A0A096MU72_PAPAN Loading...

Exportin-T

Mediates the nuclear export of aminoacylated tRNAs. In the nucleus binds to tRNA and to the GTPase Ran in its active GTP-bound form. Docking of this trimeric complex to the nuclear pore complex (NPC) is mediated through binding to nucleoporins. Upon transit of a nuclear export complex into the cytoplasm, disassembling of the complex and hydrolysis of Ran-GTP to Ran-GDP (induced by RANBP1 and RANGAP1, respectively) cause release of the tRNA from the export receptor. XPOT then return to the nuclear compartment and mediate another round of transport. The directionality of nuclear export is thought to be conferred by an asymmetric distribution of the GTP- and GDP-bound forms of Ran between the cytoplasm and nucleus. tRNA nucleus export receptor which facilitates tRNA translocation across the nuclear pore complex.

AlphaFold DB (A0A0D9QWP5), UniProt , Accession A0A096MU72, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 962 aa.

						>A0A096MU72_PAPAN|A0A096MU72
MDEQALLGLNPNADSDFRQRALAYFEQLKISPDAWQVCAEALAQRTYSDDHVKFFCFQVLEHQVKYKYSELTTVQQQLIRETLISWLQAQMLNPQPEKTFIRNKAAQVFALLFVTEYLTKWPKFFFDILSVVDLNPRGVDLYLRILMAIDSELVDRDVVHTSEEARRNTLIKDTMREQCIPNLVESWYQILQNYQYTNSEVTCQCLEVVGAYVSWIDLSLIANDRFINMLLGHMSIEVLREEACDCLFEVVNKGMDPVDKMKLVESLCQVLQSAGFFSIDQEEDVDFLARFSKLVNGMGQSLIVSWSKLIKNGDIKNAQEALQAIETKVALMLQLLIHEDDDISSNIIGFCYDYLHILKQLTVLSDQQKANVEAIMLAVMKKLTYDEEYNFENEGEDEAMFVEYRKQLKLLLDRLAQVSPELLLASVRRVFSSTLQNWQTTRFMEVEVAIRLLYMLAEALPVSHGAHFSGDVSKASALQDMMRTLVTSGVSSYQHTSVTLEFFETVVRYEKFFTVEPQHIPCVLMAFLDHRGLRHSSAKVRSRTAYLFSRFVKSLNKQMNPFIEDILNRIQDLLELSPPENGHQSLLSSDDQLFIYETAGVLIVNSEYPAERKQALMRNLLTPLMEKFKILLEKLMLAQDEERQASLADCLNHAVGFASRTSKAFSNKQTVKQCGCSEVYLDCLQTFLPALSCPLQKDILRSGVRTFLHRMIICLEEEVLPFIPSASEHMLKDCEAKDLQEFIPLINQITAKFKIQVSPFLQQMFMPLLHAIFEVLLRPAEENDQSAALEKQMLRRSYFAFLQTVTGSGMSEVIANQGAENVERVLVTVIQGAVEYPDPIAQKTCFIILSKLVELWGGKDGPVGFADFVYKHIVPACFLAPLKQTFDLADAQTVLALSECAVTLKTIHLKRGPECVQYLQQEYLPSLQVAPEIIQEFCQALQQPDAKVFKNYLKVFFQRAKP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	70.3	Confident	73.6	Confident	47 Å²	47	61.2 Å²	61.2	23%	0.232	32%	0.32	C	S	.	.				0	161.6	0	-72.1	-169.8	-83.1	0	0	108.6	E3 L6 V37 A41 Y47 V52 C56	M1-E3 PolarHBondContact O-N 2.63Å; M1-L6 HydrophobicContact CB-CD1 3.84Å; M1-L6 HydrophobicContact CE-CD1 4.22Å; M1-L6 HydrophobicContact SD-CD1 4.44Å; M1-V37 HydrophobicContact CG-CG1 3.64Å; M1-A41 HydrophobicContact CE-CB 3.88Å; M1-Y47 HydrophobicContact CE-CD2 3.65Å; M1-Y47 HydrophobicContact CE-CE1 4.44Å; M1-Y47 HydrophobicContact CE-CE2 3.13Å; M1-V52 HydrophobicContact CE-CG1 3.8Å; M1-C56 VanDerWaalsContact CE-SG 3.54Å
2	D	76.9	Confident	73.9	Confident	56 Å²	56	68.3 Å²	68.3	30%	0.299	36%	0.359	S	S	.	.			trans	-69.3	98.7	173	-178.8	-4.5	0	0	0	109.4	Q4 A5 L6 R20 Y24	D2-Q4 PolarHBondContact O-N 3.02Å; D2-Q4 WeakPolarHBondContact OD1-CB 3.44Å; D2-Q4 PolarHBondContact OD1-N 3.43Å; D2-A5 HydrophobicContact CB-CB 4Å; D2-A5 PolarHBondContact O-N 3.22Å; D2-A5 VanDerWaalsContact O-N 3.11Å; D2-A5 PolarHBondContact OD1-N 3.17Å; D2-L6 WeakPolarHBondContact O-CG 3.24Å; D2-L6 PolarHBondContact O-N 2.99Å; D2-L6 VanDerWaalsContact O-N 3.16Å; D2-R20 IonicContact OD1-NH2 3.98Å; D2-R20 IonicContact OD2-CZ 3.81Å; D2-R20 IonicContact OD2-NE 3.4Å; D2-R20 IonicContact OD2-NH2 3.76Å; D2-R20 PolarHBondContact OD2-NH2 3.25Å; D2-Y24 HydrophobicContact CB-CD2 4.48Å; D2-Y24 HydrophobicContact CB-CE1 4.26Å; D2-Y24 HydrophobicContact CB-CE2 4.02Å; D2-Y24 PolarHBondContact N-OH 3Å; D2-Y24 VanDerWaalsContact N-OH 3.08Å
3	E	74	Confident	74.3	Confident	142 Å²	142	64.2 Å²	64.2	66%	0.664	34%	0.341	S	S	*	.	H	α-helix	trans	-60.1	-28.8	-178	-66.4	-175.8	174.3	0	0	112.8	M1 L6 L7	M1-E3 PolarHBondContact O-N 2.63Å; E3-L6 PolarHBondContact O-N 2.95Å; E3-L7 PolarHBondContact O-N 2.65Å
4	Q	69.2	Low	74.7	Confident	110 Å²	110	67.9 Å²	67.9	51%	0.514	36%	0.36	S	S	.	.	H	α-helix	trans	-73.7	-33.1	177	-69.7	-171.7	-12.5	0	0	112.4	D2	D2-Q4 PolarHBondContact O-N 3.02Å; D2-Q4 WeakPolarHBondContact OD1-CB 3.44Å; D2-Q4 PolarHBondContact OD1-N 3.43Å
5	A	73.6	Confident	75.1	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.008	37%	0.373	C	S	.	.	H	α-helix	trans	-70.7	-35.8	174.3	0	0	0	0	0	111.1	D2 L7 G8 R20 A21 Y24	D2-A5 HydrophobicContact CB-CB 4Å; D2-A5 PolarHBondContact O-N 3.22Å; D2-A5 VanDerWaalsContact O-N 3.11Å; D2-A5 PolarHBondContact OD1-N 3.17Å; A5-L7 VanDerWaalsContact C-N 3.26Å; A5-L7 PolarHBondContact O-N 3.09Å; A5-G8 PolarHBondContact O-N 3.17Å; A5-G8 VanDerWaalsContact O-N 3.15Å; A5-R20 HydrophobicContact CB-CG 4.32Å; A5-A21 VanDerWaalsContact O-CB 3.26Å; A5-A21 WeakPolarHBondContact O-CB 3.32Å; A5-Y24 HydrophobicContact CB-CD1 3.85Å; A5-Y24 HydrophobicContact CB-CG 3.87Å
6	L	75.9	Confident	75.5	Confident	13 Å²	13	72.1 Å²	72.1	7%	0.068	39%	0.391	C	S	.	.	H	α-helix	trans	-66.2	-24.7	178.7	-65.1	177.5	0	0	0	113.5	M1 D2 E3 G8 L9 Y47 V52	M1-L6 HydrophobicContact CB-CD1 3.84Å; M1-L6 HydrophobicContact CE-CD1 4.22Å; M1-L6 HydrophobicContact SD-CD1 4.44Å; D2-L6 WeakPolarHBondContact O-CG 3.24Å; D2-L6 PolarHBondContact O-N 2.99Å; D2-L6 VanDerWaalsContact O-N 3.16Å; E3-L6 PolarHBondContact O-N 2.95Å; L6-G8 PolarHBondContact O-N 2.97Å; L6-L9 HydrophobicContact CD2-CD1 3.81Å; L6-L9 WeakPolarHBondContact O-CB 3.47Å; L6-L9 PolarHBondContact O-N 3.35Å; L6-L9 VanDerWaalsContact O-N 3.08Å; L6-Y47 HydrophobicContact CD1-CD1 4.48Å; L6-Y47 HydrophobicContact CD1-CE1 3.94Å; L6-V52 HydrophobicContact CB-CG2 4.21Å; L6-V52 HydrophobicContact CD1-CG1 3.95Å; L6-V52 HydrophobicContact CD1-CG2 4.32Å; L6-V52 HydrophobicContact CD2-CG1 4.11Å; L6-V52 HydrophobicContact CD2-CG2 4.23Å; L6-V52 HydrophobicContact CG-CG2 4.48Å
7	L	73.9	Confident	75.7	Confident	107 Å²	107	72.5 Å²	72.5	56%	0.56	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-59.6	-26.9	173.2	-68.3	173.1	0	0	0	112.7	E3 A5 L9 N10 A13 F17	E3-L7 PolarHBondContact O-N 2.65Å; A5-L7 VanDerWaalsContact C-N 3.26Å; A5-L7 PolarHBondContact O-N 3.09Å; L7-L9 PolarHBondContact O-N 3.01Å; L7-N10 WeakPolarHBondContact O-CB 3.21Å; L7-N10 PolarHBondContact O-N 3.28Å; L7-A13 WeakPolarHBondContact O-CB 3.25Å; L7-F17 HydrophobicContact CB-CD1 4.47Å
8	G	76.1	Confident	75.9	Confident	7 Å²	7	75.2 Å²	75.2	7%	0.072	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-71	-10.6	176.5	0	0	0	0	0	115.2	A5 L6 N10 F17 R18	A5-G8 PolarHBondContact O-N 3.17Å; A5-G8 VanDerWaalsContact O-N 3.15Å; L6-G8 PolarHBondContact O-N 2.97Å; G8-N10 VanDerWaalsContact C-N 3.3Å; G8-F17 WeakPolarHBondContact CA-O 3.48Å; G8-R18 WeakPolarHBondContact O-CG 3.46Å
9	L	75.3	Confident	76.3	Confident	41 Å²	41	77.9 Å²	77.9	22%	0.215	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-82.2	-9.6	175.2	-63.2	172.1	0	0	0	112.7	L6 L7 A21 H51 V52 F55	L6-L9 HydrophobicContact CD2-CD1 3.81Å; L6-L9 WeakPolarHBondContact O-CB 3.47Å; L6-L9 PolarHBondContact O-N 3.35Å; L6-L9 VanDerWaalsContact O-N 3.08Å; L7-L9 PolarHBondContact O-N 3.01Å; L9-A21 HydrophobicContact CD2-CB 4.31Å; L9-A21 HydrophobicContact CG-CB 4.39Å; L9-H51 HydrophobicContact CB-CB 3.97Å; L9-V52 HydrophobicContact CD1-CG2 4.16Å; L9-F55 HydrophobicContact CD1-CB 3.99Å; L9-F55 HydrophobicContact CD1-CD2 4.08Å; L9-F55 HydrophobicContact CD1-CG 4.06Å; L9-F55 HydrophobicContact CD2-CD2 4.04Å
10	N	74.9	Confident	76.6	Confident	72 Å²	72	79 Å²	79	39%	0.385	40%	0.402	S	S	.	.	S	Bend	trans	-70.9	131.9	174.9	-172.7	-35.2	0	0	0	109.9	L7 G8 N12 A13	L7-N10 WeakPolarHBondContact O-CB 3.21Å; L7-N10 PolarHBondContact O-N 3.28Å; G8-N10 VanDerWaalsContact C-N 3.3Å; N10-N12 PolarHBondContact O-N 3.33Å; N10-N12 PolarHBondContact OD1-N 3.1Å; N10-A13 HydrophobicContact CB-CB 4.29Å; N10-A13 WeakPolarHBondContact O-CB 3.42Å; N10-A13 PolarHBondContact O-N 3.27Å
11	P	69.8	Low	76.8	Confident	77 Å²	77	75.5 Å²	75.5	50%	0.5	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-25.7	176.1	-26.1	32.7	0	0	0	114.2	R18	P11-R18 PolarHBondContact O-NH2 3.31Å
12	N	77.4	Confident	77.3	Confident	147 Å²	147	78.8 Å²	78.8	79%	0.786	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	8.2	179	-62.5	-32.4	0	0	0	113.9	N10	N10-N12 PolarHBondContact O-N 3.33Å; N10-N12 PolarHBondContact OD1-N 3.1Å
13	A	78.9	Confident	77.7	Confident	15 Å²	15	78.6 Å²	78.6	12%	0.124	41%	0.409	C	S	.	.			trans	-73.5	142.7	179.5	0	0	0	0	0	112.4	L7 N10 F17 R18	L7-A13 WeakPolarHBondContact O-CB 3.25Å; N10-A13 HydrophobicContact CB-CB 4.29Å; N10-A13 WeakPolarHBondContact O-CB 3.42Å; N10-A13 PolarHBondContact O-N 3.27Å; A13-F17 HydrophobicContact CB-CB 4.26Å; A13-R18 HydrophobicContact CB-CG 4.3Å; A13-R18 PolarHBondContact O-NE 3.41Å
14	D	79.9	Confident	78.1	Confident	115 Å²	115	73.6 Å²	73.6	62%	0.615	38%	0.384	S	S	*	.			trans	-61.5	156.2	174.6	-66.1	-37.2	0	0	0	112.1	D16 F17 R18	D14-D16 PolarHBondContact O-N 3.4Å; D14-D16 VanDerWaalsContact O-N 3.16Å; D14-F17 HydrophobicContact CB-CD2 4.21Å; D14-F17 PolarHBondContact O-N 3.03Å; D14-R18 PolarHBondContact O-N 2.95Å; D14-R18 VanDerWaalsContact O-N 3.08Å
15	S	80.3	Confident	78.6	Confident	79 Å²	79	69.1 Å²	69.1	55%	0.552	36%	0.363	S	S	*	.	H	α-helix	trans	-52.1	-39.3	-178.4	-176	0	0	0	0	113.2	R18 Q19	S15-R18 PolarHBondContact O-N 3.49Å; S15-Q19 PolarHBondContact O-N 3.31Å
16	D	80.9	Confident	79	Confident	124 Å²	124	73.4 Å²	73.4	66%	0.663	38%	0.383	S	S	*	.	H	α-helix	trans	-66.5	-39.7	-179.4	-66.7	-10	0	0	0	112.1	D14 R20	D14-D16 PolarHBondContact O-N 3.4Å; D14-D16 VanDerWaalsContact O-N 3.16Å; D16-R20 WeakPolarHBondContact O-CB 3.44Å; D16-R20 PolarHBondContact O-N 2.7Å
17	F	78.9	Confident	79.4	Confident	80 Å²	80	78.7 Å²	78.7	35%	0.351	41%	0.407	S	S	.	.	H	α-helix	trans	-68.9	-38.6	175.5	-75	-74.6	0	0	0	111.3	L7 G8 A13 D14 R20 A21	L7-F17 HydrophobicContact CB-CD1 4.47Å; G8-F17 WeakPolarHBondContact CA-O 3.48Å; A13-F17 HydrophobicContact CB-CB 4.26Å; D14-F17 HydrophobicContact CB-CD2 4.21Å; D14-F17 PolarHBondContact O-N 3.03Å; F17-R20 PolarHBondContact O-N 3.19Å; F17-A21 PolarHBondContact O-N 3.11Å
18	R	80.6	Confident	79.7	Confident	121 Å²	121	74.4 Å²	74.4	46%	0.457	39%	0.385	S	S	.	.	H	α-helix	trans	-63.1	-44.7	174.9	-66.1	-178.6	-172.2	-174.9	0.3	112.1	G8 P11 A13 D14 S15 R20 A21 L22	G8-R18 WeakPolarHBondContact O-CG 3.46Å; P11-R18 PolarHBondContact O-NH2 3.31Å; A13-R18 HydrophobicContact CB-CG 4.3Å; A13-R18 PolarHBondContact O-NE 3.41Å; D14-R18 PolarHBondContact O-N 2.95Å; D14-R18 VanDerWaalsContact O-N 3.08Å; S15-R18 PolarHBondContact O-N 3.49Å; R18-R20 VanDerWaalsContact C-N 3.31Å; R18-R20 PolarHBondContact O-N 3.42Å; R18-A21 PolarHBondContact O-N 2.9Å; R18-L22 WeakPolarHBondContact O-CG 3.39Å; R18-L22 PolarHBondContact O-N 3.34Å
19	Q	81.9	Confident	79.8	Confident	126 Å²	126	75.8 Å²	75.8	59%	0.589	39%	0.389	S	S	*	.	H	α-helix	trans	-60.9	-41.2	174.9	-79.2	-173.3	-1.8	0	0	111.6	S15 L22 A23	S15-Q19 PolarHBondContact O-N 3.31Å; Q19-L22 PolarHBondContact O-N 3.12Å; Q19-A23 WeakPolarHBondContact O-CB 3.48Å; Q19-A23 PolarHBondContact O-N 3Å
20	R	83.8	Confident	80	Confident	100 Å²	100	79.7 Å²	79.7	38%	0.377	41%	0.409	S	S	.	.	H	α-helix	trans	-64.3	-39.3	176.2	-171	171.7	174	-172.6	-9.1	112.4	D2 A5 D16 F17 R18 Y24	D2-R20 IonicContact OD1-NH2 3.98Å; D2-R20 IonicContact OD2-CZ 3.81Å; D2-R20 IonicContact OD2-NE 3.4Å; D2-R20 IonicContact OD2-NH2 3.76Å; D2-R20 PolarHBondContact OD2-NH2 3.25Å; A5-R20 HydrophobicContact CB-CG 4.32Å; D16-R20 WeakPolarHBondContact O-CB 3.44Å; D16-R20 PolarHBondContact O-N 2.7Å; F17-R20 PolarHBondContact O-N 3.19Å; R18-R20 VanDerWaalsContact C-N 3.31Å; R18-R20 PolarHBondContact O-N 3.42Å; R20-Y24 WeakPolarHBondContact O-CB 3.29Å; R20-Y24 PolarHBondContact O-N 2.87Å
21	A	80.4	Confident	80.4	Confident	5 Å²	5	78.6 Å²	78.6	4%	0.041	41%	0.406	C	S	.	.	H	α-helix	trans	-63.4	-44	174.6	0	0	0	0	0	112.2	A5 L9 F17 R18 Y24 F25	A5-A21 VanDerWaalsContact O-CB 3.26Å; A5-A21 WeakPolarHBondContact O-CB 3.32Å; L9-A21 HydrophobicContact CD2-CB 4.31Å; L9-A21 HydrophobicContact CG-CB 4.39Å; F17-A21 PolarHBondContact O-N 3.11Å; R18-A21 PolarHBondContact O-N 2.9Å; A21-Y24 PolarHBondContact O-N 2.79Å; A21-F25 PolarHBondContact O-N 3.49Å
22	L	81.4	Confident	80.6	Confident	116 Å²	116	79.1 Å²	79.1	61%	0.607	41%	0.41	S	S	*	.	H	α-helix	trans	-64.6	-44.7	176.8	-71.7	171.4	0	0	0	112.1	R18 Q19 Y24 F25 E26	R18-L22 WeakPolarHBondContact O-CG 3.39Å; R18-L22 PolarHBondContact O-N 3.34Å; Q19-L22 PolarHBondContact O-N 3.12Å; L22-Y24 VanDerWaalsContact C-N 3.27Å; L22-Y24 PolarHBondContact O-N 3.14Å; L22-F25 VanDerWaalsContact O-CB 3.31Å; L22-F25 WeakPolarHBondContact O-CB 3.38Å; L22-F25 PolarHBondContact O-N 3.21Å; L22-F25 VanDerWaalsContact O-N 3.16Å; L22-E26 PolarHBondContact O-N 3.39Å; L22-E26 VanDerWaalsContact O-N 3.13Å
23	A	83.8	Confident	80.6	Confident	53 Å²	53	76.2 Å²	76.2	44%	0.438	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-39.6	175.5	0	0	0	0	0	111.5	Q19 E26 Q27	Q19-A23 WeakPolarHBondContact O-CB 3.48Å; Q19-A23 PolarHBondContact O-N 3Å; A23-E26 PolarHBondContact O-N 3.14Å; A23-Q27 WeakPolarHBondContact O-CG 3.5Å; A23-Q27 PolarHBondContact O-N 3.19Å; A23-Q27 VanDerWaalsContact O-N 3.09Å
24	Y	83.4	Confident	80.7	Confident	37 Å²	37	75.9 Å²	75.9	15%	0.145	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-37.5	175.5	-172.3	-122.6	0	0	0	112.3	D2 A5 R20 A21 L22 Q27 L28 F55	D2-Y24 HydrophobicContact CB-CD2 4.48Å; D2-Y24 HydrophobicContact CB-CE1 4.26Å; D2-Y24 HydrophobicContact CB-CE2 4.02Å; D2-Y24 PolarHBondContact N-OH 3Å; D2-Y24 VanDerWaalsContact N-OH 3.08Å; A5-Y24 HydrophobicContact CB-CD1 3.85Å; A5-Y24 HydrophobicContact CB-CG 3.87Å; R20-Y24 WeakPolarHBondContact O-CB 3.29Å; R20-Y24 PolarHBondContact O-N 2.87Å; A21-Y24 PolarHBondContact O-N 2.79Å; L22-Y24 VanDerWaalsContact C-N 3.27Å; L22-Y24 PolarHBondContact O-N 3.14Å; Y24-Q27 WeakPolarHBondContact O-CB 3.35Å; Y24-Q27 PolarHBondContact O-N 2.97Å; Y24-L28 HydrophobicContact CD1-CD1 3.9Å; Y24-L28 HydrophobicContact CD1-CG 4.45Å; Y24-L28 HydrophobicContact CE1-CD1 3.57Å; Y24-L28 HydrophobicContact CE1-CD2 4.45Å; Y24-L28 HydrophobicContact CE1-CG 4.19Å; Y24-L28 HydrophobicContact CE2-CD2 4.15Å; Y24-L28 HydrophobicContact CE2-CG 4.24Å; Y24-L28 WeakPolarHBondContact O-CG 3.38Å; Y24-L28 PolarHBondContact O-N 3.35Å; Y24-F55 HydrophobicContact CD1-CZ 4.38Å
