3.65Å; L65-F893 HydrophobicContact CD1-CD2 4.09Å; L65-F893 HydrophobicContact CD1-CE2 4.07Å; V66-F893 HydrophobicContact CG2-CE1 4.4Å; V66-F893 HydrophobicContact CG2-CZ 3.81Å; S69-F893 WeakPolarHBondContact OG-CD1 3.42Å; S69-F893 VanDerWaalsContact OG-CE1 3.23Å; S69-F893 WeakPolarHBondContact OG-CE1 3.26Å; T883-F893 HydrophobicContact CG2-CB 4.46Å; T883-F893 HydrophobicContact CG2-CD2 3.31Å; T883-F893 HydrophobicContact CG2-CE2 3.56Å; T883-F893 HydrophobicContact CG2-CG 3.93Å; T883-F893 HydrophobicContact CG2-CZ 4.36Å; F889-F893 HydrophobicContact CD1-CE1 4.01Å; F889-F893 WeakPolarHBondContact O-CB 3.48Å; F889-F893 WeakPolarHBondContact O-CD1 3.35Å; F889-F893 PolarHBondContact O-N 3Å; R890-F893 PolarHBondContact O-N 2.76Å; I891-F893 PolarHBondContact O-N 2.86Å; F893-K895 PolarHBondContact O-N 3.29Å; F893-L896 PolarHBondContact O-N 3.18Å; F893-L897 WeakPolarHBondContact O-CB 3.5Å; F893-L897 WeakPolarHBondContact O-CG 3.31Å; F893-L897 PolarHBondContact O-N 2.66Å
894	Q	91.1	Very high	87.8	Confident	49 Å²	49	83.3 Å²	83.3	23%	0.229	39%	0.389	C	S	.	.	H	α-helix	trans	-57.9	-45.5	173.2	-75.6	-179.1	-101.2	0	0	111.4	R890 I891 H898 I899 K900	R890-Q894 VanDerWaalsContact NE-OE1 3.11Å; R890-Q894 WeakPolarHBondContact O-CG 3.47Å; R890-Q894 PolarHBondContact O-N 2.87Å; I891-Q894 PolarHBondContact O-N 3.17Å; Q894-H898 PolarHBondContact O-N 3.48Å; Q894-H898 VanDerWaalsContact O-N 3.13Å; Q894-I899 WeakPolarHBondContact CB-O 3.16Å; Q894-I899 PolarHBondContact O-N 2.89Å; Q894-K900 PolarHBondContact NE2-OXT 2.91Å
895	K	90.8	Very high	87.6	Confident	112 Å²	112	81.5 Å²	81.5	49%	0.487	38%	0.378	S	S	.	.	H	α-helix	trans	-62.6	-38.6	173.9	-71.1	178.9	-176.5	-174.7	0	113.7	E73 I891 A892 F893 H898	E73-K895 IonicContact OE2-NZ 3.77Å; E73-K895 PolarHBondContact OE2-NZ 2.95Å; I891-K895 WeakPolarHBondContact O-CG 3.25Å; I891-K895 PolarHBondContact O-N 3.17Å; A892-K895 PolarHBondContact O-N 3.18Å; F893-K895 PolarHBondContact O-N 3.29Å; K895-H898 PolarHBondContact O-CD2 2.82Å; K895-H898 VanDerWaalsContact O-CD2 3.29Å
896	L	90.5	Very high	87.8	Confident	35 Å²	35	81.5 Å²	81.5	18%	0.183	38%	0.379	C	S	.	.	H	α-helix	trans	-73	-39.1	-178.9	-83.2	164.9	0	0	0	112.8	L65 L68 S69 A892 F893 H898	L65-L896 HydrophobicContact CD2-CB 4.4Å; L65-L896 HydrophobicContact CD2-CD1 4.41Å; L68-L896 HydrophobicContact CB-CD1 4.12Å; L68-L896 HydrophobicContact CB-CD2 4.28Å; S69-L896 VanDerWaalsContact OG-CD1 3.24Å; S69-L896 WeakPolarHBondContact OG-CD1 3.36Å; A892-L896 WeakPolarHBondContact O-CB 3.18Å; A892-L896 WeakPolarHBondContact O-CG 3.49Å; A892-L896 PolarHBondContact O-N 3.32Å; F893-L896 PolarHBondContact O-N 3.18Å; L896-H898 VanDerWaalsContact C-N 3.34Å
897	L	90.7	Very high	87.9	Confident	70 Å²	70	84.6 Å²	84.6	37%	0.366	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	2.7	-177.4	-62.3	174.6	0	0	0	113.2	F61 L65 F893 I899	F61-L897 HydrophobicContact CZ-CD2 3.96Å; L65-L897 HydrophobicContact CD1-CD1 4.06Å; L65-L897 HydrophobicContact CD1-CD2 4.18Å; L65-L897 HydrophobicContact CD1-CG 4.4Å; L65-L897 HydrophobicContact CD2-CD2 3.98Å; L65-L897 HydrophobicContact CD2-CG 4.39Å; F893-L897 WeakPolarHBondContact O-CB 3.5Å; F893-L897 WeakPolarHBondContact O-CG 3.31Å; F893-L897 PolarHBondContact O-N 2.66Å; L897-I899 HydrophobicContact CB-CD1 3.7Å; L897-I899 HydrophobicContact CB-CG1 3.78Å; L897-I899 HydrophobicContact CD1-CD1 3.93Å; L897-I899 HydrophobicContact CG-CD1 4.49Å; L897-I899 PolarHBondContact O-N 3.12Å
898	H	87.3	Confident	88	Confident	155 Å²	155	81.2 Å²	81.2	72%	0.718	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	32.4	-173.8	-55.5	148.6	0	0	0	113.8	Q894 K895 L896	Q894-H898 PolarHBondContact O-N 3.48Å; Q894-H898 VanDerWaalsContact O-N 3.13Å; K895-H898 PolarHBondContact O-CD2 2.82Å; K895-H898 VanDerWaalsContact O-CD2 3.29Å; L896-H898 VanDerWaalsContact C-N 3.34Å
899	I	81.2	Confident	87.9	Confident	98 Å²	98	81.1 Å²	81.1	50%	0.503	37%	0.372	S	S	.	.			trans	-89.9	119.1	177.5	-58.7	172.5	0	0	0	108.7	Q894 L897	Q894-I899 WeakPolarHBondContact CB-O 3.16Å; Q894-I899 PolarHBondContact O-N 2.89Å; L897-I899 HydrophobicContact CB-CD1 3.7Å; L897-I899 HydrophobicContact CB-CG1 3.78Å; L897-I899 HydrophobicContact CD1-CD1 3.93Å; L897-I899 HydrophobicContact CG-CD1 4.49Å; L897-I899 PolarHBondContact O-N 3.12Å
900	K	65.6	Low	87.7	Confident	253 Å²	253	88.5 Å²	88.5	100%	1.1	41%	0.406	S	S	*	.			trans	-71.4	0	173.7	-67.9	-177.7	177.2	178.3	0	111.3	Q894	Q894-K900 PolarHBondContact NE2-OXT 2.91Å

Retrieved 900 of 900 residues in 210.6 ms (Link to these results)

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