25	F	78.8	Confident	80.9	Confident	15 Å²	15	70.5 Å²	70.5	7%	0.066	36%	0.363	C	S	.	.	H	α-helix	trans	-58.5	-50.2	174.3	-171.1	-135.6	0	0	0	112.7	A21 L22 Q27 L28 K29 F55 Q58 V59	A21-F25 PolarHBondContact O-N 3.49Å; L22-F25 VanDerWaalsContact O-CB 3.31Å; L22-F25 WeakPolarHBondContact O-CB 3.38Å; L22-F25 PolarHBondContact O-N 3.21Å; L22-F25 VanDerWaalsContact O-N 3.16Å; F25-Q27 VanDerWaalsContact C-N 3.28Å; F25-Q27 PolarHBondContact O-N 3.09Å; F25-L28 PolarHBondContact O-N 3.29Å; F25-L28 VanDerWaalsContact O-N 3.12Å; F25-K29 HydrophobicContact CE1-CD 4.3Å; F25-K29 HydrophobicContact CE2-CG 4.48Å; F25-K29 HydrophobicContact CZ-CD 4.39Å; F25-K29 PolarHBondContact O-N 3.14Å; F25-F55 HydrophobicContact CB-CE2 3.53Å; F25-F55 HydrophobicContact CB-CZ 3.83Å; F25-F55 AromaticContact CD2-CD2 3.82Å; F25-F55 HydrophobicContact CD2-CD2 3.82Å; F25-F55 HydrophobicContact CD2-CE1 4.3Å; F25-F55 AromaticContact CD2-CE2 3.23Å; F25-F55 HydrophobicContact CD2-CE2 3.23Å; F25-F55 AromaticContact CD2-CZ 3.51Å; F25-F55 HydrophobicContact CD2-CZ 3.51Å; F25-F55 HydrophobicContact CE2-CD2 4.3Å; F25-F55 HydrophobicContact CE2-CE2 4.14Å; F25-F55 HydrophobicContact CG-CD2 4.4Å; F25-F55 AromaticContact CG-CE2 3.61Å; F25-F55 HydrophobicContact CG-CE2 3.61Å; F25-F55 HydrophobicContact CG-CZ 4.08Å; F25-Q58 HydrophobicContact CE2-CB 4.14Å; F25-Q58 HydrophobicContact CE2-CG 4.28Å; F25-Q58 HydrophobicContact CZ-CB 4.09Å; F25-Q58 VanDerWaalsContact CZ-CD 3.43Å; F25-Q58 HydrophobicContact CZ-CG 3.72Å; F25-V59 HydrophobicContact CD2-CG2 3.98Å; F25-V59 HydrophobicContact CE2-CG2 3.77Å
26	E	82.1	Confident	81.3	Confident	92 Å²	92	69.7 Å²	69.7	43%	0.43	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-36.9	179.5	-68.3	-54.5	135.7	0	0	111.1	L22 A23 L28 K29 I30	L22-E26 PolarHBondContact O-N 3.39Å; L22-E26 VanDerWaalsContact O-N 3.13Å; A23-E26 PolarHBondContact O-N 3.14Å; E26-L28 PolarHBondContact O-N 3.47Å; E26-K29 PolarHBondContact O-N 2.92Å; E26-K29 IonicContact OE1-NZ 2.74Å; E26-K29 PolarHBondContact OE1-NZ 2.83Å; E26-K29 IonicContact OE2-NZ 3.57Å; E26-I30 WeakPolarHBondContact O-CD1 3.5Å; E26-I30 VanDerWaalsContact O-CG1 3.23Å; E26-I30 WeakPolarHBondContact O-CG1 3.49Å; E26-I30 PolarHBondContact O-N 3.38Å; E26-I30 VanDerWaalsContact O-N 3.12Å
27	Q	84.4	Confident	81.5	Confident	124 Å²	124	66.9 Å²	66.9	58%	0.579	34%	0.338	S	S	*	.	H	α-helix	trans	-60.9	-43.5	171.7	-75.2	178.4	-0.5	0	0	112.8	A23 Y24 F25 I30 S31	A23-Q27 WeakPolarHBondContact O-CG 3.5Å; A23-Q27 PolarHBondContact O-N 3.19Å; A23-Q27 VanDerWaalsContact O-N 3.09Å; Y24-Q27 WeakPolarHBondContact O-CB 3.35Å; Y24-Q27 PolarHBondContact O-N 2.97Å; F25-Q27 VanDerWaalsContact C-N 3.28Å; F25-Q27 PolarHBondContact O-N 3.09Å; Q27-I30 PolarHBondContact O-N 3.39Å; Q27-S31 WeakPolarHBondContact O-CB 3.47Å; Q27-S31 PolarHBondContact O-N 3.33Å
28	L	80.6	Confident	81.8	Confident	16 Å²	16	63.1 Å²	63.1	8%	0.084	32%	0.321	C	S	.	.	H	α-helix	trans	-68.2	-34.5	179.6	-68.5	174.3	0	0	0	112.5	Y24 F25 E26 I30 A34 F55 V59	Y24-L28 HydrophobicContact CD1-CD1 3.9Å; Y24-L28 HydrophobicContact CD1-CG 4.45Å; Y24-L28 HydrophobicContact CE1-CD1 3.57Å; Y24-L28 HydrophobicContact CE1-CD2 4.45Å; Y24-L28 HydrophobicContact CE1-CG 4.19Å; Y24-L28 HydrophobicContact CE2-CD2 4.15Å; Y24-L28 HydrophobicContact CE2-CG 4.24Å; Y24-L28 WeakPolarHBondContact O-CG 3.38Å; Y24-L28 PolarHBondContact O-N 3.35Å; F25-L28 PolarHBondContact O-N 3.29Å; F25-L28 VanDerWaalsContact O-N 3.12Å; E26-L28 PolarHBondContact O-N 3.47Å; L28-I30 VanDerWaalsContact C-N 3.34Å; L28-A34 HydrophobicContact CB-CB 4.14Å; L28-A34 HydrophobicContact CD2-CB 3.48Å; L28-A34 VanDerWaalsContact CD2-CB 3.48Å; L28-A34 HydrophobicContact CG-CB 4.39Å; L28-A34 WeakPolarHBondContact O-CB 3.32Å; L28-F55 HydrophobicContact CD1-CE1 3.44Å; L28-F55 VanDerWaalsContact CD1-CE1 3.44Å; L28-F55 HydrophobicContact CD1-CZ 3.78Å; L28-V59 HydrophobicContact CB-CG2 4.3Å; L28-V59 HydrophobicContact CD1-CG2 4.43Å
29	K	78.7	Confident	82.1	Confident	37 Å²	37	57.4 Å²	57.4	16%	0.161	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-36.5	173.3	-73.7	178.8	-177.7	164.4	0	113	F25 E26 H62 K67	F25-K29 HydrophobicContact CE1-CD 4.3Å; F25-K29 HydrophobicContact CE2-CG 4.48Å; F25-K29 HydrophobicContact CZ-CD 4.39Å; F25-K29 PolarHBondContact O-N 3.14Å; E26-K29 PolarHBondContact O-N 2.92Å; E26-K29 IonicContact OE1-NZ 2.74Å; E26-K29 PolarHBondContact OE1-NZ 2.83Å; E26-K29 IonicContact OE2-NZ 3.57Å; K29-H62 HydrophobicContact CG-CB 4.37Å; K29-K67 PolarHBondContact O-NZ 3.29Å
30	I	80	Confident	82.3	Confident	123 Å²	123	56.4 Å²	56.4	63%	0.631	30%	0.295	S	S	*	.	H	α-helix	trans	-75.7	-39.7	-178.3	-66.6	165.9	0	0	0	110.4	E26 Q27 L28 K67	E26-I30 WeakPolarHBondContact O-CD1 3.5Å; E26-I30 VanDerWaalsContact O-CG1 3.23Å; E26-I30 WeakPolarHBondContact O-CG1 3.49Å; E26-I30 PolarHBondContact O-N 3.38Å; E26-I30 VanDerWaalsContact O-N 3.12Å; Q27-I30 PolarHBondContact O-N 3.39Å; L28-I30 VanDerWaalsContact C-N 3.34Å; I30-K67 PolarHBondContact O-NZ 3.15Å
31	S	82.1	Confident	82.4	Confident	48 Å²	48	52 Å²	52	34%	0.336	28%	0.28	S	S	.	.	S	Bend	trans	-67.9	134.7	-175.1	177	0	0	0	0	113.3	Q27 D33	Q27-S31 WeakPolarHBondContact O-CB 3.47Å; Q27-S31 PolarHBondContact O-N 3.33Å; S31-D33 PolarHBondContact O-N 2.79Å
32	P	73.2	Confident	82.7	Confident	88 Å²	88	52.1 Å²	52.1	57%	0.571	28%	0.28	S	S	*	.	S	Bend	trans	-70.8	-29.1	-174.1	27	-34.6	0	0	0	114.3	W35	P32-W35 PolarHBondContact O-NE1 3.02Å
33	D	79.4	Confident	82.8	Confident	86 Å²	86	47.8 Å²	47.8	46%	0.46	26%	0.261	S	S	.	.	S	Bend	trans	-110.9	-8.5	-174.1	-61.4	-49.4	0	0	0	113.3	S31 W35 Q36	S31-D33 PolarHBondContact O-N 2.79Å; D33-W35 PolarHBondContact O-N 3.33Å; D33-Q36 VanDerWaalsContact O-CB 3.32Å; D33-Q36 WeakPolarHBondContact O-CB 3.31Å; D33-Q36 PolarHBondContact O-N 3.3Å
34	A	80.3	Confident	82.7	Confident	9 Å²	9	51.2 Å²	51.2	7%	0.074	27%	0.268	C	S	.	.	H	α-helix	trans	-58.6	-32.4	-176.3	0	0	0	0	0	114.4	L28 Q36 V37	L28-A34 HydrophobicContact CB-CB 4.14Å; L28-A34 HydrophobicContact CD2-CB 3.48Å; L28-A34 VanDerWaalsContact CD2-CB 3.48Å; L28-A34 HydrophobicContact CG-CB 4.39Å; L28-A34 WeakPolarHBondContact O-CB 3.32Å; A34-Q36 PolarHBondContact O-N 3.21Å; A34-V37 PolarHBondContact O-N 2.96Å
35	W	84.4	Confident	82.3	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-64.5	-25.8	177.7	68.9	-92.9	0	0	0	112.4	P32 D33 V37 C38 A39 V59 L60 Q63 L71 Q75 L78 I79	P32-W35 PolarHBondContact O-NE1 3.02Å; D33-W35 PolarHBondContact O-N 3.33Å; W35-V37 VanDerWaalsContact C-N 3.3Å; W35-V37 PolarHBondContact O-N 3.49Å; W35-C38 WeakPolarHBondContact O-CB 3.38Å; W35-C38 PolarHBondContact O-N 3.31Å; W35-A39 HydrophobicContact CE3-CB 4.23Å; W35-A39 HydrophobicContact CZ3-CB 4.26Å; W35-A39 WeakPolarHBondContact O-CB 3.39Å; W35-A39 PolarHBondContact O-N 3.08Å; W35-V59 HydrophobicContact CB-CG1 3.97Å; W35-L60 HydrophobicContact CB-CD2 4.37Å; W35-L60 HydrophobicContact CE3-CD2 3.87Å; W35-Q63 HydrophobicContact CB-CB 4.27Å; W35-Q63 HydrophobicContact CB-CG 4.23Å; W35-Q63 HydrophobicContact CD2-CG 4.23Å; W35-Q63 HydrophobicContact CG-CB 4.37Å; W35-Q63 HydrophobicContact CG-CG 3.8Å; W35-L71 HydrophobicContact CZ2-CD1 4.35Å; W35-L71 HydrophobicContact CZ2-CD2 3.82Å; W35-Q75 HydrophobicContact CH2-CB 3.91Å; W35-Q75 HydrophobicContact CH2-CG 4.25Å; W35-Q75 WeakPolarHBondContact CH2-O 3.46Å; W35-Q75 HydrophobicContact CZ2-CB 3.7Å; W35-Q75 HydrophobicContact CZ2-CG 3.81Å; W35-L78 HydrophobicContact CH2-CD2 4.14Å; W35-L78 HydrophobicContact CZ3-CD2 4.3Å; W35-I79 HydrophobicContact CE3-CD1 4.17Å; W35-I79 HydrophobicContact CE3-CG1 3.89Å; W35-I79 HydrophobicContact CH2-CD1 4.05Å; W35-I79 HydrophobicContact CH2-CG1 3.7Å; W35-I79 HydrophobicContact CZ3-CD1 3.85Å; W35-I79 HydrophobicContact CZ3-CG1 3.25Å
36	Q	87.3	Confident	82.1	Confident	63 Å²	63	57.1 Å²	57.1	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-36.4	178.3	-63.5	-179.6	-1.4	0	0	111.4	D33 A34 C38 A39 E40 L78	D33-Q36 VanDerWaalsContact O-CB 3.32Å; D33-Q36 WeakPolarHBondContact O-CB 3.31Å; D33-Q36 PolarHBondContact O-N 3.3Å; A34-Q36 PolarHBondContact O-N 3.21Å; Q36-C38 VanDerWaalsContact C-N 3.3Å; Q36-C38 PolarHBondContact O-N 2.94Å; Q36-A39 WeakPolarHBondContact O-CB 3.33Å; Q36-A39 PolarHBondContact O-N 2.96Å; Q36-E40 WeakPolarHBondContact O-CB 3.44Å; Q36-E40 PolarHBondContact O-N 2.7Å; Q36-L78 HydrophobicContact CG-CD2 4.38Å
37	V	85	Confident	81.9	Confident	65 Å²	65	55.1 Å²	55.1	39%	0.394	29%	0.287	S	S	.	.	H	α-helix	trans	-65.8	-38.2	176.1	-175.2	0	0	0	0	110.4	M1 A34 W35 A41	M1-V37 HydrophobicContact CG-CG1 3.64Å; A34-V37 PolarHBondContact O-N 2.96Å; W35-V37 VanDerWaalsContact C-N 3.3Å; W35-V37 PolarHBondContact O-N 3.49Å; V37-A41 VanDerWaalsContact O-CB 3.22Å; V37-A41 WeakPolarHBondContact O-CB 3.38Å; V37-A41 PolarHBondContact O-N 3.04Å
38	C	86.3	Confident	81.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.9	-39	174.7	-64.6	0	0	0	0	111.6	W35 Q36 A41 L42 C56 V59	W35-C38 WeakPolarHBondContact O-CB 3.38Å; W35-C38 PolarHBondContact O-N 3.31Å; Q36-C38 VanDerWaalsContact C-N 3.3Å; Q36-C38 PolarHBondContact O-N 2.94Å; C38-A41 PolarHBondContact O-N 3.09Å; C38-L42 WeakPolarHBondContact O-CG 3.47Å; C38-L42 PolarHBondContact O-N 3.01Å; C38-L42 VanDerWaalsContact O-N 3.1Å; C38-C56 HydrophobicContact CB-CB 3.83Å; C38-V59 HydrophobicContact CB-CB 4.45Å; C38-V59 HydrophobicContact CB-CG1 4.48Å
39	A	86.5	Confident	81.5	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-49.7	176.2	0	0	0	0	0	111.5	W35 Q36 A41 L42 A43 L60 T82	W35-A39 HydrophobicContact CE3-CB 4.23Å; W35-A39 HydrophobicContact CZ3-CB 4.26Å; W35-A39 WeakPolarHBondContact O-CB 3.39Å; W35-A39 PolarHBondContact O-N 3.08Å; Q36-A39 WeakPolarHBondContact O-CB 3.33Å; Q36-A39 PolarHBondContact O-N 2.96Å; A39-A41 VanDerWaalsContact C-N 3.34Å; A39-A41 PolarHBondContact O-N 2.83Å; A39-L42 PolarHBondContact O-N 2.89Å; A39-A43 PolarHBondContact O-N 3.24Å; A39-L60 HydrophobicContact CB-CD2 4.18Å; A39-T82 HydrophobicContact CB-CG2 3.91Å; A39-T82 WeakPolarHBondContact O-CG2 3.38Å
40	E	86.2	Confident	81.8	Confident	105 Å²	105	56.8 Å²	56.8	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-61.8	-42.5	178.1	-172.1	174.8	-165.4	0	0	111.5	Q36 L42 A43 Q44	Q36-E40 WeakPolarHBondContact O-CB 3.44Å; Q36-E40 PolarHBondContact O-N 2.7Å; E40-L42 VanDerWaalsContact C-N 3.3Å; E40-L42 PolarHBondContact O-N 2.84Å; E40-A43 PolarHBondContact O-N 3.15Å; E40-Q44 HydrophobicContact CG-CG 4.19Å; E40-Q44 VanDerWaalsContact CG-NE2 3.3Å; E40-Q44 WeakPolarHBondContact O-CB 3.46Å; E40-Q44 PolarHBondContact O-N 3Å; E40-Q44 PolarHBondContact OE1-NE2 3.29Å
41	A	86.2	Confident	82	Confident	9 Å²	9	54.6 Å²	54.6	7%	0.074	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-39	176.4	0	0	0	0	0	113	M1 V37 C38 A39 R45 T46 Y47	M1-A41 HydrophobicContact CE-CB 3.88Å; V37-A41 VanDerWaalsContact O-CB 3.22Å; V37-A41 WeakPolarHBondContact O-CB 3.38Å; V37-A41 PolarHBondContact O-N 3.04Å; C38-A41 PolarHBondContact O-N 3.09Å; A39-A41 VanDerWaalsContact C-N 3.34Å; A39-A41 PolarHBondContact O-N 2.83Å; A41-R45 PolarHBondContact O-N 2.9Å; A41-T46 PolarHBondContact O-N 3.01Å; A41-T46 VanDerWaalsContact O-N 3.14Å; A41-Y47 HydrophobicContact CB-CD2 3.89Å; A41-Y47 HydrophobicContact CB-CE2 3.73Å
42	L	86.3	Confident	82.2	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-71.4	-44.3	176	-73	170	0	0	0	111.8	C38 A39 E40 K53 C56 F57 L60 T82	C38-L42 WeakPolarHBondContact O-CG 3.47Å; C38-L42 PolarHBondContact O-N 3.01Å; C38-L42 VanDerWaalsContact O-N 3.1Å; A39-L42 PolarHBondContact O-N 2.89Å; E40-L42 VanDerWaalsContact C-N 3.3Å; E40-L42 PolarHBondContact O-N 2.84Å; L42-K53 HydrophobicContact CD2-CB 4.31Å; L42-C56 HydrophobicContact CD1-CB 3.73Å; L42-C56 HydrophobicContact CD2-CB 4.05Å; L42-C56 HydrophobicContact CG-CB 3.73Å; L42-F57 HydrophobicContact CD1-CD1 3.92Å; L42-F57 HydrophobicContact CD1-CD2 4.26Å; L42-F57 HydrophobicContact CD1-CE1 3.9Å; L42-F57 HydrophobicContact CD1-CE2 4.25Å; L42-F57 HydrophobicContact CD1-CG 4.09Å; L42-F57 HydrophobicContact CD1-CZ 4.07Å; L42-F57 HydrophobicContact CD2-CD2 3.98Å; L42-F57 HydrophobicContact CD2-CE2 3.63Å; L42-F57 HydrophobicContact CD2-CZ 4Å; L42-L60 HydrophobicContact CD1-CD1 3.56Å; L42-T82 HydrophobicContact CB-CG2 4.38Å
43	A	83.7	Confident	82.9	Confident	26 Å²	26	49.9 Å²	49.9	22%	0.215	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-42.7	-179.8	0	0	0	0	0	112.7	A39 E40 T82	A39-A43 PolarHBondContact O-N 3.24Å; E40-A43 PolarHBondContact O-N 3.15Å; A43-T82 HydrophobicContact CB-CG2 4.25Å
44	Q	81.3	Confident	83.3	Confident	125 Å²	125	48.8 Å²	48.8	58%	0.584	25%	0.254	S	S	*	.	H	α-helix	trans	-86.8	-5.6	-177.4	-65.8	-179.8	6.8	0	0	113.8	E40 T46	E40-Q44 HydrophobicContact CG-CG 4.19Å; E40-Q44 VanDerWaalsContact CG-NE2 3.3Å; E40-Q44 WeakPolarHBondContact O-CB 3.46Å; E40-Q44 PolarHBondContact O-N 3Å; E40-Q44 PolarHBondContact OE1-NE2 3.29Å; Q44-T46 VanDerWaalsContact C-N 3.27Å; Q44-T46 PolarHBondContact O-N 3.14Å
45	R	75.2	Confident	83.7	Confident	98 Å²	98	48.8 Å²	48.8	37%	0.37	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	40.7	-175.2	-59.4	179.1	153.9	-179.7	-11.7	113.2	A41 Y47 A89 Q90	A41-R45 PolarHBondContact O-N 2.9Å; R45-Y47 PolarHBondContact O-N 3.03Å; R45-A89 VanDerWaalsContact CZ-O 3.24Å; R45-A89 PolarHBondContact NH1-O 3.36Å; R45-A89 PolarHBondContact NH2-O 3.47Å; R45-Q90 VanDerWaalsContact NH2-N 3.15Å
46	T	74.6	Confident	83.9	Confident	78 Å²	78	48.8 Å²	48.8	48%	0.479	25%	0.253	S	S	.	.			trans	-62.6	-29.1	-174.4	-45.9	0	0	0	0	112.5	A41 Q44	A41-T46 PolarHBondContact O-N 3.01Å; A41-T46 VanDerWaalsContact O-N 3.14Å; Q44-T46 VanDerWaalsContact C-N 3.27Å; Q44-T46 PolarHBondContact O-N 3.14Å
47	Y	78.3	Confident	84.1	Confident	50 Å²	50	45.9 Å²	45.9	20%	0.196	24%	0.239	C	C	.	.			trans	-117.7	131.5	-177	-56.5	-87.7	0	0	0	111.5	M1 L6 A41 R45 V52 K53	M1-Y47 HydrophobicContact CE-CD2 3.65Å; M1-Y47 HydrophobicContact CE-CE1 4.44Å; M1-Y47 HydrophobicContact CE-CE2 3.13Å; L6-Y47 HydrophobicContact CD1-CD1 4.48Å; L6-Y47 HydrophobicContact CD1-CE1 3.94Å; A41-Y47 HydrophobicContact CB-CD2 3.89Å; A41-Y47 HydrophobicContact CB-CE2 3.73Å; R45-Y47 PolarHBondContact O-N 3.03Å; Y47-V52 HydrophobicContact CD1-CG1 4.16Å; Y47-V52 HydrophobicContact CD2-CG1 4.08Å; Y47-V52 HydrophobicContact CG-CG1 3.81Å; Y47-K53 VanDerWaalsContact O-CE 3.29Å; Y47-K53 WeakPolarHBondContact O-CE 3.5Å
48	S	73.6	Confident	84.4	Confident	112 Å²	112	45.8 Å²	45.8	78%	0.783	23%	0.234	S	C	*	.			trans	-83.5	-17.3	171.6	57.3	0	0	0	0	113.2	D50	S48-D50 PolarHBondContact O-N 3.24Å
49	D	82.6	Confident	84.6	Confident	61 Å²	61	45.9 Å²	45.9	33%	0.326	24%	0.235	S	C	.	.			trans	-72.7	123.5	-178.3	-169	-54.6	0	0	0	111.7	H51 V52 K53	D49-H51 PolarHBondContact O-N 3.44Å; D49-H51 WeakPolarHBondContact OD1-CB 3.43Å; D49-H51 IonicContact OD1-CG 3.15Å; D49-H51 PolarHBondContact OD1-N 3.44Å; D49-H51 IonicContact OD1-ND1 2.7Å; D49-H51 PolarHBondContact OD1-ND1 3.33Å; D49-V52 HydrophobicContact CB-CB 4.21Å; D49-V52 HydrophobicContact CB-CG2 3.81Å; D49-V52 PolarHBondContact O-N 2.87Å; D49-V52 PolarHBondContact OD1-N 2.93Å; D49-K53 WeakPolarHBondContact O-CG 3.23Å; D49-K53 PolarHBondContact O-N 2.98Å
50	D	85.3	Confident	84.8	Confident	39 Å²	39	45.9 Å²	45.9	21%	0.209	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-31.4	-175.8	-70.1	-23	0	0	0	113.5	S48 K53 F54 K98 F100 I101	S48-D50 PolarHBondContact O-N 3.24Å; D50-K53 PolarHBondContact O-N 3.34Å; D50-K53 IonicContact OD1-NZ 2.94Å; D50-K53 PolarHBondContact OD1-NZ 2.71Å; D50-F54 PolarHBondContact O-N 3.1Å; D50-K98 VanDerWaalsContact OD2-CG 3.23Å; D50-K98 WeakPolarHBondContact OD2-CG 3.49Å; D50-F100 HydrophobicContact CB-CE2 4.42Å; D50-F100 HydrophobicContact CB-CZ 3.76Å; D50-I101 HydrophobicContact CB-CD1 3.71Å
51	H	85.1	Confident	85	Confident	77 Å²	77	42.8 Å²	42.8	36%	0.356	22%	0.22	S	C	.	.	H	α-helix	trans	-72.8	-35.9	177.5	-56.9	88.5	0	0	0	111.1	L9 D49 F54 F55	L9-H51 HydrophobicContact CB-CB 3.97Å; D49-H51 PolarHBondContact O-N 3.44Å; D49-H51 WeakPolarHBondContact OD1-CB 3.43Å; D49-H51 IonicContact OD1-CG 3.15Å; D49-H51 PolarHBondContact OD1-N 3.44Å; D49-H51 IonicContact OD1-ND1 2.7Å; D49-H51 PolarHBondContact OD1-ND1 3.33Å; H51-F54 PolarHBondContact O-N 2.89Å; H51-F55 VanDerWaalsContact O-CB 3.25Å; H51-F55 WeakPolarHBondContact O-CB 3.28Å; H51-F55 PolarHBondContact O-N 3.46Å
52	V	85.8	Confident	85.2	Confident	5 Å²	5	44.3 Å²	44.3	3%	0.03	23%	0.226	C	C	.	.	H	α-helix	trans	-65.8	-42.7	174.6	-179.1	0	0	0	0	110.5	M1 L6 L9 Y47 D49 F55 C56	M1-V52 HydrophobicContact CE-CG1 3.8Å; L6-V52 HydrophobicContact CB-CG2 4.21Å; L6-V52 HydrophobicContact CD1-CG1 3.95Å; L6-V52 HydrophobicContact CD1-CG2 4.32Å; L6-V52 HydrophobicContact CD2-CG1 4.11Å; L6-V52 HydrophobicContact CD2-CG2 4.23Å; L6-V52 HydrophobicContact CG-CG2 4.48Å; L9-V52 HydrophobicContact CD1-CG2 4.16Å; Y47-V52 HydrophobicContact CD1-CG1 4.16Å; Y47-V52 HydrophobicContact CD2-CG1 4.08Å; Y47-V52 HydrophobicContact CG-CG1 3.81Å; D49-V52 HydrophobicContact CB-CB 4.21Å; D49-V52 HydrophobicContact CB-CG2 3.81Å; D49-V52 PolarHBondContact O-N 2.87Å; D49-V52 PolarHBondContact OD1-N 2.93Å; V52-F55 WeakPolarHBondContact O-CB 3.5Å; V52-F55 PolarHBondContact O-N 2.94Å; V52-C56 PolarHBondContact O-N 2.7Å; V52-C56 PolarHBondContact O-SG 3.4Å
53	K	87.6	Confident	85.4	Confident	32 Å²	32	44.3 Å²	44.3	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-60.4	-46.5	174.6	-65.3	171.6	-165.9	164.2	0	111.6	L42 Y47 D49 D50 F55 C56 F57 E97 I101	L42-K53 HydrophobicContact CD2-CB 4.31Å; Y47-K53 VanDerWaalsContact O-CE 3.29Å; Y47-K53 WeakPolarHBondContact O-CE 3.5Å; D49-K53 WeakPolarHBondContact O-CG 3.23Å; D49-K53 PolarHBondContact O-N 2.98Å; D50-K53 PolarHBondContact O-N 3.34Å; D50-K53 IonicContact OD1-NZ 2.94Å; D50-K53 PolarHBondContact OD1-NZ 2.71Å; K53-F55 VanDerWaalsContact C-N 3.33Å; K53-F55 PolarHBondContact O-N 3.01Å; K53-C56 WeakPolarHBondContact O-CB 3.38Å; K53-C56 PolarHBondContact O-N 3.25Å; K53-F57 VanDerWaalsContact O-CD2 3.32Å; K53-F57 WeakPolarHBondContact O-CD2 3.42Å; K53-F57 PolarHBondContact O-N 3.41Å; K53-E97 VanDerWaalsContact NZ-CD 3.31Å; K53-E97 IonicContact NZ-OE1 3.01Å; K53-E97 PolarHBondContact NZ-OE1 3.31Å; K53-E97 IonicContact NZ-OE2 3.29Å; K53-E97 PolarHBondContact NZ-OE2 2.94Å; K53-I101 HydrophobicContact CB-CD1 4.16Å; K53-I101 HydrophobicContact CD-CD1 3.95Å
54	F	88.7	Confident	85.6	Confident	63 Å²	63	43.3 Å²	43.3	28%	0.276	22%	0.217	S	C	.	.	H	α-helix	trans	-59.9	-44.8	177.4	-178.1	-92.3	0	0	0	111.6	D50 H51 C56 F57 Q58 F100 K104	D50-F54 PolarHBondContact O-N 3.1Å; H51-F54 PolarHBondContact O-N 2.89Å; F54-C56 VanDerWaalsContact C-N 3.35Å; F54-C56 PolarHBondContact O-N 2.86Å; F54-F57 PolarHBondContact O-N 3.35Å; F54-Q58 PolarHBondContact O-N 3.41Å; F54-F100 HydrophobicContact CB-CD2 4.21Å; F54-F100 HydrophobicContact CB-CE2 3.99Å; F54-F100 AromaticContact CD2-CD2 3.64Å; F54-F100 HydrophobicContact CD2-CD2 3.64Å; F54-F100 HydrophobicContact CD2-CE2 4.28Å; F54-F100 HydrophobicContact CE2-CD2 4.28Å; F54-F100 HydrophobicContact CG-CD2 4.13Å; F54-F100 HydrophobicContact CG-CE2 4.35Å; F54-K104 HydrophobicContact CD2-CB 3.76Å; F54-K104 HydrophobicContact CD2-CG 3.87Å; F54-K104 HydrophobicContact CE2-CB 3.66Å; F54-K104 HydrophobicContact CE2-CD 3.85Å; F54-K104 HydrophobicContact CE2-CG 3.67Å; F54-K104 HydrophobicContact CZ-CD 4.1Å; F54-K104 HydrophobicContact CZ-CG 4.27Å
55	F	87.8	Confident	85.9	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.035	21%	0.212	C	C	.	.	H	α-helix	trans	-58	-44.3	175	179.8	-88.6	0	0	0	112.2	L9 Y24 F25 L28 H51 V52 K53 F57 Q58 V59	L9-F55 HydrophobicContact CD1-CB 3.99Å; L9-F55 HydrophobicContact CD1-CD2 4.08Å; L9-F55 HydrophobicContact CD1-CG 4.06Å; L9-F55 HydrophobicContact CD2-CD2 4.04Å; Y24-F55 HydrophobicContact CD1-CZ 4.38Å; F25-F55 HydrophobicContact CB-CE2 3.53Å; F25-F55 HydrophobicContact CB-CZ 3.83Å; F25-F55 AromaticContact CD2-CD2 3.82Å; F25-F55 HydrophobicContact CD2-CD2 3.82Å; F25-F55 HydrophobicContact CD2-CE1 4.3Å; F25-F55 AromaticContact CD2-CE2 3.23Å; F25-F55 HydrophobicContact CD2-CE2 3.23Å; F25-F55 AromaticContact CD2-CZ 3.51Å; F25-F55 HydrophobicContact CD2-CZ 3.51Å; F25-F55 HydrophobicContact CE2-CD2 4.3Å; F25-F55 HydrophobicContact CE2-CE2 4.14Å; F25-F55 HydrophobicContact CG-CD2 4.4Å; F25-F55 AromaticContact CG-CE2 3.61Å; F25-F55 HydrophobicContact CG-CE2 3.61Å; F25-F55 HydrophobicContact CG-CZ 4.08Å; L28-F55 HydrophobicContact CD1-CE1 3.44Å; L28-F55 VanDerWaalsContact CD1-CE1 3.44Å; L28-F55 HydrophobicContact CD1-CZ 3.78Å; H51-F55 VanDerWaalsContact O-CB 3.25Å; H51-F55 WeakPolarHBondContact O-CB 3.28Å; H51-F55 PolarHBondContact O-N 3.46Å; V52-F55 WeakPolarHBondContact O-CB 3.5Å; V52-F55 PolarHBondContact O-N 2.94Å; K53-F55 VanDerWaalsContact C-N 3.33Å; K53-F55 PolarHBondContact O-N 3.01Å; F55-F57 VanDerWaalsContact C-N 3.35Å; F55-F57 PolarHBondContact O-N 2.81Å; F55-Q58 WeakPolarHBondContact O-CB 3.39Å; F55-Q58 PolarHBondContact O-N 3.49Å; F55-Q58 VanDerWaalsContact O-N 3.11Å; F55-V59 HydrophobicContact CD1-CG2 4.31Å; F55-V59 HydrophobicContact CE1-CG2 4.08Å; F55-V59 WeakPolarHBondContact O-CG2 3.46Å; F55-V59 PolarHBondContact O-N 3.43Å
56	C	89.4	Confident	86.4	Confident	2 Å²	2	45 Å²	45	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-42.8	175.2	-69.9	0	0	0	0	112.2	M1 C38 L42 V52 K53 F54 Q58 V59 L60	M1-C56 VanDerWaalsContact CE-SG 3.54Å; C38-C56 HydrophobicContact CB-CB 3.83Å; L42-C56 HydrophobicContact CD1-CB 3.73Å; L42-C56 HydrophobicContact CD2-CB 4.05Å; L42-C56 HydrophobicContact CG-CB 3.73Å; V52-C56 PolarHBondContact O-N 2.7Å; V52-C56 PolarHBondContact O-SG 3.4Å; K53-C56 WeakPolarHBondContact O-CB 3.38Å; K53-C56 PolarHBondContact O-N 3.25Å; F54-C56 VanDerWaalsContact C-N 3.35Å; F54-C56 PolarHBondContact O-N 2.86Å; C56-Q58 VanDerWaalsContact C-N 3.31Å; C56-Q58 PolarHBondContact O-N 3.17Å; C56-V59 PolarHBondContact O-N 2.83Å; C56-L60 WeakPolarHBondContact O-CG 3.33Å; C56-L60 PolarHBondContact O-N 2.91Å
57	F	91.8	Very high	86.9	Confident	1 Å²	1	43.3 Å²	43.3	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-35.1	174	-79.6	-66	0	0	0	112.5	L42 K53 F54 F55 L60 E61 L83 W86 I101 K104 A105 V108	L42-F57 HydrophobicContact CD1-CD1 3.92Å; L42-F57 HydrophobicContact CD1-CD2 4.26Å; L42-F57 HydrophobicContact CD1-CE1 3.9Å; L42-F57 HydrophobicContact CD1-CE2 4.25Å; L42-F57 HydrophobicContact CD1-CG 4.09Å; L42-F57 HydrophobicContact CD1-CZ 4.07Å; L42-F57 HydrophobicContact CD2-CD2 3.98Å; L42-F57 HydrophobicContact CD2-CE2 3.63Å; L42-F57 HydrophobicContact CD2-CZ 4Å; K53-F57 VanDerWaalsContact O-CD2 3.32Å; K53-F57 WeakPolarHBondContact O-CD2 3.42Å; K53-F57 PolarHBondContact O-N 3.41Å; F54-F57 PolarHBondContact O-N 3.35Å; F55-F57 VanDerWaalsContact C-N 3.35Å; F55-F57 PolarHBondContact O-N 2.81Å; F57-L60 PolarHBondContact O-N 3.46Å; F57-E61 WeakPolarHBondContact O-CB 3.22Å; F57-E61 PolarHBondContact O-N 3.02Å; F57-L83 HydrophobicContact CE1-CD2 3.94Å; F57-W86 AromaticContact CE2-CE2 3.98Å; F57-W86 AromaticContact CE2-CZ2 4Å; F57-W86 HydrophobicContact CE2-CZ2 4Å; F57-W86 AromaticContact CZ-CD2 3.8Å; F57-W86 HydrophobicContact CZ-CD2 3.8Å; F57-W86 AromaticContact CZ-CE2 3.65Å; F57-W86 HydrophobicContact CZ-CE3 4.17Å; F57-W86 HydrophobicContact CZ-CG 4.24Å; F57-W86 HydrophobicContact CZ-CH2 4.28Å; F57-W86 AromaticContact CZ-CZ2 3.93Å; F57-W86 HydrophobicContact CZ-CZ2 3.93Å; F57-W86 HydrophobicContact CZ-CZ3 4.37Å; F57-W86 AromaticContact CZ-NE1 3.95Å; F57-I101 HydrophobicContact CD2-CG2 4.18Å; F57-I101 HydrophobicContact CE2-CG2 3.85Å; F57-K104 HydrophobicContact CB-CB 4.39Å; F57-K104 HydrophobicContact CB-CG 3.71Å; F57-A105 HydrophobicContact CD1-CB 4.33Å; F57-A105 HydrophobicContact CE1-CB 3.78Å; F57-A105 HydrophobicContact CE2-CB 4.11Å; F57-A105 HydrophobicContact CZ-CB 3.66Å; F57-V108 HydrophobicContact CB-CG2 4.44Å; F57-V108 HydrophobicContact CD1-CG2 4.18Å
58	Q	90	Very high	87.2	Confident	63 Å²	63	41.6 Å²	41.6	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-67.6	-35.6	177.5	-150	-177.9	-2.7	0	0	112.4	F25 F54 F55 C56 H62	F25-Q58 HydrophobicContact CE2-CB 4.14Å; F25-Q58 HydrophobicContact CE2-CG 4.28Å; F25-Q58 HydrophobicContact CZ-CB 4.09Å; F25-Q58 VanDerWaalsContact CZ-CD 3.43Å; F25-Q58 HydrophobicContact CZ-CG 3.72Å; F54-Q58 PolarHBondContact O-N 3.41Å; F55-Q58 WeakPolarHBondContact O-CB 3.39Å; F55-Q58 PolarHBondContact O-N 3.49Å; F55-Q58 VanDerWaalsContact O-N 3.11Å; C56-Q58 VanDerWaalsContact C-N 3.31Å; C56-Q58 PolarHBondContact O-N 3.17Å; Q58-H62 PolarHBondContact O-N 2.87Å; Q58-H62 VanDerWaalsContact O-N 3.11Å
59	V	89.8	Confident	87.7	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-44.4	171.2	175.6	0	0	0	0	110.7	F25 L28 W35 C38 F55 C56 H62 Q63	F25-V59 HydrophobicContact CD2-CG2 3.98Å; F25-V59 HydrophobicContact CE2-CG2 3.77Å; L28-V59 HydrophobicContact CB-CG2 4.3Å; L28-V59 HydrophobicContact CD1-CG2 4.43Å; W35-V59 HydrophobicContact CB-CG1 3.97Å; C38-V59 HydrophobicContact CB-CB 4.45Å; C38-V59 HydrophobicContact CB-CG1 4.48Å; F55-V59 HydrophobicContact CD1-CG2 4.31Å; F55-V59 HydrophobicContact CE1-CG2 4.08Å; F55-V59 WeakPolarHBondContact O-CG2 3.46Å; F55-V59 PolarHBondContact O-N 3.43Å; C56-V59 PolarHBondContact O-N 2.83Å; V59-H62 PolarHBondContact O-N 3.36Å; V59-Q63 PolarHBondContact O-N 3.33Å
60	L	90.8	Very high	87.8	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-43.5	176.7	-72	179	0	0	0	112.4	W35 A39 L42 C56 F57 H62 Q63 V64 V108	W35-L60 HydrophobicContact CB-CD2 4.37Å; W35-L60 HydrophobicContact CE3-CD2 3.87Å; A39-L60 HydrophobicContact CB-CD2 4.18Å; L42-L60 HydrophobicContact CD1-CD1 3.56Å; C56-L60 WeakPolarHBondContact O-CG 3.33Å; C56-L60 PolarHBondContact O-N 2.91Å; F57-L60 PolarHBondContact O-N 3.46Å; L60-H62 PolarHBondContact O-N 3.1Å; L60-Q63 PolarHBondContact O-N 3.5Å; L60-V64 VanDerWaalsContact O-CG2 3.32Å; L60-V64 WeakPolarHBondContact O-CG2 3.46Å; L60-V64 PolarHBondContact O-N 3.26Å; L60-V108 HydrophobicContact CB-CG1 4.31Å
61	E	91.9	Very high	87.8	Confident	39 Å²	39	44.2 Å²	44.2	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-54.8	-51.6	174.4	-179.8	-164.7	-156.2	0	0	111.3	F57 Q63 V64 K65 K104 V108 L111	F57-E61 WeakPolarHBondContact O-CB 3.22Å; F57-E61 PolarHBondContact O-N 3.02Å; E61-Q63 VanDerWaalsContact C-N 3.28Å; E61-Q63 PolarHBondContact O-N 3.33Å; E61-V64 PolarHBondContact O-N 3.08Å; E61-K65 VanDerWaalsContact O-CB 3.32Å; E61-K65 WeakPolarHBondContact O-CB 3.34Å; E61-K65 PolarHBondContact O-N 3.2Å; E61-K104 IonicContact OE1-NZ 2.79Å; E61-K104 PolarHBondContact OE1-NZ 3.46Å; E61-K104 WeakPolarHBondContact OE2-CE 3.47Å; E61-K104 IonicContact OE2-NZ 3.36Å; E61-K104 PolarHBondContact OE2-NZ 2.92Å; E61-V108 HydrophobicContact CB-CG2 3.9Å; E61-L111 HydrophobicContact CG-CD1 3.62Å
62	H	89.4	Confident	87.9	Confident	41 Å²	41	44.2 Å²	44.2	19%	0.19	22%	0.216	C	C	.	.	H	α-helix	trans	-58.8	-41.8	178.4	179.7	-85.3	0	0	0	111.5	K29 Q58 V59 L60 K65 Y66	K29-H62 HydrophobicContact CG-CB 4.37Å; Q58-H62 PolarHBondContact O-N 2.87Å; Q58-H62 VanDerWaalsContact O-N 3.11Å; V59-H62 PolarHBondContact O-N 3.36Å; L60-H62 PolarHBondContact O-N 3.1Å; H62-K65 PolarHBondContact O-N 2.95Å; H62-Y66 AromaticContact CD2-CD2 3.48Å; H62-Y66 VanDerWaalsContact CD2-CD2 3.48Å; H62-Y66 WeakPolarHBondContact CD2-CD2 3.41Å; H62-Y66 AromaticContact CD2-CE2 3.79Å; H62-Y66 AromaticContact CG-CD2 3.97Å; H62-Y66 AromaticContact NE2-CD2 3.69Å; H62-Y66 WeakPolarHBondContact O-CD2 3.1Å; H62-Y66 PolarHBondContact O-N 3.22Å
63	Q	89.9	Confident	87.9	Confident	7 Å²	7	48.6 Å²	48.6	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-63.8	-44.4	177.8	-169.9	64.6	21	0	0	112	W35 V59 L60 E61 K67 Y68 L71	W35-Q63 HydrophobicContact CB-CB 4.27Å; W35-Q63 HydrophobicContact CB-CG 4.23Å; W35-Q63 HydrophobicContact CD2-CG 4.23Å; W35-Q63 HydrophobicContact CG-CB 4.37Å; W35-Q63 HydrophobicContact CG-CG 3.8Å; V59-Q63 PolarHBondContact O-N 3.33Å; L60-Q63 PolarHBondContact O-N 3.5Å; E61-Q63 VanDerWaalsContact C-N 3.28Å; E61-Q63 PolarHBondContact O-N 3.33Å; Q63-K67 VanDerWaalsContact NE2-CB 3.33Å; Q63-K67 CarbonylContact O-C 3.6Å; Q63-K67 PolarHBondContact O-N 3.04Å; Q63-K67 VanDerWaalsContact O-N 3.09Å; Q63-Y68 PolarHBondContact O-N 3.44Å; Q63-L71 HydrophobicContact CG-CD1 4.12Å
64	V	89.8	Confident	87.9	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.03	27%	0.268	C	S	.	.	H	α-helix	trans	-68.4	-35.3	178.9	177.2	0	0	0	0	111.7	L60 E61 Y68 I79 L111	L60-V64 VanDerWaalsContact O-CG2 3.32Å; L60-V64 WeakPolarHBondContact O-CG2 3.46Å; L60-V64 PolarHBondContact O-N 3.26Å; E61-V64 PolarHBondContact O-N 3.08Å; V64-Y68 HydrophobicContact CB-CD2 4.26Å; V64-Y68 HydrophobicContact CG1-CD2 4.16Å; V64-Y68 HydrophobicContact CG2-CD2 4.08Å; V64-Y68 HydrophobicContact CG2-CE2 4.33Å; V64-Y68 VanDerWaalsContact O-CB 3.25Å; V64-Y68 WeakPolarHBondContact O-CB 3.33Å; V64-I79 HydrophobicContact CG2-CD1 4.46Å; V64-I79 HydrophobicContact CG2-CG2 4.38Å; V64-L111 HydrophobicContact CG1-CB 3.78Å
65	K	87.5	Confident	87.9	Confident	113 Å²	113	51 Å²	51	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-76.6	-42.7	-177.4	-169.3	166.5	-176.1	165.6	0	113.5	E61 H62	E61-K65 VanDerWaalsContact O-CB 3.32Å; E61-K65 WeakPolarHBondContact O-CB 3.34Å; E61-K65 PolarHBondContact O-N 3.2Å; H62-K65 PolarHBondContact O-N 2.95Å
66	Y	85.6	Confident	87.9	Confident	144 Å²	144	51.1 Å²	51.1	57%	0.565	26%	0.263	S	S	*	.	H	α-helix	trans	-112.1	-28.1	-168.2	-60.6	-71.9	0	0	0	115	H62	H62-Y66 AromaticContact CD2-CD2 3.48Å; H62-Y66 VanDerWaalsContact CD2-CD2 3.48Å; H62-Y66 WeakPolarHBondContact CD2-CD2 3.41Å; H62-Y66 AromaticContact CD2-CE2 3.79Å; H62-Y66 AromaticContact CG-CD2 3.97Å; H62-Y66 AromaticContact NE2-CD2 3.69Å; H62-Y66 WeakPolarHBondContact O-CD2 3.1Å; H62-Y66 PolarHBondContact O-N 3.22Å
67	K	84.6	Confident	87.9	Confident	43 Å²	43	55.2 Å²	55.2	19%	0.187	28%	0.282	C	S	.	.	S	Bend	trans	-124.6	14.4	-169.5	-67.1	-176.5	174.2	178.3	0	113.7	K29 I30 Q63 S69 E70	K29-K67 PolarHBondContact O-NZ 3.29Å; I30-K67 PolarHBondContact O-NZ 3.15Å; Q63-K67 VanDerWaalsContact NE2-CB 3.33Å; Q63-K67 CarbonylContact O-C 3.6Å; Q63-K67 PolarHBondContact O-N 3.04Å; Q63-K67 VanDerWaalsContact O-N 3.09Å; K67-S69 PolarHBondContact O-N 3.45Å; K67-E70 WeakPolarHBondContact O-CB 3.17Å; K67-E70 PolarHBondContact O-N 3.16Å
68	Y	84.9	Confident	87.8	Confident	14 Å²	14	58.3 Å²	58.3	6%	0.055	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-69.6	-32.8	-173.2	-165.9	-95.3	0	0	0	113.9	Q63 V64 E70 L71 Q76 I79 L112 T115 E116	Q63-Y68 PolarHBondContact O-N 3.44Å; V64-Y68 HydrophobicContact CB-CD2 4.26Å; V64-Y68 HydrophobicContact CG1-CD2 4.16Å; V64-Y68 HydrophobicContact CG2-CD2 4.08Å; V64-Y68 HydrophobicContact CG2-CE2 4.33Å; V64-Y68 VanDerWaalsContact O-CB 3.25Å; V64-Y68 WeakPolarHBondContact O-CB 3.33Å; Y68-E70 PolarHBondContact O-N 3.41Å; Y68-L71 HydrophobicContact CD2-CD1 4.05Å; Y68-L71 HydrophobicContact CE2-CD1 4.42Å; Y68-L71 WeakPolarHBondContact O-CB 3.22Å; Y68-L71 PolarHBondContact O-N 3.33Å; Y68-Q76 HydrophobicContact CE1-CG 3.97Å; Y68-Q76 HydrophobicContact CE2-CG 4.14Å; Y68-Q76 PolarHBondContact O-NE2 3.08Å; Y68-I79 HydrophobicContact CD2-CD1 4.48Å; Y68-I79 HydrophobicContact CE2-CD1 4.15Å; Y68-L112 HydrophobicContact CE2-CD1 3.66Å; Y68-L112 VanDerWaalsContact OH-CD1 3.28Å; Y68-L112 WeakPolarHBondContact OH-CD1 3.25Å; Y68-T115 HydrophobicContact CD1-CG2 3.38Å; Y68-T115 HydrophobicContact CE1-CG2 3.54Å; Y68-T115 HydrophobicContact CG-CG2 4.19Å; Y68-E116 HydrophobicContact CE1-CG 4.06Å; Y68-E116 VanDerWaalsContact OH-CG 3.31Å; Y68-E116 WeakPolarHBondContact OH-CG 3.35Å; Y68-E116 PolarHBondContact OH-OE1 3.08Å; Y68-E116 PolarHBondContact OH-OE2 3.06Å
69	S	82.4	Confident	87.8	Confident	108 Å²	108	55.3 Å²	55.3	76%	0.755	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-67.3	-24.1	175.4	51.2	0	0	0	0	113	K67 L71	K67-S69 PolarHBondContact O-N 3.45Å; S69-L71 VanDerWaalsContact C-N 3.33Å
70	E	85.7	Confident	87.8	Confident	145 Å²	145	57.4 Å²	57.4	68%	0.678	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-80.5	-15.9	178.2	-56.2	179.3	173.1	0	0	112.4	K67 Y68	K67-E70 WeakPolarHBondContact O-CB 3.17Å; K67-E70 PolarHBondContact O-N 3.16Å; Y68-E70 PolarHBondContact O-N 3.41Å
71	L	85.9	Confident	87.8	Confident	15 Å²	15	62.3 Å²	62.3	8%	0.079	32%	0.315	C	S	.	.	S	Bend	trans	-76.3	142.3	-178.5	-65.5	-179.9	0	0	0	112.5	W35 Q63 Y68 S69 Q75 Q76 I79	W35-L71 HydrophobicContact CZ2-CD1 4.35Å; W35-L71 HydrophobicContact CZ2-CD2 3.82Å; Q63-L71 HydrophobicContact CG-CD1 4.12Å; Y68-L71 HydrophobicContact CD2-CD1 4.05Å; Y68-L71 HydrophobicContact CE2-CD1 4.42Å; Y68-L71 WeakPolarHBondContact O-CB 3.22Å; Y68-L71 PolarHBondContact O-N 3.33Å; S69-L71 VanDerWaalsContact C-N 3.33Å; L71-Q75 HydrophobicContact CB-CB 4.19Å; L71-Q75 HydrophobicContact CD2-CB 4.23Å; L71-Q76 HydrophobicContact CB-CG 3.79Å; L71-Q76 HydrophobicContact CD1-CG 4.46Å; L71-Q76 PolarHBondContact O-NE2 3.03Å; L71-I79 HydrophobicContact CD1-CD1 3.52Å
72	T	87.4	Confident	87.7	Confident	77 Å²	77	60.8 Å²	60.8	47%	0.472	31%	0.308	S	S	.	.			trans	-68.6	157.3	170.7	62.9	0	0	0	0	111.6	V74 Q75 Q76	T72-V74 PolarHBondContact O-N 3.42Å; T72-Q75 WeakPolarHBondContact O-CB 3.46Å; T72-Q75 PolarHBondContact O-N 3.11Å; T72-Q75 WeakPolarHBondContact OG1-CB 3.42Å; T72-Q75 VanDerWaalsContact OG1-CG 3.3Å; T72-Q75 WeakPolarHBondContact OG1-CG 3.47Å; T72-Q75 PolarHBondContact OG1-N 3.23Å; T72-Q75 PolarHBondContact OG1-OE1 3.02Å; T72-Q76 WeakPolarHBondContact O-CG 3.25Å; T72-Q76 PolarHBondContact O-N 3.05Å
73	T	85.6	Confident	87.8	Confident	96 Å²	96	58.9 Å²	58.9	59%	0.589	30%	0.299	S	S	*	.	H	α-helix	trans	-56	-35.1	177.8	-45.8	0	0	0	0	112.8	Q77	T73-Q77 WeakPolarHBondContact O-CB 3.25Å; T73-Q77 PolarHBondContact O-N 3.27Å
74	V	87.5	Confident	87.9	Confident	112 Å²	112	60 Å²	60	68%	0.679	31%	0.305	S	S	*	.	H	α-helix	trans	-68.1	-43	177.2	-179.3	0	0	0	0	110.9	T72 Q77 L78	T72-V74 PolarHBondContact O-N 3.42Å; V74-Q77 PolarHBondContact O-N 3.13Å; V74-L78 PolarHBondContact O-N 2.88Å
75	Q	87.8	Confident	87.9	Confident	35 Å²	35	61.9 Å²	61.9	16%	0.164	32%	0.319	C	S	.	.	H	α-helix	trans	-65.6	-40.8	176.4	-77.2	169.1	-38.9	0	0	112.2	W35 L71 T72 Q77 L78 I79	W35-Q75 HydrophobicContact CH2-CB 3.91Å; W35-Q75 HydrophobicContact CH2-CG 4.25Å; W35-Q75 WeakPolarHBondContact CH2-O 3.46Å; W35-Q75 HydrophobicContact CZ2-CB 3.7Å; W35-Q75 HydrophobicContact CZ2-CG 3.81Å; L71-Q75 HydrophobicContact CB-CB 4.19Å; L71-Q75 HydrophobicContact CD2-CB 4.23Å; T72-Q75 WeakPolarHBondContact O-CB 3.46Å; T72-Q75 PolarHBondContact O-N 3.11Å; T72-Q75 WeakPolarHBondContact OG1-CB 3.42Å; T72-Q75 VanDerWaalsContact OG1-CG 3.3Å; T72-Q75 WeakPolarHBondContact OG1-CG 3.47Å; T72-Q75 PolarHBondContact OG1-N 3.23Å; T72-Q75 PolarHBondContact OG1-OE1 3.02Å; Q75-Q77 VanDerWaalsContact C-N 3.3Å; Q75-Q77 PolarHBondContact O-N 2.8Å; Q75-L78 WeakPolarHBondContact O-CB 3.34Å; Q75-L78 PolarHBondContact O-N 3.18Å; Q75-I79 PolarHBondContact O-N 3.18Å; Q75-I79 VanDerWaalsContact O-N 3.13Å
76	Q	88.8	Confident	88.1	Confident	9 Å²	9	56.7 Å²	56.7	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-62.6	-38.4	174.6	-70	166.4	-14.6	0	0	111.8	Y68 L71 T72 I79 R80	Y68-Q76 HydrophobicContact CE1-CG 3.97Å; Y68-Q76 HydrophobicContact CE2-CG 4.14Å; Y68-Q76 PolarHBondContact O-NE2 3.08Å; L71-Q76 HydrophobicContact CB-CG 3.79Å; L71-Q76 HydrophobicContact CD1-CG 4.46Å; L71-Q76 PolarHBondContact O-NE2 3.03Å; T72-Q76 WeakPolarHBondContact O-CG 3.25Å; T72-Q76 PolarHBondContact O-N 3.05Å; Q76-I79 PolarHBondContact O-N 3.24Å; Q76-R80 PolarHBondContact O-N 3.49Å
77	Q	88.4	Confident	88.3	Confident	89 Å²	89	49.9 Å²	49.9	42%	0.416	27%	0.269	S	S	.	.	H	α-helix	trans	-65.5	-40.7	172.7	-176.3	173	-15	0	0	112.2	T73 V74 Q75 I79 R80 E81	T73-Q77 WeakPolarHBondContact O-CB 3.25Å; T73-Q77 PolarHBondContact O-N 3.27Å; V74-Q77 PolarHBondContact O-N 3.13Å; Q75-Q77 VanDerWaalsContact C-N 3.3Å; Q75-Q77 PolarHBondContact O-N 2.8Å; Q77-I79 VanDerWaalsContact C-N 3.3Å; Q77-I79 PolarHBondContact O-N 2.7Å; Q77-R80 WeakPolarHBondContact O-CB 3.33Å; Q77-R80 PolarHBondContact O-N 3.32Å; Q77-R80 VanDerWaalsContact O-N 3.15Å; Q77-E81 HydrophobicContact CG-CG 4.33Å; Q77-E81 WeakPolarHBondContact CG-OE1 3.47Å; Q77-E81 PolarHBondContact NE2-OE1 2.87Å; Q77-E81 WeakPolarHBondContact O-CG 3.42Å; Q77-E81 PolarHBondContact O-N 3.4Å
78	L	90.1	Very high	88.4	Confident	65 Å²	65	52.3 Å²	52.3	34%	0.34	28%	0.281	S	S	.	.	H	α-helix	trans	-59.6	-39.1	176.9	-179.1	64.4	0	0	0	112.4	W35 Q36 V74 Q75 E81 T82	W35-L78 HydrophobicContact CH2-CD2 4.14Å; W35-L78 HydrophobicContact CZ3-CD2 4.3Å; Q36-L78 HydrophobicContact CG-CD2 4.38Å; V74-L78 PolarHBondContact O-N 2.88Å; Q75-L78 WeakPolarHBondContact O-CB 3.34Å; Q75-L78 PolarHBondContact O-N 3.18Å; L78-E81 PolarHBondContact O-N 2.94Å; L78-T82 VanDerWaalsContact O-CB 3.29Å; L78-T82 WeakPolarHBondContact O-CB 3.42Å; L78-T82 PolarHBondContact O-N 3.43Å; L78-T82 PolarHBondContact O-OG1 2.95Å
79	I	89.8	Confident	88.5	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-46.5	175.6	-65.3	173.5	0	0	0	110.4	W35 V64 Y68 L71 Q75 Q76 Q77 T82 L83 L112	W35-I79 HydrophobicContact CE3-CD1 4.17Å; W35-I79 HydrophobicContact CE3-CG1 3.89Å; W35-I79 HydrophobicContact CH2-CD1 4.05Å; W35-I79 HydrophobicContact CH2-CG1 3.7Å; W35-I79 HydrophobicContact CZ3-CD1 3.85Å; W35-I79 HydrophobicContact CZ3-CG1 3.25Å; V64-I79 HydrophobicContact CG2-CD1 4.46Å; V64-I79 HydrophobicContact CG2-CG2 4.38Å; Y68-I79 HydrophobicContact CD2-CD1 4.48Å; Y68-I79 HydrophobicContact CE2-CD1 4.15Å; L71-I79 HydrophobicContact CD1-CD1 3.52Å; Q75-I79 PolarHBondContact O-N 3.18Å; Q75-I79 VanDerWaalsContact O-N 3.13Å; Q76-I79 PolarHBondContact O-N 3.24Å; Q77-I79 VanDerWaalsContact C-N 3.3Å; Q77-I79 PolarHBondContact O-N 2.7Å; I79-T82 WeakPolarHBondContact O-CB 3.46Å; I79-T82 PolarHBondContact O-N 3.33Å; I79-L83 HydrophobicContact CG2-CD1 4.32Å; I79-L83 WeakPolarHBondContact O-CG 3.37Å; I79-L83 PolarHBondContact O-N 3.49Å; I79-L83 VanDerWaalsContact O-N 3.07Å; I79-L112 HydrophobicContact CG2-CD2 4.08Å
80	R	89.6	Confident	88.6	Confident	47 Å²	47	48 Å²	48	18%	0.177	25%	0.252	C	S	.	.	H	α-helix	trans	-59.9	-50.1	176.9	-74.7	-177	-82.8	170.1	3.2	112.2	Q76 Q77 T82 L83 I84 L112 E116 K120 W121	Q76-R80 PolarHBondContact O-N 3.49Å; Q77-R80 WeakPolarHBondContact O-CB 3.33Å; Q77-R80 PolarHBondContact O-N 3.32Å; Q77-R80 VanDerWaalsContact O-N 3.15Å; R80-T82 VanDerWaalsContact C-N 3.26Å; R80-T82 PolarHBondContact O-N 3.01Å; R80-L83 PolarHBondContact O-N 3.18Å; R80-I84 WeakPolarHBondContact O-CG1 3.38Å; R80-I84 PolarHBondContact O-N 3.24Å; R80-L112 HydrophobicContact CG-CD2 3.84Å; R80-E116 WeakPolarHBondContact CD-OE2 3.47Å; R80-E116 WeakPolarHBondContact CG-OE2 3.44Å; R80-E116 IonicContact CZ-OE2 3.13Å; R80-E116 IonicContact NE-OE1 3.71Å; R80-E116 IonicContact NE-OE2 2.8Å; R80-E116 PolarHBondContact NE-OE2 3.25Å; R80-K120 PolarHBondContact NH1-O 2.99Å; R80-K120 VanDerWaalsContact NH1-O 3.1Å; R80-W121 HydrophobicContact CB-CZ3 4.34Å; R80-W121 HydrophobicContact CG-CD2 4.38Å; R80-W121 HydrophobicContact CG-CE3 3.67Å; R80-W121 HydrophobicContact CG-CH2 4.45Å; R80-W121 HydrophobicContact CG-CZ3 3.73Å
81	E	90.3	Very high	88.6	Confident	104 Å²	104	42.7 Å²	42.7	49%	0.486	23%	0.228	S	C	.	.	H	α-helix	trans	-60.4	-39	179.6	-72.9	175.5	-174.8	0	0	111.4	Q77 L78 S85	Q77-E81 HydrophobicContact CG-CG 4.33Å; Q77-E81 WeakPolarHBondContact CG-OE1 3.47Å; Q77-E81 PolarHBondContact NE2-OE1 2.87Å; Q77-E81 WeakPolarHBondContact O-CG 3.42Å; Q77-E81 PolarHBondContact O-N 3.4Å; L78-E81 PolarHBondContact O-N 2.94Å; E81-S85 WeakPolarHBondContact O-CB 3.4Å; E81-S85 PolarHBondContact O-N 3.42Å
82	T	91.6	Very high	88.4	Confident	6 Å²	6	49 Å²	49	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-49.6	175.3	-64	0	0	0	0	111.7	A39 L42 A43 L78 I79 R80 S85 W86	A39-T82 HydrophobicContact CB-CG2 3.91Å; A39-T82 WeakPolarHBondContact O-CG2 3.38Å; L42-T82 HydrophobicContact CB-CG2 4.38Å; A43-T82 HydrophobicContact CB-CG2 4.25Å; L78-T82 VanDerWaalsContact O-CB 3.29Å; L78-T82 WeakPolarHBondContact O-CB 3.42Å; L78-T82 PolarHBondContact O-N 3.43Å; L78-T82 PolarHBondContact O-OG1 2.95Å; I79-T82 WeakPolarHBondContact O-CB 3.46Å; I79-T82 PolarHBondContact O-N 3.33Å; R80-T82 VanDerWaalsContact C-N 3.26Å; R80-T82 PolarHBondContact O-N 3.01Å; T82-S85 PolarHBondContact O-N 3.14Å; T82-W86 WeakPolarHBondContact O-CB 3.48Å; T82-W86 PolarHBondContact O-N 3.35Å
83	L	91.6	Very high	87.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-42.2	-178	-69.6	177.3	0	0	0	111.9	F57 I79 R80 W86 L87 V108 F109 L112	F57-L83 HydrophobicContact CE1-CD2 3.94Å; I79-L83 HydrophobicContact CG2-CD1 4.32Å; I79-L83 WeakPolarHBondContact O-CG 3.37Å; I79-L83 PolarHBondContact O-N 3.49Å; I79-L83 VanDerWaalsContact O-N 3.07Å; R80-L83 PolarHBondContact O-N 3.18Å; L83-W86 PolarHBondContact O-N 3.02Å; L83-L87 WeakPolarHBondContact O-CB 3.35Å; L83-L87 PolarHBondContact O-N 3.14Å; L83-V108 HydrophobicContact CD1-CG1 4.07Å; L83-V108 HydrophobicContact CD2-CG1 4.1Å; L83-F109 HydrophobicContact CB-CD1 4.46Å; L83-F109 HydrophobicContact CB-CE1 3.76Å; L83-F109 HydrophobicContact CB-CE2 4.21Å; L83-F109 HydrophobicContact CB-CZ 3.62Å; L83-F109 HydrophobicContact CD1-CD1 4.33Å; L83-F109 HydrophobicContact CD1-CE1 4.42Å; L83-F109 HydrophobicContact CD2-CE2 4.38Å; L83-F109 WeakPolarHBondContact O-CZ 3.45Å; L83-L112 HydrophobicContact CD1-CD2 3.54Å
84	I	90.7	Very high	87.2	Confident	30 Å²	30	47.3 Å²	47.3	15%	0.154	25%	0.251	C	S	.	.	H	α-helix	trans	-67.4	-42.3	176.4	-66.2	-63.3	0	0	0	111.4	R80 W86 L87 Q88 F109 W121 I128 V131	R80-I84 WeakPolarHBondContact O-CG1 3.38Å; R80-I84 PolarHBondContact O-N 3.24Å; I84-W86 VanDerWaalsContact C-N 3.32Å; I84-W86 PolarHBondContact O-N 3.01Å; I84-L87 HydrophobicContact CD1-CD2 4.48Å; I84-L87 WeakPolarHBondContact O-CB 3.23Å; I84-L87 PolarHBondContact O-N 2.98Å; I84-Q88 HydrophobicContact CG2-CG 4.39Å; I84-Q88 WeakPolarHBondContact O-CB 3.47Å; I84-Q88 WeakPolarHBondContact O-CG 3.33Å; I84-Q88 PolarHBondContact O-N 3.45Å; I84-F109 HydrophobicContact CD1-CE1 4.4Å; I84-W121 HydrophobicContact CD1-CH2 3.92Å; I84-W121 HydrophobicContact CD1-CZ2 3.84Å; I84-W121 HydrophobicContact CG1-CH2 3.98Å; I84-W121 HydrophobicContact CG1-CZ2 4Å; I84-I128 HydrophobicContact CD1-CG1 4.4Å; I84-V131 HydrophobicContact CG2-CG2 4.39Å
85	S	90.3	Very high	86.7	Confident	45 Å²	45	48.5 Å²	48.5	32%	0.315	25%	0.249	S	C	.	.	H	α-helix	trans	-60.4	-43.4	174.8	-178.3	0	0	0	0	111.2	E81 T82 Q88 A89	E81-S85 WeakPolarHBondContact O-CB 3.4Å; E81-S85 PolarHBondContact O-N 3.42Å; T82-S85 PolarHBondContact O-N 3.14Å; S85-Q88 PolarHBondContact O-N 2.79Å; S85-A89 VanDerWaalsContact O-CB 3.32Å; S85-A89 WeakPolarHBondContact O-CB 3.29Å; S85-A89 PolarHBondContact O-N 3.36Å
86	W	90.9	Very high	86.2	Confident	5 Å²	5	50.4 Å²	50.4	2%	0.019	27%	0.265	C	S	.	.	H	α-helix	trans	-61.3	-46.6	175	-178.3	87.9	0	0	0	111.5	F57 T82 L83 I84 A89 Q90 E97 I101 A105 L141	F57-W86 AromaticContact CE2-CE2 3.98Å; F57-W86 AromaticContact CE2-CZ2 4Å; F57-W86 HydrophobicContact CE2-CZ2 4Å; F57-W86 AromaticContact CZ-CD2 3.8Å; F57-W86 HydrophobicContact CZ-CD2 3.8Å; F57-W86 AromaticContact CZ-CE2 3.65Å; F57-W86 HydrophobicContact CZ-CE3 4.17Å; F57-W86 HydrophobicContact CZ-CG 4.24Å; F57-W86 HydrophobicContact CZ-CH2 4.28Å; F57-W86 AromaticContact CZ-CZ2 3.93Å; F57-W86 HydrophobicContact CZ-CZ2 3.93Å; F57-W86 HydrophobicContact CZ-CZ3 4.37Å; F57-W86 AromaticContact CZ-NE1 3.95Å; T82-W86 WeakPolarHBondContact O-CB 3.48Å; T82-W86 PolarHBondContact O-N 3.35Å; L83-W86 PolarHBondContact O-N 3.02Å; I84-W86 VanDerWaalsContact C-N 3.32Å; I84-W86 PolarHBondContact O-N 3.01Å; W86-A89 WeakPolarHBondContact O-CB 3.49Å; W86-A89 PolarHBondContact O-N 2.74Å; W86-Q90 HydrophobicContact CD2-CG 4.11Å; W86-Q90 HydrophobicContact CE3-CG 4.2Å; W86-Q90 HydrophobicContact CH2-CG 3.98Å; W86-Q90 HydrophobicContact CZ2-CG 3.86Å; W86-Q90 HydrophobicContact CZ3-CG 4.16Å; W86-Q90 WeakPolarHBondContact O-CG 3.23Å; W86-Q90 PolarHBondContact O-N 3.22Å; W86-E97 HydrophobicContact CZ2-CG 4.37Å; W86-I101 HydrophobicContact CZ2-CG2 4.08Å; W86-A105 HydrophobicContact CE3-CB 4.4Å; W86-A105 HydrophobicContact CH2-CB 3.64Å; W86-A105 HydrophobicContact CZ2-CB 4.44Å; W86-A105 HydrophobicContact CZ3-CB 3.61Å; W86-L141 HydrophobicContact CH2-CD2 4.19Å; W86-L141 HydrophobicContact CZ3-CD2 3.59Å
87	L	89.4	Confident	86.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-48.2	176.6	177.8	65.6	0	0	0	112	L83 I84 A89 Q90 M91 F109 I128 V131 V132 L141	L83-L87 WeakPolarHBondContact O-CB 3.35Å; L83-L87 PolarHBondContact O-N 3.14Å; I84-L87 HydrophobicContact CD1-CD2 4.48Å; I84-L87 WeakPolarHBondContact O-CB 3.23Å; I84-L87 PolarHBondContact O-N 2.98Å; L87-A89 VanDerWaalsContact C-N 3.31Å; L87-A89 PolarHBondContact O-N 3.17Å; L87-Q90 WeakPolarHBondContact O-CB 3.41Å; L87-Q90 PolarHBondContact O-N 2.99Å; L87-Q90 VanDerWaalsContact O-N 3.12Å; L87-M91 PolarHBondContact O-N 3.44Å; L87-F109 HydrophobicContact CB-CZ 4.27Å; L87-I128 HydrophobicContact CD2-CG1 4.42Å; L87-I128 HydrophobicContact CD2-CG2 4.19Å; L87-V131 HydrophobicContact CB-CG1 4.49Å; L87-V131 HydrophobicContact CD2-CB 4.14Å; L87-V131 HydrophobicContact CD2-CG1 3.94Å; L87-V131 HydrophobicContact CG-CB 4.5Å; L87-V131 HydrophobicContact CG-CG1 3.76Å; L87-V132 HydrophobicContact CD1-CG2 4.13Å; L87-V132 HydrophobicContact CD2-CG2 4.3Å; L87-L141 HydrophobicContact CD1-CD2 3.33Å; L87-L141 HydrophobicContact CD1-CG 4.23Å
88	Q	88.7	Confident	86.2	Confident	95 Å²	95	52.4 Å²	52.4	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-44.1	175.9	-75	175.3	-8	0	0	111.5	I84 S85 Q90 M91 L92 V131	I84-Q88 HydrophobicContact CG2-CG 4.39Å; I84-Q88 WeakPolarHBondContact O-CB 3.47Å; I84-Q88 WeakPolarHBondContact O-CG 3.33Å; I84-Q88 PolarHBondContact O-N 3.45Å; S85-Q88 PolarHBondContact O-N 2.79Å; Q88-Q90 VanDerWaalsContact C-N 3.25Å; Q88-Q90 PolarHBondContact O-N 2.99Å; Q88-M91 WeakPolarHBondContact O-CB 3.44Å; Q88-M91 PolarHBondContact O-N 3Å; Q88-M91 VanDerWaalsContact O-N 3.1Å; Q88-L92 PolarHBondContact O-N 2.91Å; Q88-V131 HydrophobicContact CB-CG1 4.22Å; Q88-V131 HydrophobicContact CG-CB 4.35Å; Q88-V131 HydrophobicContact CG-CG1 3.48Å; Q88-V131 VanDerWaalsContact CG-CG1 3.48Å; Q88-V131 HydrophobicContact CG-CG2 3.86Å
89	A	86.5	Confident	86.1	Confident	15 Å²	15	52.4 Å²	52.4	12%	0.124	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-37.9	178.5	0	0	0	0	0	110.6	R45 S85 W86 L87 M91 L92 N93	R45-A89 VanDerWaalsContact CZ-O 3.24Å; R45-A89 PolarHBondContact NH1-O 3.36Å; R45-A89 PolarHBondContact NH2-O 3.47Å; S85-A89 VanDerWaalsContact O-CB 3.32Å; S85-A89 WeakPolarHBondContact O-CB 3.29Å; S85-A89 PolarHBondContact O-N 3.36Å; W86-A89 WeakPolarHBondContact O-CB 3.49Å; W86-A89 PolarHBondContact O-N 2.74Å; L87-A89 VanDerWaalsContact C-N 3.31Å; L87-A89 PolarHBondContact O-N 3.17Å; A89-M91 PolarHBondContact O-N 3.38Å; A89-L92 PolarHBondContact O-N 3.42Å; A89-L92 VanDerWaalsContact O-N 3.11Å; A89-N93 PolarHBondContact O-N 3.24Å; A89-N93 VanDerWaalsContact O-N 3.17Å
90	Q	84.4	Confident	86.2	Confident	16 Å²	16	56.3 Å²	56.3	8%	0.075	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-29.8	177.5	-66.4	-48.8	-29.9	0	0	112.6	R45 W86 L87 Q88 L92 N93 E97	R45-Q90 VanDerWaalsContact NH2-N 3.15Å; W86-Q90 HydrophobicContact CD2-CG 4.11Å; W86-Q90 HydrophobicContact CE3-CG 4.2Å; W86-Q90 HydrophobicContact CH2-CG 3.98Å; W86-Q90 HydrophobicContact CZ2-CG 3.86Å; W86-Q90 HydrophobicContact CZ3-CG 4.16Å; W86-Q90 WeakPolarHBondContact O-CG 3.23Å; W86-Q90 PolarHBondContact O-N 3.22Å; L87-Q90 WeakPolarHBondContact O-CB 3.41Å; L87-Q90 PolarHBondContact O-N 2.99Å; L87-Q90 VanDerWaalsContact O-N 3.12Å; Q88-Q90 VanDerWaalsContact C-N 3.25Å; Q88-Q90 PolarHBondContact O-N 2.99Å; Q90-L92 VanDerWaalsContact C-N 3.26Å; Q90-L92 PolarHBondContact O-N 2.94Å; Q90-N93 PolarHBondContact O-N 2.97Å; Q90-E97 PolarHBondContact NE2-OE1 3.11Å; Q90-E97 VanDerWaalsContact OE1-CG 3.23Å
91	M	85.3	Confident	86.3	Confident	34 Å²	34	54.1 Å²	54.1	17%	0.167	28%	0.283	C	S	.	.	H	α-helix	trans	-69.3	-27.1	176.3	-61.2	-54.9	98.9	0	0	112.4	L87 Q88 A89 V131 N135 G138	L87-M91 PolarHBondContact O-N 3.44Å; Q88-M91 WeakPolarHBondContact O-CB 3.44Å; Q88-M91 PolarHBondContact O-N 3Å; Q88-M91 VanDerWaalsContact O-N 3.1Å; A89-M91 PolarHBondContact O-N 3.38Å; M91-V131 HydrophobicContact CG-CG1 4.31Å; M91-N135 HydrophobicContact SD-CB 4.05Å; M91-G138 WeakPolarHBondContact SD-CA 3.26Å
92	L	81.4	Confident	86.4	Confident	148 Å²	148	51 Å²	51	78%	0.775	27%	0.268	S	S	*	.	H	α-helix	trans	-89.5	-15.6	179.3	-62.1	171.3	0	0	0	113.5	Q88 A89 Q90	Q88-L92 PolarHBondContact O-N 2.91Å; A89-L92 PolarHBondContact O-N 3.42Å; A89-L92 VanDerWaalsContact O-N 3.11Å; Q90-L92 VanDerWaalsContact C-N 3.26Å; Q90-L92 PolarHBondContact O-N 2.94Å
93	N	78.1	Confident	86.5	Confident	38 Å²	38	53.9 Å²	53.9	20%	0.203	28%	0.282	C	S	.	.			trans	-75.4	132.7	-176.7	-169.1	-8	0	0	0	110.3	A89 Q90 Q95 R137	A89-N93 PolarHBondContact O-N 3.24Å; A89-N93 VanDerWaalsContact O-N 3.17Å; Q90-N93 PolarHBondContact O-N 2.97Å; N93-Q95 VanDerWaalsContact C-N 3.31Å; N93-Q95 VanDerWaalsContact CG-O 3.26Å; N93-Q95 PolarHBondContact ND2-O 3.01Å; N93-Q95 PolarHBondContact O-N 3.06Å; N93-Q95 PolarHBondContact OD1-N 3.46Å; N93-R137 PolarHBondContact O-NH1 3.07Å
94	P	69.9	Low	86.7	Confident	98 Å²	98	54.8 Å²	54.8	64%	0.636	29%	0.286	S	S	*	.	S	Bend	trans	-67	-26.4	175	22.6	-33.5	0	0	0	114.4	R137	P94-R137 VanDerWaalsContact C-NH1 3.26Å; P94-R137 PolarHBondContact O-NH1 3.24Å; P94-R137 PolarHBondContact O-NH2 3.24Å
95	Q	77.4	Confident	86.8	Confident	137 Å²	137	53.4 Å²	53.4	64%	0.64	28%	0.279	S	S	*	.	S	Bend	trans	-109.5	138.2	-178.7	-68.1	-68.5	-18.4	0	0	111.8	N93	N93-Q95 VanDerWaalsContact C-N 3.31Å; N93-Q95 VanDerWaalsContact CG-O 3.26Å; N93-Q95 PolarHBondContact ND2-O 3.01Å; N93-Q95 PolarHBondContact O-N 3.06Å; N93-Q95 PolarHBondContact OD1-N 3.46Å
96	P	77.4	Confident	87.1	Confident	76 Å²	76	51.3 Å²	51.3	49%	0.494	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-70.3	144.7	172.7	29.9	-33.1	0	0	0	111.2
97	E	86.6	Confident	87.3	Confident	19 Å²	19	54.8 Å²	54.8	9%	0.089	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-68.5	156.4	170.7	-70.9	-75.1	-178.4	0	0	111.4	K53 W86 Q90 R102	K53-E97 VanDerWaalsContact NZ-CD 3.31Å; K53-E97 IonicContact NZ-OE1 3.01Å; K53-E97 PolarHBondContact NZ-OE1 3.31Å; K53-E97 IonicContact NZ-OE2 3.29Å; K53-E97 PolarHBondContact NZ-OE2 2.94Å; W86-E97 HydrophobicContact CZ2-CG 4.37Å; Q90-E97 PolarHBondContact NE2-OE1 3.11Å; Q90-E97 VanDerWaalsContact OE1-CG 3.23Å; E97-R102 HydrophobicContact CB-CG 4.19Å; E97-R102 PolarHBondContact O-NE 2.91Å
98	K	89.3	Confident	87.5	Confident	120 Å²	120	54.8 Å²	54.8	52%	0.522	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-60.4	146.8	177	-60.8	-64.8	-175.5	178.5	0	111.5	D50 F100 I101 R102	D50-K98 VanDerWaalsContact OD2-CG 3.23Å; D50-K98 WeakPolarHBondContact OD2-CG 3.49Å; K98-F100 VanDerWaalsContact C-N 3.29Å; K98-F100 HydrophobicContact CB-CD1 3.64Å; K98-F100 HydrophobicContact CB-CE1 3.35Å; K98-F100 HydrophobicContact CB-CZ 4.05Å; K98-F100 HydrophobicContact CG-CE1 3.8Å; K98-F100 HydrophobicContact CG-CZ 4.36Å; K98-F100 PolarHBondContact O-N 2.92Å; K98-I101 HydrophobicContact CB-CD1 4.41Å; K98-I101 PolarHBondContact O-N 2.64Å; K98-R102 PolarHBondContact O-N 3.19Å; K98-R102 VanDerWaalsContact O-N 3.14Å
99	T	89.8	Confident	87.9	Confident	66 Å²	66	50.3 Å²	50.3	41%	0.405	26%	0.26	S	S	.	.	H	α-helix	trans	-55.1	-41	-176.8	-51.4	0	0	0	0	112.9	I101 R102 N103	T99-I101 VanDerWaalsContact C-N 3.3Å; T99-I101 PolarHBondContact O-N 3Å; T99-R102 PolarHBondContact O-N 3.41Å; T99-R102 PolarHBondContact OG1-NH2 3.06Å; T99-N103 WeakPolarHBondContact O-CB 3.48Å; T99-N103 VanDerWaalsContact O-CG 3.3Å; T99-N103 PolarHBondContact O-N 3.35Å
100	F	90.9	Very high	88.3	Confident	83 Å²	83	49.6 Å²	49.6	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-64.9	-30.9	179	68	-92.7	0	0	0	113.4	D50 F54 K98 K104	D50-F100 HydrophobicContact CB-CE2 4.42Å; D50-F100 HydrophobicContact CB-CZ 3.76Å; F54-F100 HydrophobicContact CB-CD2 4.21Å; F54-F100 HydrophobicContact CB-CE2 3.99Å; F54-F100 AromaticContact CD2-CD2 3.64Å; F54-F100 HydrophobicContact CD2-CD2 3.64Å; F54-F100 HydrophobicContact CD2-CE2 4.28Å; F54-F100 HydrophobicContact CE2-CD2 4.28Å; F54-F100 HydrophobicContact CG-CD2 4.13Å; F54-F100 HydrophobicContact CG-CE2 4.35Å; K98-F100 VanDerWaalsContact C-N 3.29Å; K98-F100 HydrophobicContact CB-CD1 3.64Å; K98-F100 HydrophobicContact CB-CE1 3.35Å; K98-F100 HydrophobicContact CB-CZ 4.05Å; K98-F100 HydrophobicContact CG-CE1 3.8Å; K98-F100 HydrophobicContact CG-CZ 4.36Å; K98-F100 PolarHBondContact O-N 2.92Å; F100-K104 WeakPolarHBondContact O-CB 3.31Å; F100-K104 PolarHBondContact O-N 2.77Å; F100-K104 VanDerWaalsContact O-N 3.09Å
101	I	91.9	Very high	88.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-73	-46.2	174.2	-60.1	174.2	0	0	0	110	D50 K53 F57 W86 K98 T99 N103 K104 A105	D50-I101 HydrophobicContact CB-CD1 3.71Å; K53-I101 HydrophobicContact CB-CD1 4.16Å; K53-I101 HydrophobicContact CD-CD1 3.95Å; F57-I101 HydrophobicContact CD2-CG2 4.18Å; F57-I101 HydrophobicContact CE2-CG2 3.85Å; W86-I101 HydrophobicContact CZ2-CG2 4.08Å; K98-I101 HydrophobicContact CB-CD1 4.41Å; K98-I101 PolarHBondContact O-N 2.64Å; T99-I101 VanDerWaalsContact C-N 3.3Å; T99-I101 PolarHBondContact O-N 3Å; I101-N103 VanDerWaalsContact C-N 3.33Å; I101-N103 PolarHBondContact O-N 2.96Å; I101-K104 PolarHBondContact O-N 3.03Å; I101-K104 VanDerWaalsContact O-N 3.14Å; I101-A105 WeakPolarHBondContact O-CB 3.45Å; I101-A105 PolarHBondContact O-N 3.41Å
102	R	92.5	Very high	89.1	Confident	40 Å²	40	47.9 Å²	47.9	15%	0.151	25%	0.246	C	C	.	.	H	α-helix	trans	-57.9	-46	178.2	-68.4	-176.5	-77.3	160.3	0.5	111.4	E97 K98 T99 K104 A105 A106 D140 L141	E97-R102 HydrophobicContact CB-CG 4.19Å; E97-R102 PolarHBondContact O-NE 2.91Å; K98-R102 PolarHBondContact O-N 3.19Å; K98-R102 VanDerWaalsContact O-N 3.14Å; T99-R102 PolarHBondContact O-N 3.41Å; T99-R102 PolarHBondContact OG1-NH2 3.06Å; R102-K104 PolarHBondContact O-N 2.88Å; R102-A105 PolarHBondContact O-N 3.16Å; R102-A106 WeakPolarHBondContact O-CB 3.29Å; R102-A106 PolarHBondContact O-N 3.32Å; R102-D140 IonicContact CZ-OD2 3.03Å; R102-D140 IonicContact NE-OD2 3.92Å; R102-D140 IonicContact NH1-OD1 3.64Å; R102-D140 PolarHBondContact NH1-OD1 3.43Å; R102-D140 VanDerWaalsContact NH1-OD1 3.15Å; R102-D140 IonicContact NH1-OD2 2.95Å; R102-D140 PolarHBondContact NH1-OD2 3.25Å; R102-L141 HydrophobicContact CB-CD1 4.26Å
103	N	94.3	Very high	89.8	Confident	65 Å²	65	40.9 Å²	40.9	35%	0.348	21%	0.21	S	C	.	.	H	α-helix	trans	-61.9	-42.6	175.2	-70.7	-8.8	0	0	0	111.7	T99 I101 A106 Q107 R144	T99-N103 WeakPolarHBondContact O-CB 3.48Å; T99-N103 VanDerWaalsContact O-CG 3.3Å; T99-N103 PolarHBondContact O-N 3.35Å; I101-N103 VanDerWaalsContact C-N 3.33Å; I101-N103 PolarHBondContact O-N 2.96Å; N103-A106 WeakPolarHBondContact O-CB 3.29Å; N103-A106 PolarHBondContact O-N 3.43Å; N103-Q107 WeakPolarHBondContact O-CG 3.46Å; N103-Q107 PolarHBondContact O-N 3.49Å; N103-R144 WeakPolarHBondContact OD1-CD 3.24Å; N103-R144 PolarHBondContact OD1-NH1 3.05Å
104	K	94.6	Very high	90.4	Very high	21 Å²	21	39.3 Å²	39.3	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-40	179.8	-162.9	60	176.4	173	0	112.7	F54 F57 E61 F100 I101 R102 A106 Q107 V108	F54-K104 HydrophobicContact CD2-CB 3.76Å; F54-K104 HydrophobicContact CD2-CG 3.87Å; F54-K104 HydrophobicContact CE2-CB 3.66Å; F54-K104 HydrophobicContact CE2-CD 3.85Å; F54-K104 HydrophobicContact CE2-CG 3.67Å; F54-K104 HydrophobicContact CZ-CD 4.1Å; F54-K104 HydrophobicContact CZ-CG 4.27Å; F57-K104 HydrophobicContact CB-CB 4.39Å; F57-K104 HydrophobicContact CB-CG 3.71Å; E61-K104 IonicContact OE1-NZ 2.79Å; E61-K104 PolarHBondContact OE1-NZ 3.46Å; E61-K104 WeakPolarHBondContact OE2-CE 3.47Å; E61-K104 IonicContact OE2-NZ 3.36Å; E61-K104 PolarHBondContact OE2-NZ 2.92Å; F100-K104 WeakPolarHBondContact O-CB 3.31Å; F100-K104 PolarHBondContact O-N 2.77Å; F100-K104 VanDerWaalsContact O-N 3.09Å; I101-K104 PolarHBondContact O-N 3.03Å; I101-K104 VanDerWaalsContact O-N 3.14Å; R102-K104 PolarHBondContact O-N 2.88Å; K104-A106 VanDerWaalsContact C-N 3.35Å; K104-Q107 VanDerWaalsContact CD-OE1 3.31Å; K104-Q107 PolarHBondContact O-N 3.14Å; K104-V108 WeakPolarHBondContact O-CG2 3.44Å; K104-V108 PolarHBondContact O-N 2.78Å
105	A	94.1	Very high	91.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.3	-46.2	172.5	0	0	0	0	0	110.9	F57 W86 I101 R102 Q107 V108 F109	F57-A105 HydrophobicContact CD1-CB 4.33Å; F57-A105 HydrophobicContact CE1-CB 3.78Å; F57-A105 HydrophobicContact CE2-CB 4.11Å; F57-A105 HydrophobicContact CZ-CB 3.66Å; W86-A105 HydrophobicContact CE3-CB 4.4Å; W86-A105 HydrophobicContact CH2-CB 3.64Å; W86-A105 HydrophobicContact CZ2-CB 4.44Å; W86-A105 HydrophobicContact CZ3-CB 3.61Å; I101-A105 WeakPolarHBondContact O-CB 3.45Å; I101-A105 PolarHBondContact O-N 3.41Å; R102-A105 PolarHBondContact O-N 3.16Å; A105-Q107 VanDerWaalsContact C-N 3.32Å; A105-Q107 PolarHBondContact O-N 2.83Å; A105-V108 PolarHBondContact O-N 2.89Å; A105-V108 VanDerWaalsContact O-N 3.09Å; A105-F109 VanDerWaalsContact O-CD2 3.28Å; A105-F109 WeakPolarHBondContact O-CD2 3.45Å; A105-F109 PolarHBondContact O-N 3.08Å
106	A	95.3	Very high	92.1	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.017	16%	0.157	C	C	.	.	H	α-helix	trans	-57.3	-41.3	177.6	0	0	0	0	0	112.9	R102 N103 K104 F109 A110 R144 I145 A148	R102-A106 WeakPolarHBondContact O-CB 3.29Å; R102-A106 PolarHBondContact O-N 3.32Å; N103-A106 WeakPolarHBondContact O-CB 3.29Å; N103-A106 PolarHBondContact O-N 3.43Å; K104-A106 VanDerWaalsContact C-N 3.35Å; A106-F109 PolarHBondContact O-N 3.36Å; A106-A110 WeakPolarHBondContact O-CB 3.22Å; A106-A110 PolarHBondContact O-N 2.99Å; A106-R144 HydrophobicContact CB-CB 3.93Å; A106-I145 HydrophobicContact CB-CG1 3.96Å; A106-A148 HydrophobicContact CB-CB 4.27Å
107	Q	94.9	Very high	92.8	Very high	78 Å²	78	27.3 Å²	27.3	36%	0.364	13%	0.134	S	C	.	.	H	α-helix	trans	-59.9	-45.2	173.2	-71.4	174.9	-4.5	0	0	112.2	N103 K104 A105 F109 A110 L111	N103-Q107 WeakPolarHBondContact O-CG 3.46Å; N103-Q107 PolarHBondContact O-N 3.49Å; K104-Q107 VanDerWaalsContact CD-OE1 3.31Å; K104-Q107 PolarHBondContact O-N 3.14Å; A105-Q107 VanDerWaalsContact C-N 3.32Å; A105-Q107 PolarHBondContact O-N 2.83Å; Q107-F109 PolarHBondContact O-N 3.47Å; Q107-A110 PolarHBondContact O-N 3.09Å; Q107-L111 WeakPolarHBondContact O-CG 3.48Å; Q107-L111 PolarHBondContact O-N 3.41Å
108	V	95.3	Very high	92.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.3	-40	178.4	179.9	0	0	0	0	111.3	F57 L60 E61 L83 K104 A105 L112	F57-V108 HydrophobicContact CB-CG2 4.44Å; F57-V108 HydrophobicContact CD1-CG2 4.18Å; L60-V108 HydrophobicContact CB-CG1 4.31Å; E61-V108 HydrophobicContact CB-CG2 3.9Å; L83-V108 HydrophobicContact CD1-CG1 4.07Å; L83-V108 HydrophobicContact CD2-CG1 4.1Å; K104-V108 WeakPolarHBondContact O-CG2 3.44Å; K104-V108 PolarHBondContact O-N 2.78Å; A105-V108 PolarHBondContact O-N 2.89Å; A105-V108 VanDerWaalsContact O-N 3.09Å; V108-L112 WeakPolarHBondContact O-CB 3.45Å; V108-L112 PolarHBondContact O-N 3.33Å; V108-L112 VanDerWaalsContact O-N 3.07Å
109	F	95.9	Very high	92.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.7	-44.5	172	-87.7	-77.6	0	0	0	111.9	L83 I84 L87 A105 A106 Q107 L112 F113 F124 I128 I145	L83-F109 HydrophobicContact CB-CD1 4.46Å; L83-F109 HydrophobicContact CB-CE1 3.76Å; L83-F109 HydrophobicContact CB-CE2 4.21Å; L83-F109 HydrophobicContact CB-CZ 3.62Å; L83-F109 HydrophobicContact CD1-CD1 4.33Å; L83-F109 HydrophobicContact CD1-CE1 4.42Å; L83-F109 HydrophobicContact CD2-CE2 4.38Å; L83-F109 WeakPolarHBondContact O-CZ 3.45Å; I84-F109 HydrophobicContact CD1-CE1 4.4Å; L87-F109 HydrophobicContact CB-CZ 4.27Å; A105-F109 VanDerWaalsContact O-CD2 3.28Å; A105-F109 WeakPolarHBondContact O-CD2 3.45Å; A105-F109 PolarHBondContact O-N 3.08Å; A106-F109 PolarHBondContact O-N 3.36Å; Q107-F109 PolarHBondContact O-N 3.47Å; F109-L112 PolarHBondContact O-N 3.44Å; F109-F113 WeakPolarHBondContact O-CB 3.48Å; F109-F113 PolarHBondContact O-N 3.41Å; F109-F124 HydrophobicContact CB-CZ 4.43Å; F109-F124 HydrophobicContact CD1-CE2 4.14Å; F109-F124 HydrophobicContact CD1-CZ 4.24Å; F109-I128 HydrophobicContact CD1-CD1 4.21Å; F109-I128 HydrophobicContact CE1-CD1 4.38Å; F109-I145 HydrophobicContact CB-CD1 4.17Å; F109-I145 HydrophobicContact CB-CG1 3.95Å; F109-I145 HydrophobicContact CB-CG2 4.13Å; F109-I145 HydrophobicContact CD1-CD1 4.34Å; F109-I145 HydrophobicContact CD2-CD1 3.85Å; F109-I145 HydrophobicContact CD2-CG1 4.22Å; F109-I145 HydrophobicContact CE2-CD1 4.29Å; F109-I145 HydrophobicContact CG-CD1 3.88Å; F109-I145 HydrophobicContact CG-CG1 4.19Å
110	A	95	Very high	92.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-45.8	178.7	0	0	0	0	0	112.3	A106 Q107 L112 F113 V114 A148 I149 E152	A106-A110 WeakPolarHBondContact O-CB 3.22Å; A106-A110 PolarHBondContact O-N 2.99Å; Q107-A110 PolarHBondContact O-N 3.09Å; A110-L112 VanDerWaalsContact C-N 3.3Å; A110-L112 PolarHBondContact O-N 3.24Å; A110-F113 WeakPolarHBondContact O-CB 3.35Å; A110-F113 PolarHBondContact O-N 3.18Å; A110-V114 WeakPolarHBondContact O-CB 3.46Å; A110-V114 VanDerWaalsContact O-CG2 3.27Å; A110-V114 WeakPolarHBondContact O-CG2 3.32Å; A110-V114 PolarHBondContact O-N 3.07Å; A110-A148 HydrophobicContact CB-CB 3.71Å; A110-I149 HydrophobicContact CB-CG1 3.82Å; A110-E152 HydrophobicContact CB-CG 4.45Å
111	L	93.4	Very high	92.7	Very high	14 Å²	14	26.5 Å²	26.5	7%	0.073	14%	0.136	C	C	.	.	H	α-helix	trans	-60.3	-40.7	176.5	-71.1	173.7	0	0	0	112.1	E61 V64 Q107 T115	E61-L111 HydrophobicContact CG-CD1 3.62Å; V64-L111 HydrophobicContact CG1-CB 3.78Å; Q107-L111 WeakPolarHBondContact O-CG 3.48Å; Q107-L111 PolarHBondContact O-N 3.41Å; L111-T115 WeakPolarHBondContact O-CB 3.28Å; L111-T115 PolarHBondContact O-N 3.44Å; L111-T115 VanDerWaalsContact O-N 3.17Å; L111-T115 PolarHBondContact O-OG1 2.93Å
112	L	93.8	Very high	92.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.2	-41.7	177	-172.8	59.9	0	0	0	111.5	Y68 I79 R80 L83 V108 F109 A110 T115 E116 W121	Y68-L112 HydrophobicContact CE2-CD1 3.66Å; Y68-L112 VanDerWaalsContact OH-CD1 3.28Å; Y68-L112 WeakPolarHBondContact OH-CD1 3.25Å; I79-L112 HydrophobicContact CG2-CD2 4.08Å; R80-L112 HydrophobicContact CG-CD2 3.84Å; L83-L112 HydrophobicContact CD1-CD2 3.54Å; V108-L112 WeakPolarHBondContact O-CB 3.45Å; V108-L112 PolarHBondContact O-N 3.33Å; V108-L112 VanDerWaalsContact O-N 3.07Å; F109-L112 PolarHBondContact O-N 3.44Å; A110-L112 VanDerWaalsContact C-N 3.3Å; A110-L112 PolarHBondContact O-N 3.24Å; L112-T115 PolarHBondContact O-N 3.07Å; L112-E116 HydrophobicContact CD1-CG 4.02Å; L112-E116 PolarHBondContact O-N 3.23Å; L112-W121 HydrophobicContact CD2-CE3 4.31Å; L112-W121 HydrophobicContact CD2-CZ3 3.8Å; L112-W121 HydrophobicContact CG-CE3 4.42Å; L112-W121 HydrophobicContact CG-CZ3 4.3Å
113	F	94.8	Very high	92.4	Very high	1 Å²	1	34.6 Å²	34.6	0%	0.004	18%	0.179	C	C	.	.	H	α-helix	trans	-55.9	-52.7	173	170.7	-97.2	0	0	0	111.3	F109 A110 T115 E116 Y117 F124 F125 I149 L153 I171 M175	F109-F113 WeakPolarHBondContact O-CB 3.48Å; F109-F113 PolarHBondContact O-N 3.41Å; A110-F113 WeakPolarHBondContact O-CB 3.35Å; A110-F113 PolarHBondContact O-N 3.18Å; F113-T115 PolarHBondContact O-N 3.35Å; F113-T115 VanDerWaalsContact O-N 3.1Å; F113-E116 PolarHBondContact O-N 3Å; F113-Y117 AromaticContact CD2-CD2 3.92Å; F113-Y117 HydrophobicContact CD2-CD2 3.92Å; F113-Y117 AromaticContact CD2-CG 3.97Å; F113-Y117 HydrophobicContact CD2-CG 3.97Å; F113-Y117 HydrophobicContact CE1-CG 4.46Å; F113-Y117 AromaticContact CE2-CD1 3.94Å; F113-Y117 HydrophobicContact CE2-CD1 3.94Å; F113-Y117 AromaticContact CE2-CD2 3.2Å; F113-Y117 HydrophobicContact CE2-CD2 3.2Å; F113-Y117 HydrophobicContact CE2-CE1 4.4Å; F113-Y117 AromaticContact CE2-CE2 3.73Å; F113-Y117 HydrophobicContact CE2-CE2 3.73Å; F113-Y117 AromaticContact CE2-CG 3.3Å; F113-Y117 HydrophobicContact CE2-CG 3.3Å; F113-Y117 AromaticContact CZ-CD1 3.73Å; F113-Y117 HydrophobicContact CZ-CD1 3.73Å; F113-Y117 AromaticContact CZ-CD2 3.87Å; F113-Y117 HydrophobicContact CZ-CD2 3.87Å; F113-Y117 HydrophobicContact CZ-CE1 4.11Å; F113-Y117 HydrophobicContact CZ-CE2 4.22Å; F113-Y117 AromaticContact CZ-CG 3.58Å; F113-Y117 HydrophobicContact CZ-CG 3.58Å; F113-Y117 WeakPolarHBondContact O-CB 3.49Å; F113-Y117 PolarHBondContact O-N 3.47Å; F113-F124 HydrophobicContact CB-CD2 4.39Å; F113-F124 HydrophobicContact CB-CE1 4.14Å; F113-F124 HydrophobicContact CB-CE2 3.98Å; F113-F124 HydrophobicContact CB-CZ 3.84Å; F113-F124 HydrophobicContact CD2-CB 4.1Å; F113-F124 AromaticContact CD2-CD1 3.39Å; F113-F124 HydrophobicContact CD2-CD1 3.39Å; F113-F124 HydrophobicContact CD2-CD2 4.16Å; F113-F124 AromaticContact CD2-CE1 3.71Å; F113-F124 HydrophobicContact CD2-CE1 3.71Å; F113-F124 HydrophobicContact CD2-CE2 4.42Å; F113-F124 AromaticContact CD2-CG 3.63Å; F113-F124 HydrophobicContact CD2-CG 3.63Å; F113-F124 HydrophobicContact CD2-CZ 4.21Å; F113-F124 HydrophobicContact CE2-CB 4.46Å; F113-F124 AromaticContact CE2-CD1 3.94Å; F113-F124 HydrophobicContact CE2-CD1 3.94Å; F113-F124 HydrophobicContact CE2-CE1 4.48Å; F113-F124 HydrophobicContact CE2-CG 4.33Å; F113-F124 HydrophobicContact CG-CD1 4.3Å; F113-F124 HydrophobicContact CG-CE1 4.18Å; F113-F124 HydrophobicContact CG-CZ 4.38Å; F113-F125 HydrophobicContact CD2-CE2 4.44Å; F113-F125 HydrophobicContact CD2-CZ 4.29Å; F113-F125 HydrophobicContact CE2-CD2 4.39Å; F113-F125 AromaticContact CE2-CE2 3.46Å; F113-F125 HydrophobicContact CE2-CE2 3.46Å; F113-F125 VanDerWaalsContact CE2-CE2 3.46Å; F113-F125 AromaticContact CE2-CZ 3.57Å; F113-F125 HydrophobicContact CE2-CZ 3.57Å; F113-F125 AromaticContact CZ-CE2 3.8Å; F113-F125 HydrophobicContact CZ-CE2 3.8Å; F113-F125 AromaticContact CZ-CZ 3.78Å; F113-F125 HydrophobicContact CZ-CZ 3.78Å; F113-I149 HydrophobicContact CB-CD1 4.25Å; F113-I149 HydrophobicContact CB-CG1 4.4Å; F113-I149 HydrophobicContact CD1-CB 4.46Å; F113-I149 HydrophobicContact CD1-CD1 3.84Å; F113-I149 HydrophobicContact CD1-CG1 3.82Å; F113-I149 HydrophobicContact CD1-CG2 3.81Å; F113-I149 HydrophobicContact CD2-CD1 4.26Å; F113-I149 HydrophobicContact CE1-CD1 4.27Å; F113-I149 HydrophobicContact CE1-CG1 4.41Å; F113-I149 HydrophobicContact CE1-CG2 3.63Å; F113-I149 HydrophobicContact CG-CD1 3.85Å; F113-I149 HydrophobicContact CG-CG1 4.18Å; F113-I149 HydrophobicContact CZ-CG2 4.49Å; F113-L153 HydrophobicContact CE1-CD1 4.09Å; F113-I171 HydrophobicContact CE1-CG2 3.82Å; F113-I171 HydrophobicContact CZ-CG2 4.12Å; F113-M175 HydrophobicContact CE1-SD 3.96Å; F113-M175 HydrophobicContact CZ-CE 4.19Å; F113-M175 HydrophobicContact CZ-CG 4.14Å; F113-M175 HydrophobicContact CZ-SD 3.6Å
114	V	91.9	Very high	92.4	Very high	6 Å²	6	31.5 Å²	31.5	4%	0.036	16%	0.163	C	C	.	.	H	α-helix	trans	-58.4	-28.3	-180	169.3	0	0	0	0	112	A110 E152 L153 I171	A110-V114 WeakPolarHBondContact O-CB 3.46Å; A110-V114 VanDerWaalsContact O-CG2 3.27Å; A110-V114 WeakPolarHBondContact O-CG2 3.32Å; A110-V114 PolarHBondContact O-N 3.07Å; V114-E152 HydrophobicContact CG2-CB 4.02Å; V114-L153 HydrophobicContact CG2-CD2 3.9Å; V114-L153 HydrophobicContact CG2-CG 4.23Å; V114-I171 HydrophobicContact CG1-CD1 4.23Å; V114-I171 WeakPolarHBondContact O-CD1 3.41Å
115	T	89.9	Confident	92.2	Very high	55 Å²	55	31 Å²	31	34%	0.337	16%	0.161	S	C	.	.	H	α-helix	trans	-87.6	-39.3	-179.3	-53.4	0	0	0	0	113.2	Y68 L111 L112 F113	Y68-T115 HydrophobicContact CD1-CG2 3.38Å; Y68-T115 HydrophobicContact CE1-CG2 3.54Å; Y68-T115 HydrophobicContact CG-CG2 4.19Å; L111-T115 WeakPolarHBondContact O-CB 3.28Å; L111-T115 PolarHBondContact O-N 3.44Å; L111-T115 VanDerWaalsContact O-N 3.17Å; L111-T115 PolarHBondContact O-OG1 2.93Å; L112-T115 PolarHBondContact O-N 3.07Å; F113-T115 PolarHBondContact O-N 3.35Å; F113-T115 VanDerWaalsContact O-N 3.1Å
116	E	91.8	Very high	92	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-110	-17.4	-168.6	-70.9	-157.4	125	0	0	115.8	Y68 R80 L112 F113 L118 T119 K120 W121	Y68-E116 HydrophobicContact CE1-CG 4.06Å; Y68-E116 VanDerWaalsContact OH-CG 3.31Å; Y68-E116 WeakPolarHBondContact OH-CG 3.35Å; Y68-E116 PolarHBondContact OH-OE1 3.08Å; Y68-E116 PolarHBondContact OH-OE2 3.06Å; R80-E116 WeakPolarHBondContact CD-OE2 3.47Å; R80-E116 WeakPolarHBondContact CG-OE2 3.44Å; R80-E116 IonicContact CZ-OE2 3.13Å; R80-E116 IonicContact NE-OE1 3.71Å; R80-E116 IonicContact NE-OE2 2.8Å; R80-E116 PolarHBondContact NE-OE2 3.25Å; L112-E116 HydrophobicContact CD1-CG 4.02Å; L112-E116 PolarHBondContact O-N 3.23Å; F113-E116 PolarHBondContact O-N 3Å; E116-L118 VanDerWaalsContact C-N 3.33Å; E116-L118 PolarHBondContact O-N 2.93Å; E116-T119 PolarHBondContact O-N 3.37Å; E116-K120 HydrophobicContact CB-CB 4.14Å; E116-K120 HydrophobicContact CG-CB 4.22Å; E116-K120 HydrophobicContact CG-CD 4.34Å; E116-K120 PolarHBondContact O-N 3.16Å; E116-K120 WeakPolarHBondContact OE1-CD 3.41Å; E116-W121 HydrophobicContact CB-CB 4.11Å; E116-W121 PolarHBondContact O-N 3.28Å
117	Y	93.4	Very high	91.8	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.012	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-45.3	-169.8	174.2	-116.6	0	0	0	113.7	F113 T119 P122 F124 F125 I171 T174 M175 C179	F113-Y117 AromaticContact CD2-CD2 3.92Å; F113-Y117 HydrophobicContact CD2-CD2 3.92Å; F113-Y117 AromaticContact CD2-CG 3.97Å; F113-Y117 HydrophobicContact CD2-CG 3.97Å; F113-Y117 HydrophobicContact CE1-CG 4.46Å; F113-Y117 AromaticContact CE2-CD1 3.94Å; F113-Y117 HydrophobicContact CE2-CD1 3.94Å; F113-Y117 AromaticContact CE2-CD2 3.2Å; F113-Y117 HydrophobicContact CE2-CD2 3.2Å; F113-Y117 HydrophobicContact CE2-CE1 4.4Å; F113-Y117 AromaticContact CE2-CE2 3.73Å; F113-Y117 HydrophobicContact CE2-CE2 3.73Å; F113-Y117 AromaticContact CE2-CG 3.3Å; F113-Y117 HydrophobicContact CE2-CG 3.3Å; F113-Y117 AromaticContact CZ-CD1 3.73Å; F113-Y117 HydrophobicContact CZ-CD1 3.73Å; F113-Y117 AromaticContact CZ-CD2 3.87Å; F113-Y117 HydrophobicContact CZ-CD2 3.87Å; F113-Y117 HydrophobicContact CZ-CE1 4.11Å; F113-Y117 HydrophobicContact CZ-CE2 4.22Å; F113-Y117 AromaticContact CZ-CG 3.58Å; F113-Y117 HydrophobicContact CZ-CG 3.58Å; F113-Y117 WeakPolarHBondContact O-CB 3.49Å; F113-Y117 PolarHBondContact O-N 3.47Å; Y117-T119 PolarHBondContact O-N 2.94Å; Y117-P122 WeakPolarHBondContact O-CA 3.45Å; Y117-F124 HydrophobicContact CD2-CB 4.46Å; Y117-F125 HydrophobicContact CE2-CE2 4.33Å; Y117-I171 HydrophobicContact CD1-CG2 3.99Å; Y117-I171 HydrophobicContact CE1-CG2 4.41Å; Y117-T174 HydrophobicContact CE1-CG2 4Å; Y117-M175 HydrophobicContact CD1-CG 4.46Å; Y117-M175 HydrophobicContact CE1-CG 3.57Å; Y117-C179 PolarHBondContact OH-SG 2.92Å; Y117-C179 VanDerWaalsContact OH-SG 3.34Å
118	L	89.3	Confident	91.6	Very high	62 Å²	62	36.4 Å²	36.4	33%	0.325	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-16	-176.9	-66.1	177.9	0	0	0	114.4	E116 L170 I171 T174	E116-L118 VanDerWaalsContact C-N 3.33Å; E116-L118 PolarHBondContact O-N 2.93Å; L118-L170 HydrophobicContact CD1-CB 4.26Å; L118-L170 HydrophobicContact CD1-CD2 3.6Å; L118-L170 HydrophobicContact CD1-CG 3.74Å; L118-L170 HydrophobicContact CD2-CG 4.31Å; L118-I171 HydrophobicContact CD1-CG1 3.83Å; L118-I171 HydrophobicContact CD2-CG1 4.3Å; L118-I171 HydrophobicContact CG-CG1 3.89Å; L118-T174 HydrophobicContact CD2-CG2 3.96Å; L118-T174 VanDerWaalsContact CD2-OG1 3.31Å; L118-T174 WeakPolarHBondContact CD2-OG1 3.49Å
119	T	86.9	Confident	91.3	Very high	105 Å²	105	38.9 Å²	38.9	64%	0.644	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.8	-63.5	-169.3	55.4	0	0	0	0	112.9	E116 Y117	E116-T119 PolarHBondContact O-N 3.37Å; Y117-T119 PolarHBondContact O-N 2.94Å
120	K	86.9	Confident	90.9	Very high	89 Å²	89	42.6 Å²	42.6	39%	0.387	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-22.6	-166.8	-66.9	174.6	-175.2	171.4	0	113.4	R80 E116	R80-K120 PolarHBondContact NH1-O 2.99Å; R80-K120 VanDerWaalsContact NH1-O 3.1Å; E116-K120 HydrophobicContact CB-CB 4.14Å; E116-K120 HydrophobicContact CG-CB 4.22Å; E116-K120 HydrophobicContact CG-CD 4.34Å; E116-K120 PolarHBondContact O-N 3.16Å; E116-K120 WeakPolarHBondContact OE1-CD 3.41Å
121	W	91	Very high	90.5	Very high	14 Å²	14	43.9 Å²	43.9	5%	0.053	23%	0.232	C	C	.	.			trans	-137.2	59.9	-177.9	-157.3	1.8	0	0	0	114.2	R80 I84 L112 E116 K123 F124 D127	R80-W121 HydrophobicContact CB-CZ3 4.34Å; R80-W121 HydrophobicContact CG-CD2 4.38Å; R80-W121 HydrophobicContact CG-CE3 3.67Å; R80-W121 HydrophobicContact CG-CH2 4.45Å; R80-W121 HydrophobicContact CG-CZ3 3.73Å; I84-W121 HydrophobicContact CD1-CH2 3.92Å; I84-W121 HydrophobicContact CD1-CZ2 3.84Å; I84-W121 HydrophobicContact CG1-CH2 3.98Å; I84-W121 HydrophobicContact CG1-CZ2 4Å; L112-W121 HydrophobicContact CD2-CE3 4.31Å; L112-W121 HydrophobicContact CD2-CZ3 3.8Å; L112-W121 HydrophobicContact CG-CE3 4.42Å; L112-W121 HydrophobicContact CG-CZ3 4.3Å; E116-W121 HydrophobicContact CB-CB 4.11Å; E116-W121 PolarHBondContact O-N 3.28Å; W121-K123 VanDerWaalsContact C-N 3.25Å; W121-K123 PolarHBondContact O-N 2.93Å; W121-F124 HydrophobicContact CD2-CB 4.31Å; W121-F124 AromaticContact CD2-CD2 3.74Å; W121-F124 HydrophobicContact CD2-CD2 3.74Å; W121-F124 AromaticContact CE2-CD2 3.89Å; W121-F124 AromaticContact CE3-CD2 3.61Å; W121-F124 HydrophobicContact CE3-CD2 3.61Å; W121-F124 HydrophobicContact CE3-CE2 4.16Å; W121-F124 HydrophobicContact CG-CB 4.26Å; W121-F124 HydrophobicContact CG-CD2 4.47Å; W121-F124 AromaticContact CH2-CD2 3.8Å; W121-F124 HydrophobicContact CH2-CD2 3.8Å; W121-F124 AromaticContact CH2-CE2 3.97Å; W121-F124 HydrophobicContact CH2-CE2 3.97Å; W121-F124 AromaticContact CZ2-CD2 3.94Å; W121-F124 HydrophobicContact CZ2-CD2 3.94Å; W121-F124 AromaticContact CZ3-CD2 3.62Å; W121-F124 HydrophobicContact CZ3-CD2 3.62Å; W121-F124 AromaticContact CZ3-CE2 3.77Å; W121-F124 HydrophobicContact CZ3-CE2 3.77Å; W121-F124 WeakPolarHBondContact O-CB 3.46Å; W121-F124 PolarHBondContact O-N 3.25Å; W121-D127 PolarHBondContact NE1-OD2 2.81Å
122	P	87.9	Confident	90.1	Very high	72 Å²	72	43.3 Å²	43.3	47%	0.468	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-22.6	-179.4	27.6	-35.6	0	0	0	113.8	Y117 F124	Y117-P122 WeakPolarHBondContact O-CA 3.45Å; P122-F124 VanDerWaalsContact C-N 3.33Å
123	K	89.8	Confident	89.5	Confident	139 Å²	139	49 Å²	49	60%	0.604	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	14.4	178.6	-66.6	-170.1	178.6	-175.4	0	114.4	W121 F125 F126 D127	W121-K123 VanDerWaalsContact C-N 3.25Å; W121-K123 PolarHBondContact O-N 2.93Å; K123-F125 PolarHBondContact O-N 2.86Å; K123-F126 WeakPolarHBondContact O-CB 3.38Å; K123-F126 PolarHBondContact O-N 2.74Å; K123-D127 PolarHBondContact O-N 2.9Å
124	F	93.8	Very high	88.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-41.5	-55.7	-176	178.2	-95.9	0	0	0	114.6	F109 F113 Y117 W121 P122 F126 D127 I128 I145 I149	F109-F124 HydrophobicContact CB-CZ 4.43Å; F109-F124 HydrophobicContact CD1-CE2 4.14Å; F109-F124 HydrophobicContact CD1-CZ 4.24Å; F113-F124 HydrophobicContact CB-CD2 4.39Å; F113-F124 HydrophobicContact CB-CE1 4.14Å; F113-F124 HydrophobicContact CB-CE2 3.98Å; F113-F124 HydrophobicContact CB-CZ 3.84Å; F113-F124 HydrophobicContact CD2-CB 4.1Å; F113-F124 AromaticContact CD2-CD1 3.39Å; F113-F124 HydrophobicContact CD2-CD1 3.39Å; F113-F124 HydrophobicContact CD2-CD2 4.16Å; F113-F124 AromaticContact CD2-CE1 3.71Å; F113-F124 HydrophobicContact CD2-CE1 3.71Å; F113-F124 HydrophobicContact CD2-CE2 4.42Å; F113-F124 AromaticContact CD2-CG 3.63Å; F113-F124 HydrophobicContact CD2-CG 3.63Å; F113-F124 HydrophobicContact CD2-CZ 4.21Å; F113-F124 HydrophobicContact CE2-CB 4.46Å; F113-F124 AromaticContact CE2-CD1 3.94Å; F113-F124 HydrophobicContact CE2-CD1 3.94Å; F113-F124 HydrophobicContact CE2-CE1 4.48Å; F113-F124 HydrophobicContact CE2-CG 4.33Å; F113-F124 HydrophobicContact CG-CD1 4.3Å; F113-F124 HydrophobicContact CG-CE1 4.18Å; F113-F124 HydrophobicContact CG-CZ 4.38Å; Y117-F124 HydrophobicContact CD2-CB 4.46Å; W121-F124 HydrophobicContact CD2-CB 4.31Å; W121-F124 AromaticContact CD2-CD2 3.74Å; W121-F124 HydrophobicContact CD2-CD2 3.74Å; W121-F124 AromaticContact CE2-CD2 3.89Å; W121-F124 AromaticContact CE3-CD2 3.61Å; W121-F124 HydrophobicContact CE3-CD2 3.61Å; W121-F124 HydrophobicContact CE3-CE2 4.16Å; W121-F124 HydrophobicContact CG-CB 4.26Å; W121-F124 HydrophobicContact CG-CD2 4.47Å; W121-F124 AromaticContact CH2-CD2 3.8Å; W121-F124 HydrophobicContact CH2-CD2 3.8Å; W121-F124 AromaticContact CH2-CE2 3.97Å; W121-F124 HydrophobicContact CH2-CE2 3.97Å; W121-F124 AromaticContact CZ2-CD2 3.94Å; W121-F124 HydrophobicContact CZ2-CD2 3.94Å; W121-F124 AromaticContact CZ3-CD2 3.62Å; W121-F124 HydrophobicContact CZ3-CD2 3.62Å; W121-F124 AromaticContact CZ3-CE2 3.77Å; W121-F124 HydrophobicContact CZ3-CE2 3.77Å; W121-F124 WeakPolarHBondContact O-CB 3.46Å; W121-F124 PolarHBondContact O-N 3.25Å; P122-F124 VanDerWaalsContact C-N 3.33Å; F124-F126 PolarHBondContact O-N 2.86Å; F124-D127 PolarHBondContact O-N 3.36Å; F124-I128 HydrophobicContact CD1-CD1 3.86Å; F124-I128 HydrophobicContact CD2-CD1 4.13Å; F124-I128 HydrophobicContact CE1-CD1 3.34Å; F124-I128 HydrophobicContact CE2-CD1 3.66Å; F124-I128 HydrophobicContact CG-CD1 4.24Å; F124-I128 HydrophobicContact CZ-CD1 3.23Å; F124-I128 WeakPolarHBondContact O-CG1 3.43Å; F124-I128 PolarHBondContact O-N 3.31Å; F124-I128 VanDerWaalsContact O-N 3.08Å; F124-I145 HydrophobicContact CE1-CG2 4.15Å; F124-I145 HydrophobicContact CZ-CG2 4.08Å; F124-I149 HydrophobicContact CE1-CD1 3.82Å; F124-I149 HydrophobicContact CZ-CD1 4.38Å
125	F	92.3	Very high	88.3	Confident	10 Å²	10	54.9 Å²	54.9	4%	0.044	29%	0.29	C	S	.	.	H	α-helix	trans	-66.7	-37.2	-177.8	-65.1	-67.3	0	0	0	113.3	F113 Y117 K123 L129 Y142 L146 I149 M175 C179 L183	F113-F125 HydrophobicContact CD2-CE2 4.44Å; F113-F125 HydrophobicContact CD2-CZ 4.29Å; F113-F125 HydrophobicContact CE2-CD2 4.39Å; F113-F125 AromaticContact CE2-CE2 3.46Å; F113-F125 HydrophobicContact CE2-CE2 3.46Å; F113-F125 VanDerWaalsContact CE2-CE2 3.46Å; F113-F125 AromaticContact CE2-CZ 3.57Å; F113-F125 HydrophobicContact CE2-CZ 3.57Å; F113-F125 AromaticContact CZ-CE2 3.8Å; F113-F125 HydrophobicContact CZ-CE2 3.8Å; F113-F125 AromaticContact CZ-CZ 3.78Å; F113-F125 HydrophobicContact CZ-CZ 3.78Å; Y117-F125 HydrophobicContact CE2-CE2 4.33Å; K123-F125 PolarHBondContact O-N 2.86Å; F125-L129 VanDerWaalsContact O-CB 3.29Å; F125-L129 WeakPolarHBondContact O-CB 3.29Å; F125-L129 VanDerWaalsContact O-CG 3.29Å; F125-L129 WeakPolarHBondContact O-CG 3.46Å; F125-L129 PolarHBondContact O-N 3.3Å; F125-Y142 HydrophobicContact CD1-CE2 4.43Å; F125-L146 HydrophobicContact CD1-CD2 4.17Å; F125-L146 HydrophobicContact CE1-CD2 3.54Å; F125-L146 HydrophobicContact CZ-CD2 4.4Å; F125-I149 HydrophobicContact CE1-CD1 3.91Å; F125-I149 HydrophobicContact CZ-CD1 4Å; F125-M175 HydrophobicContact CE2-CE 3.75Å; F125-M175 HydrophobicContact CZ-CE 3.6Å; F125-C179 HydrophobicContact CD2-CB 3.99Å; F125-L183 HydrophobicContact CB-CD2 3.9Å; F125-L183 HydrophobicContact CD1-CD1 4.39Å; F125-L183 HydrophobicContact CD1-CD2 3.71Å; F125-L183 HydrophobicContact CD2-CD1 4.41Å; F125-L183 HydrophobicContact CD2-CD2 4.35Å; F125-L183 HydrophobicContact CE1-CD1 4.3Å; F125-L183 HydrophobicContact CE1-CD2 4.35Å; F125-L183 HydrophobicContact CE2-CD1 4.31Å; F125-L183 HydrophobicContact CG-CD1 4.46Å; F125-L183 HydrophobicContact CG-CD2 3.72Å; F125-L183 HydrophobicContact CZ-CD1 4.25Å
126	F	89.8	Confident	88.1	Confident	143 Å²	143	54.6 Å²	54.6	63%	0.627	29%	0.29	S	S	*	.	H	α-helix	trans	-64.6	-44.6	177.5	178.4	-91.8	0	0	0	110.7	K123 F124 L129 S130	K123-F126 WeakPolarHBondContact O-CB 3.38Å; K123-F126 PolarHBondContact O-N 2.74Å; F124-F126 PolarHBondContact O-N 2.86Å; F126-L129 PolarHBondContact O-N 2.91Å; F126-S130 VanDerWaalsContact O-CB 3.28Å; F126-S130 WeakPolarHBondContact O-CB 3.49Å; F126-S130 PolarHBondContact O-N 3.48Å; F126-S130 PolarHBondContact O-OG 3.28Å
127	D	90.4	Very high	87.8	Confident	51 Å²	51	59.3 Å²	59.3	27%	0.273	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-42.9	179.9	-61.6	-23.1	0	0	0	110.9	W121 K123 F124 S130 V131	W121-D127 PolarHBondContact NE1-OD2 2.81Å; K123-D127 PolarHBondContact O-N 2.9Å; F124-D127 PolarHBondContact O-N 3.36Å; D127-S130 PolarHBondContact O-N 3.17Å; D127-S130 PolarHBondContact O-OG 3.02Å; D127-V131 WeakPolarHBondContact O-CG2 3.42Å; D127-V131 PolarHBondContact O-N 3.04Å
128	I	91.2	Very high	87.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-49.8	176.6	-68.9	173.5	0	0	0	111.4	I84 L87 F109 F124 S130 V131 V132 Y142 I145	I84-I128 HydrophobicContact CD1-CG1 4.4Å; L87-I128 HydrophobicContact CD2-CG1 4.42Å; L87-I128 HydrophobicContact CD2-CG2 4.19Å; F109-I128 HydrophobicContact CD1-CD1 4.21Å; F109-I128 HydrophobicContact CE1-CD1 4.38Å; F124-I128 HydrophobicContact CD1-CD1 3.86Å; F124-I128 HydrophobicContact CD2-CD1 4.13Å; F124-I128 HydrophobicContact CE1-CD1 3.34Å; F124-I128 HydrophobicContact CE2-CD1 3.66Å; F124-I128 HydrophobicContact CG-CD1 4.24Å; F124-I128 HydrophobicContact CZ-CD1 3.23Å; F124-I128 WeakPolarHBondContact O-CG1 3.43Å; F124-I128 PolarHBondContact O-N 3.31Å; F124-I128 VanDerWaalsContact O-N 3.08Å; I128-S130 VanDerWaalsContact C-N 3.26Å; I128-S130 PolarHBondContact O-N 3.43Å; I128-V131 PolarHBondContact O-N 3.02Å; I128-V131 VanDerWaalsContact O-N 3.1Å; I128-V132 HydrophobicContact CG2-CG2 4.19Å; I128-V132 WeakPolarHBondContact O-CB 3.47Å; I128-V132 WeakPolarHBondContact O-CG2 3.38Å; I128-V132 PolarHBondContact O-N 3.24Å; I128-Y142 HydrophobicContact CG2-CD2 3.89Å; I128-I145 HydrophobicContact CD1-CD1 4.33Å
129	L	88.4	Confident	87.6	Confident	51 Å²	51	56.3 Å²	56.3	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-34.7	179.3	-75.8	170	0	0	0	111.9	F125 F126 V131 V132 D133 Y142	F125-L129 VanDerWaalsContact O-CB 3.29Å; F125-L129 WeakPolarHBondContact O-CB 3.29Å; F125-L129 VanDerWaalsContact O-CG 3.29Å; F125-L129 WeakPolarHBondContact O-CG 3.46Å; F125-L129 PolarHBondContact O-N 3.3Å; F126-L129 PolarHBondContact O-N 2.91Å; L129-V131 VanDerWaalsContact C-N 3.26Å; L129-V131 PolarHBondContact O-N 3.03Å; L129-V132 PolarHBondContact O-N 3.25Å; L129-D133 PolarHBondContact O-N 3.03Å; L129-Y142 HydrophobicContact CD2-CD1 4.16Å; L129-Y142 HydrophobicContact CD2-CD2 4.17Å; L129-Y142 HydrophobicContact CD2-CE1 3.84Å; L129-Y142 HydrophobicContact CD2-CE2 3.86Å; L129-Y142 HydrophobicContact CD2-CG 4.3Å; L129-Y142 HydrophobicContact CG-CE2 4.02Å
130	S	88.1	Confident	87.8	Confident	78 Å²	78	51.6 Å²	51.6	55%	0.545	26%	0.263	S	S	.	.	H	α-helix	trans	-65.9	-27.1	176.7	76.6	0	0	0	0	113.8	F126 D127 I128	F126-S130 VanDerWaalsContact O-CB 3.28Å; F126-S130 WeakPolarHBondContact O-CB 3.49Å; F126-S130 PolarHBondContact O-N 3.48Å; F126-S130 PolarHBondContact O-OG 3.28Å; D127-S130 PolarHBondContact O-N 3.17Å; D127-S130 PolarHBondContact O-OG 3.02Å; I128-S130 VanDerWaalsContact C-N 3.26Å; I128-S130 PolarHBondContact O-N 3.43Å
131	V	86.3	Confident	88.1	Confident	28 Å²	28	47.6 Å²	47.6	17%	0.17	25%	0.246	C	C	.	.	H	α-helix	trans	-86.2	-41.1	177.3	171.9	0	0	0	0	111.3	I84 L87 Q88 M91 D127 I128 L129	I84-V131 HydrophobicContact CG2-CG2 4.39Å; L87-V131 HydrophobicContact CB-CG1 4.49Å; L87-V131 HydrophobicContact CD2-CB 4.14Å; L87-V131 HydrophobicContact CD2-CG1 3.94Å; L87-V131 HydrophobicContact CG-CB 4.5Å; L87-V131 HydrophobicContact CG-CG1 3.76Å; Q88-V131 HydrophobicContact CB-CG1 4.22Å; Q88-V131 HydrophobicContact CG-CB 4.35Å; Q88-V131 HydrophobicContact CG-CG1 3.48Å; Q88-V131 VanDerWaalsContact CG-CG1 3.48Å; Q88-V131 HydrophobicContact CG-CG2 3.86Å; M91-V131 HydrophobicContact CG-CG1 4.31Å; D127-V131 WeakPolarHBondContact O-CG2 3.42Å; D127-V131 PolarHBondContact O-N 3.04Å; I128-V131 PolarHBondContact O-N 3.02Å; I128-V131 VanDerWaalsContact O-N 3.1Å; L129-V131 VanDerWaalsContact C-N 3.26Å; L129-V131 PolarHBondContact O-N 3.03Å
132	V	85.1	Confident	88.3	Confident	1 Å²	1	47 Å²	47	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-73.4	-42	-176.2	160.6	0	0	0	0	111.8	L87 I128 L129 N135 G138 V139	L87-V132 HydrophobicContact CD1-CG2 4.13Å; L87-V132 HydrophobicContact CD2-CG2 4.3Å; I128-V132 HydrophobicContact CG2-CG2 4.19Å; I128-V132 WeakPolarHBondContact O-CB 3.47Å; I128-V132 WeakPolarHBondContact O-CG2 3.38Å; I128-V132 PolarHBondContact O-N 3.24Å; L129-V132 PolarHBondContact O-N 3.25Å; V132-N135 VanDerWaalsContact O-CB 3.25Å; V132-N135 WeakPolarHBondContact O-CB 3.43Å; V132-N135 PolarHBondContact O-N 3.11Å; V132-N135 VanDerWaalsContact O-N 3.17Å; V132-G138 WeakPolarHBondContact CG1-O 3.32Å; V132-G138 WeakPolarHBondContact CG2-O 3.38Å; V132-V139 HydrophobicContact CG1-CG2 3.93Å; V132-V139 VanDerWaalsContact CG1-N 3.28Å
133	D	80.6	Confident	88.6	Confident	121 Å²	121	43.7 Å²	43.7	65%	0.647	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.8	-149.4	-172.4	-165.5	11.3	0	0	0	111.5	L129 N135	L129-D133 PolarHBondContact O-N 3.03Å; D133-N135 PolarHBondContact O-N 3.29Å
134	L	77.8	Confident	88.9	Confident	80 Å²	80	38.9 Å²	38.9	42%	0.419	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	36.3	170.6	-65.5	171.8	0	0	0	112.3	N193 Y194	L134-N193 WeakPolarHBondContact CD1-ND2 3.41Å; L134-N193 VanDerWaalsContact CD2-ND2 3.31Å; L134-N193 WeakPolarHBondContact CD2-ND2 3.33Å; L134-Y194 PolarHBondContact O-OH 3.48Å
135	N	84.6	Confident	89	Confident	49 Å²	49	39 Å²	39	26%	0.262	20%	0.2	S	C	.	.			trans	-84	122	170.8	-173.8	-39.6	0	0	0	109.9	M91 V132 D133 R137 G138 V139	M91-N135 HydrophobicContact SD-CB 4.05Å; V132-N135 VanDerWaalsContact O-CB 3.25Å; V132-N135 WeakPolarHBondContact O-CB 3.43Å; V132-N135 PolarHBondContact O-N 3.11Å; V132-N135 VanDerWaalsContact O-N 3.17Å; D133-N135 PolarHBondContact O-N 3.29Å; N135-R137 PolarHBondContact O-N 2.75Å; N135-R137 PolarHBondContact OD1-N 3.4Å; N135-R137 VanDerWaalsContact OD1-N 3.09Å; N135-G138 PolarHBondContact O-N 3.32Å; N135-V139 WeakPolarHBondContact O-CG2 3.45Å; N135-V139 PolarHBondContact O-N 2.98Å
136	P	84.9	Confident	89.2	Confident	50 Å²	50	38.5 Å²	38.5	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-54	-33.7	-175.1	-18.4	21.5	0	0	0	113.9	D140 Y194	P136-D140 PolarHBondContact O-N 3.45Å; P136-Y194 HydrophobicContact CB-CE1 4.04Å; P136-Y194 WeakPolarHBondContact CD-OH 3.3Å; P136-Y194 HydrophobicContact CG-CE1 3.7Å; P136-Y194 WeakPolarHBondContact CG-OH 3.36Å
137	R	84.9	Confident	89.4	Confident	100 Å²	100	34.4 Å²	34.4	38%	0.377	18%	0.181	S	C	.	.	H	α-helix	trans	-78.3	-36.1	-178.1	-51.3	-178.2	-155.1	176.7	1.6	112.4	N93 P94 N135 V139 L141	N93-R137 PolarHBondContact O-NH1 3.07Å; P94-R137 VanDerWaalsContact C-NH1 3.26Å; P94-R137 PolarHBondContact O-NH1 3.24Å; P94-R137 PolarHBondContact O-NH2 3.24Å; N135-R137 PolarHBondContact O-N 2.75Å; N135-R137 PolarHBondContact OD1-N 3.4Å; N135-R137 VanDerWaalsContact OD1-N 3.09Å; R137-V139 VanDerWaalsContact C-N 3.3Å; R137-L141 PolarHBondContact O-N 3.11Å
138	G	88.1	Confident	89.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.8	-40.3	172.6	0	0	0	0	0	110.1	M91 V132 N135 L141 Y142	M91-G138 WeakPolarHBondContact SD-CA 3.26Å; V132-G138 WeakPolarHBondContact CG1-O 3.32Å; V132-G138 WeakPolarHBondContact CG2-O 3.38Å; N135-G138 PolarHBondContact O-N 3.32Å; G138-L141 PolarHBondContact O-N 2.92Å; G138-Y142 WeakPolarHBondContact O-CB 3.36Å; G138-Y142 PolarHBondContact O-N 3.21Å
139	V	91.4	Very high	89.8	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-46.4	178	175.5	0	0	0	0	110.7	V132 N135 R137 L141 Y142 L143 I190 Y194 V201	V132-V139 HydrophobicContact CG1-CG2 3.93Å; V132-V139 VanDerWaalsContact CG1-N 3.28Å; N135-V139 WeakPolarHBondContact O-CG2 3.45Å; N135-V139 PolarHBondContact O-N 2.98Å; R137-V139 VanDerWaalsContact C-N 3.3Å; V139-L141 VanDerWaalsContact C-N 3.3Å; V139-L141 PolarHBondContact O-N 3.3Å; V139-Y142 WeakPolarHBondContact O-CB 3.32Å; V139-Y142 PolarHBondContact O-N 2.82Å; V139-Y142 VanDerWaalsContact O-N 3.16Å; V139-L143 HydrophobicContact CG1-CD1 3.91Å; V139-L143 HydrophobicContact CG1-CG 4.21Å; V139-L143 VanDerWaalsContact O-CG 3.29Å; V139-L143 WeakPolarHBondContact O-CG 3.26Å; V139-L143 PolarHBondContact O-N 2.79Å; V139-I190 HydrophobicContact CG1-CB 4.45Å; V139-I190 HydrophobicContact CG1-CD1 3.73Å; V139-I190 HydrophobicContact CG1-CG1 3.84Å; V139-I190 HydrophobicContact CG1-CG2 3.73Å; V139-I190 HydrophobicContact CG2-CG1 4.43Å; V139-Y194 HydrophobicContact CG2-CE2 4.34Å; V139-V201 HydrophobicContact CB-CG1 4.32Å; V139-V201 HydrophobicContact CG1-CG1 3.56Å
140	D	91.4	Very high	90	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.032	17%	0.166	C	C	.	.	H	α-helix	trans	-52.4	-47.3	172.6	163.9	98.8	0	0	0	111.8	R102 P136 L143 R144 V201 Q204	R102-D140 IonicContact CZ-OD2 3.03Å; R102-D140 IonicContact NE-OD2 3.92Å; R102-D140 IonicContact NH1-OD1 3.64Å; R102-D140 PolarHBondContact NH1-OD1 3.43Å; R102-D140 VanDerWaalsContact NH1-OD1 3.15Å; R102-D140 IonicContact NH1-OD2 2.95Å; R102-D140 PolarHBondContact NH1-OD2 3.25Å; P136-D140 PolarHBondContact O-N 3.45Å; D140-L143 PolarHBondContact O-N 2.98Å; D140-R144 VanDerWaalsContact O-CG 3.31Å; D140-R144 WeakPolarHBondContact O-CG 3.5Å; D140-R144 PolarHBondContact O-N 3.11Å; D140-R144 IonicContact OD1-CZ 3.31Å; D140-R144 IonicContact OD1-NE 3.23Å; D140-R144 PolarHBondContact OD1-NE 3.22Å; D140-R144 VanDerWaalsContact OD1-NE 3.09Å; D140-R144 IonicContact OD1-NH2 3.75Å; D140-R144 PolarHBondContact OD1-NH2 2.75Å; D140-R144 IonicContact OD2-CZ 2.86Å; D140-R144 IonicContact OD2-NE 3.9Å; D140-R144 PolarHBondContact OD2-NE 3.21Å; D140-R144 IonicContact OD2-NH2 3.65Å; D140-V201 HydrophobicContact CB-CG2 4.45Å; D140-Q204 PolarHBondContact OD1-NE2 3Å; D140-Q204 PolarHBondContact OD1-OE1 2.97Å; D140-Q204 VanDerWaalsContact OD1-OE1 3.11Å
141	L	91.9	Very high	90.1	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-68.8	-37.7	179.7	-175.1	59.2	0	0	0	112.5	W86 L87 R102 R137 G138 V139 R144 I145	W86-L141 HydrophobicContact CH2-CD2 4.19Å; W86-L141 HydrophobicContact CZ3-CD2 3.59Å; L87-L141 HydrophobicContact CD1-CD2 3.33Å; L87-L141 HydrophobicContact CD1-CG 4.23Å; R102-L141 HydrophobicContact CB-CD1 4.26Å; R137-L141 PolarHBondContact O-N 3.11Å; G138-L141 PolarHBondContact O-N 2.92Å; V139-L141 VanDerWaalsContact C-N 3.3Å; V139-L141 PolarHBondContact O-N 3.3Å; L141-R144 PolarHBondContact O-N 3.33Å; L141-I145 HydrophobicContact CG-CD1 4.22Å; L141-I145 WeakPolarHBondContact O-CD1 3.46Å; L141-I145 VanDerWaalsContact O-CG1 3.22Å; L141-I145 WeakPolarHBondContact O-CG1 3.41Å; L141-I145 PolarHBondContact O-N 3.12Å
142	Y	94.9	Very high	90.2	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-45.8	174.2	166.3	-111.3	0	0	0	111.7	F125 I128 L129 G138 V139 I145 L146 L183 S186 I190	F125-Y142 HydrophobicContact CD1-CE2 4.43Å; I128-Y142 HydrophobicContact CG2-CD2 3.89Å; L129-Y142 HydrophobicContact CD2-CD1 4.16Å; L129-Y142 HydrophobicContact CD2-CD2 4.17Å; L129-Y142 HydrophobicContact CD2-CE1 3.84Å; L129-Y142 HydrophobicContact CD2-CE2 3.86Å; L129-Y142 HydrophobicContact CD2-CG 4.3Å; L129-Y142 HydrophobicContact CG-CE2 4.02Å; G138-Y142 WeakPolarHBondContact O-CB 3.36Å; G138-Y142 PolarHBondContact O-N 3.21Å; V139-Y142 WeakPolarHBondContact O-CB 3.32Å; V139-Y142 PolarHBondContact O-N 2.82Å; V139-Y142 VanDerWaalsContact O-N 3.16Å; Y142-I145 WeakPolarHBondContact O-CB 3.45Å; Y142-I145 PolarHBondContact O-N 2.98Å; Y142-L146 HydrophobicContact CD1-CD1 4.38Å; Y142-L146 HydrophobicContact CE1-CD1 3.75Å; Y142-L146 HydrophobicContact CE2-CD1 4.06Å; Y142-L146 HydrophobicContact CE2-CD2 4.23Å; Y142-L146 HydrophobicContact CE2-CG 4.13Å; Y142-L146 WeakPolarHBondContact O-CG 3.39Å; Y142-L146 PolarHBondContact O-N 2.96Å; Y142-L183 WeakPolarHBondContact OH-CD2 3.44Å; Y142-S186 PolarHBondContact OH-OG 2.92Å; Y142-I190 HydrophobicContact CD1-CD1 4.23Å; Y142-I190 HydrophobicContact CE1-CD1 4.11Å
143	L	95.5	Very high	90.3	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-41.3	177.4	-65.4	172.5	0	0	0	111.5	V139 D140 I145 L146 M147 I190 V201 Q204 C205 V208	V139-L143 HydrophobicContact CG1-CD1 3.91Å; V139-L143 HydrophobicContact CG1-CG 4.21Å; V139-L143 VanDerWaalsContact O-CG 3.29Å; V139-L143 WeakPolarHBondContact O-CG 3.26Å; V139-L143 PolarHBondContact O-N 2.79Å; D140-L143 PolarHBondContact O-N 2.98Å; L143-I145 VanDerWaalsContact C-N 3.32Å; L143-I145 PolarHBondContact O-N 3.43Å; L143-L146 HydrophobicContact CD2-CD1 4.46Å; L143-L146 WeakPolarHBondContact O-CB 3.33Å; L143-L146 PolarHBondContact O-N 3.06Å; L143-L146 VanDerWaalsContact O-N 3.16Å; L143-M147 PolarHBondContact O-N 3.35Å; L143-I190 HydrophobicContact CD2-CD1 4.46Å; L143-V201 HydrophobicContact CD1-CG1 4.15Å; L143-Q204 HydrophobicContact CB-CB 4.48Å; L143-Q204 HydrophobicContact CD1-CB 3.91Å; L143-C205 HydrophobicContact CD1-CB 3.84Å; L143-C205 HydrophobicContact CD2-CB 4.1Å; L143-V208 HydrophobicContact CB-CG2 4.09Å; L143-V208 HydrophobicContact CD2-CB 4.31Å; L143-V208 HydrophobicContact CD2-CG1 4.44Å; L143-V208 HydrophobicContact CD2-CG2 4.03Å
144	R	95.6	Very high	90.4	Very high	38 Å²	38	27.3 Å²	27.3	14%	0.143	14%	0.142	C	C	.	.	H	α-helix	trans	-61.2	-38.5	172.8	-69.7	172.7	-168.3	-71	-14.1	112.8	N103 A106 D140 L141 L146 M147 A148	N103-R144 WeakPolarHBondContact OD1-CD 3.24Å; N103-R144 PolarHBondContact OD1-NH1 3.05Å; A106-R144 HydrophobicContact CB-CB 3.93Å; D140-R144 VanDerWaalsContact O-CG 3.31Å; D140-R144 WeakPolarHBondContact O-CG 3.5Å; D140-R144 PolarHBondContact O-N 3.11Å; D140-R144 IonicContact OD1-CZ 3.31Å; D140-R144 IonicContact OD1-NE 3.23Å; D140-R144 PolarHBondContact OD1-NE 3.22Å; D140-R144 VanDerWaalsContact OD1-NE 3.09Å; D140-R144 IonicContact OD1-NH2 3.75Å; D140-R144 PolarHBondContact OD1-NH2 2.75Å; D140-R144 IonicContact OD2-CZ 2.86Å; D140-R144 IonicContact OD2-NE 3.9Å; D140-R144 PolarHBondContact OD2-NE 3.21Å; D140-R144 IonicContact OD2-NH2 3.65Å; L141-R144 PolarHBondContact O-N 3.33Å; R144-L146 VanDerWaalsContact C-N 3.34Å; R144-M147 PolarHBondContact O-N 3.38Å; R144-A148 WeakPolarHBondContact O-CB 3.45Å; R144-A148 PolarHBondContact O-N 2.99Å
145	I	95.6	Very high	90.5	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-42.5	174.9	-70.1	162.7	0	0	0	110.2	A106 F109 F124 I128 L141 Y142 L143 A148 I149	A106-I145 HydrophobicContact CB-CG1 3.96Å; F109-I145 HydrophobicContact CB-CD1 4.17Å; F109-I145 HydrophobicContact CB-CG1 3.95Å; F109-I145 HydrophobicContact CB-CG2 4.13Å; F109-I145 HydrophobicContact CD1-CD1 4.34Å; F109-I145 HydrophobicContact CD2-CD1 3.85Å; F109-I145 HydrophobicContact CD2-CG1 4.22Å; F109-I145 HydrophobicContact CE2-CD1 4.29Å; F109-I145 HydrophobicContact CG-CD1 3.88Å; F109-I145 HydrophobicContact CG-CG1 4.19Å; F124-I145 HydrophobicContact CE1-CG2 4.15Å; F124-I145 HydrophobicContact CZ-CG2 4.08Å; I128-I145 HydrophobicContact CD1-CD1 4.33Å; L141-I145 HydrophobicContact CG-CD1 4.22Å; L141-I145 WeakPolarHBondContact O-CD1 3.46Å; L141-I145 VanDerWaalsContact O-CG1 3.22Å; L141-I145 WeakPolarHBondContact O-CG1 3.41Å; L141-I145 PolarHBondContact O-N 3.12Å; Y142-I145 WeakPolarHBondContact O-CB 3.45Å; Y142-I145 PolarHBondContact O-N 2.98Å; L143-I145 VanDerWaalsContact C-N 3.32Å; L143-I145 PolarHBondContact O-N 3.43Å; I145-A148 PolarHBondContact O-N 3.37Å; I145-I149 HydrophobicContact CG2-CD1 3.83Å; I145-I149 HydrophobicContact CG2-CG1 4.42Å; I145-I149 VanDerWaalsContact O-CG1 3.28Å; I145-I149 WeakPolarHBondContact O-CG1 3.32Å; I145-I149 PolarHBondContact O-N 3.18Å
146	L	95.8	Very high	90	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-46.9	176.3	-67.3	177.7	0	0	0	112	F125 Y142 L143 R144 A148 I149 D150 L183 W187 V208 Y212	F125-L146 HydrophobicContact CD1-CD2 4.17Å; F125-L146 HydrophobicContact CE1-CD2 3.54Å; F125-L146 HydrophobicContact CZ-CD2 4.4Å; Y142-L146 HydrophobicContact CD1-CD1 4.38Å; Y142-L146 HydrophobicContact CE1-CD1 3.75Å; Y142-L146 HydrophobicContact CE2-CD1 4.06Å; Y142-L146 HydrophobicContact CE2-CD2 4.23Å; Y142-L146 HydrophobicContact CE2-CG 4.13Å; Y142-L146 WeakPolarHBondContact O-CG 3.39Å; Y142-L146 PolarHBondContact O-N 2.96Å; L143-L146 HydrophobicContact CD2-CD1 4.46Å; L143-L146 WeakPolarHBondContact O-CB 3.33Å; L143-L146 PolarHBondContact O-N 3.06Å; L143-L146 VanDerWaalsContact O-N 3.16Å; R144-L146 VanDerWaalsContact C-N 3.34Å; L146-A148 VanDerWaalsContact C-N 3.31Å; L146-A148 PolarHBondContact O-N 2.93Å; L146-I149 PolarHBondContact O-N 3.17Å; L146-I149 VanDerWaalsContact O-N 3.14Å; L146-D150 PolarHBondContact O-N 3Å; L146-L183 HydrophobicContact CD2-CD1 4.46Å; L146-W187 HydrophobicContact CD1-CZ2 4.14Å; L146-V208 HydrophobicContact CB-CG1 3.99Å; L146-V208 HydrophobicContact CB-CG2 4.29Å; L146-V208 HydrophobicContact CD1-CG1 3.69Å; L146-Y212 WeakPolarHBondContact CA-OH 3.49Å; L146-Y212 HydrophobicContact CB-CE2 3.96Å; L146-Y212 WeakPolarHBondContact CD2-OH 3.49Å; L146-Y212 PolarHBondContact O-OH 2.81Å
147	M	95.4	Very high	89.5	Confident	57 Å²	57	40 Å²	40	28%	0.281	19%	0.19	S	C	.	.	H	α-helix	trans	-60.4	-40.1	175.8	-71	-53.8	-67.7	0	0	112.7	L143 R144 I149 D150 S151 V208 A211	L143-M147 PolarHBondContact O-N 3.35Å; R144-M147 PolarHBondContact O-N 3.38Å; M147-I149 VanDerWaalsContact C-N 3.35Å; M147-D150 PolarHBondContact O-N 3.1Å; M147-S151 PolarHBondContact O-N 2.89Å; M147-S151 PolarHBondContact O-OG 3.42Å; M147-V208 HydrophobicContact CG-CG2 3.61Å; M147-V208 HydrophobicContact SD-CB 4.31Å; M147-V208 HydrophobicContact SD-CG2 3.69Å; M147-A211 HydrophobicContact CE-CB 4.07Å; M147-A211 HydrophobicContact SD-CB 3.96Å
148	A	95.1	Very high	89.1	Confident	13 Å²	13	38.2 Å²	38.2	11%	0.107	19%	0.19	C	C	.	.	H	α-helix	trans	-66.3	-35.7	175.8	0	0	0	0	0	112.5	A106 A110 R144 I145 L146 E152	A106-A148 HydrophobicContact CB-CB 4.27Å; A110-A148 HydrophobicContact CB-CB 3.71Å; R144-A148 WeakPolarHBondContact O-CB 3.45Å; R144-A148 PolarHBondContact O-N 2.99Å; I145-A148 PolarHBondContact O-N 3.37Å; L146-A148 VanDerWaalsContact C-N 3.31Å; L146-A148 PolarHBondContact O-N 2.93Å; A148-E152 WeakPolarHBondContact O-CG 3.48Å; A148-E152 PolarHBondContact O-N 3.24Å
149	I	94.6	Very high	88.4	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-44	174.1	-72.4	168.1	0	0	0	110.8	A110 F113 F124 F125 I145 L146 M147 S151 E152 L153	A110-I149 HydrophobicContact CB-CG1 3.82Å; F113-I149 HydrophobicContact CB-CD1 4.25Å; F113-I149 HydrophobicContact CB-CG1 4.4Å; F113-I149 HydrophobicContact CD1-CB 4.46Å; F113-I149 HydrophobicContact CD1-CD1 3.84Å; F113-I149 HydrophobicContact CD1-CG1 3.82Å; F113-I149 HydrophobicContact CD1-CG2 3.81Å; F113-I149 HydrophobicContact CD2-CD1 4.26Å; F113-I149 HydrophobicContact CE1-CD1 4.27Å; F113-I149 HydrophobicContact CE1-CG1 4.41Å; F113-I149 HydrophobicContact CE1-CG2 3.63Å; F113-I149 HydrophobicContact CG-CD1 3.85Å; F113-I149 HydrophobicContact CG-CG1 4.18Å; F113-I149 HydrophobicContact CZ-CG2 4.49Å; F124-I149 HydrophobicContact CE1-CD1 3.82Å; F124-I149 HydrophobicContact CZ-CD1 4.38Å; F125-I149 HydrophobicContact CE1-CD1 3.91Å; F125-I149 HydrophobicContact CZ-CD1 4Å; I145-I149 HydrophobicContact CG2-CD1 3.83Å; I145-I149 HydrophobicContact CG2-CG1 4.42Å; I145-I149 VanDerWaalsContact O-CG1 3.28Å; I145-I149 WeakPolarHBondContact O-CG1 3.32Å; I145-I149 PolarHBondContact O-N 3.18Å; L146-I149 PolarHBondContact O-N 3.17Å; L146-I149 VanDerWaalsContact O-N 3.14Å; M147-I149 VanDerWaalsContact C-N 3.35Å; I149-S151 VanDerWaalsContact C-N 3.34Å; I149-S151 PolarHBondContact O-N 3.47Å; I149-E152 PolarHBondContact O-N 3.13Å; I149-L153 HydrophobicContact CG2-CD1 3.63Å; I149-L153 HydrophobicContact CG2-CG 4.36Å; I149-L153 WeakPolarHBondContact O-CB 3.29Å; I149-L153 VanDerWaalsContact O-CG 3.3Å; I149-L153 WeakPolarHBondContact O-CG 3.07Å; I149-L153 PolarHBondContact O-N 3.21Å
150	D	92.6	Very high	87.8	Confident	20 Å²	20	47.4 Å²	47.4	11%	0.107	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-43.9	177.8	-167.9	76.7	0	0	0	111.4	L146 M147 E152 L153 V154 Y212 W215	L146-D150 PolarHBondContact O-N 3Å; M147-D150 PolarHBondContact O-N 3.1Å; D150-E152 VanDerWaalsContact C-N 3.28Å; D150-E152 PolarHBondContact O-N 3.47Å; D150-L153 PolarHBondContact O-N 2.87Å; D150-L153 VanDerWaalsContact O-N 3.11Å; D150-V154 WeakPolarHBondContact O-CB 3.37Å; D150-V154 PolarHBondContact O-N 3.47Å; D150-V154 WeakPolarHBondContact OD1-CG2 3.39Å; D150-Y212 HydrophobicContact CB-CE2 3.97Å; D150-W215 PolarHBondContact OD1-NE1 3.5Å
151	S	90.9	Very high	87.4	Confident	53 Å²	53	50.8 Å²	50.8	37%	0.371	26%	0.263	S	S	.	.	H	α-helix	trans	-58	-35.8	176.7	-55.3	0	0	0	0	113.1	M147 I149 D155	M147-S151 PolarHBondContact O-N 2.89Å; M147-S151 PolarHBondContact O-OG 3.42Å; I149-S151 VanDerWaalsContact C-N 3.34Å; I149-S151 PolarHBondContact O-N 3.47Å; S151-D155 WeakPolarHBondContact O-CB 3.24Å
152	E	88.1	Confident	86.7	Confident	58 Å²	58	56 Å²	56	27%	0.271	30%	0.3	S	S	.	.	H	α-helix	trans	-83	-19	179.6	-69.8	-71.1	155.3	0	0	113.8	A110 V114 A148 I149 D150 H160 N168	A110-E152 HydrophobicContact CB-CG 4.45Å; V114-E152 HydrophobicContact CG2-CB 4.02Å; A148-E152 WeakPolarHBondContact O-CG 3.48Å; A148-E152 PolarHBondContact O-N 3.24Å; I149-E152 PolarHBondContact O-N 3.13Å; D150-E152 VanDerWaalsContact C-N 3.28Å; D150-E152 PolarHBondContact O-N 3.47Å; E152-H160 PolarHBondContact O-CE1 3.4Å; E152-N168 PolarHBondContact O-ND2 3.38Å
153	L	87	Confident	86.1	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-111.1	-26.9	-170.7	-69.9	-176.8	0	0	0	115.2	F113 V114 I149 D150 N168 I171 K172 M175	F113-L153 HydrophobicContact CE1-CD1 4.09Å; V114-L153 HydrophobicContact CG2-CD2 3.9Å; V114-L153 HydrophobicContact CG2-CG 4.23Å; I149-L153 HydrophobicContact CG2-CD1 3.63Å; I149-L153 HydrophobicContact CG2-CG 4.36Å; I149-L153 WeakPolarHBondContact O-CB 3.29Å; I149-L153 VanDerWaalsContact O-CG 3.3Å; I149-L153 WeakPolarHBondContact O-CG 3.07Å; I149-L153 PolarHBondContact O-N 3.21Å; D150-L153 PolarHBondContact O-N 2.87Å; D150-L153 VanDerWaalsContact O-N 3.11Å; L153-N168 HydrophobicContact CD2-CB 3.95Å; L153-I171 HydrophobicContact CD1-CG2 3.7Å; L153-I171 HydrophobicContact CD2-CB 4.32Å; L153-I171 HydrophobicContact CD2-CD1 4.02Å; L153-I171 HydrophobicContact CD2-CG2 4.13Å; L153-K172 PolarHBondContact O-NZ 3.49Å; L153-M175 HydrophobicContact CD1-SD 4.27Å
154	V	83.3	Confident	85.6	Confident	33 Å²	33	66.4 Å²	66.4	20%	0.2	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-32.5	-166.5	-175.9	0	0	0	0	112.2	D150 R156 K172 W215	D150-V154 WeakPolarHBondContact O-CB 3.37Å; D150-V154 PolarHBondContact O-N 3.47Å; D150-V154 WeakPolarHBondContact OD1-CG2 3.39Å; V154-R156 PolarHBondContact O-N 3.07Å; V154-K172 HydrophobicContact CG2-CD 3.84Å; V154-W215 HydrophobicContact CG2-CG 4.26Å
155	D	79.3	Confident	85.1	Confident	63 Å²	63	66.7 Å²	66.7	34%	0.337	36%	0.359	S	S	.	.			trans	-52.1	122.6	-179.2	-168	-14.1	0	0	0	110.9	S151 D157 V158	S151-D155 WeakPolarHBondContact O-CB 3.24Å; D155-D157 WeakPolarHBondContact OD1-CB 3.39Å; D155-D157 PolarHBondContact OD1-N 2.91Å; D155-V158 HydrophobicContact CB-CG2 4.09Å
156	R	73.4	Confident	84.8	Confident	234 Å²	234	75.7 Å²	75.7	88%	0.883	39%	0.393	S	S	*	.	S	Bend	trans	-86.3	-15.2	-175.1	-62.8	-175.3	-178.8	-179.3	3.2	112.4	V154 V158	V154-R156 PolarHBondContact O-N 3.07Å; R156-V158 VanDerWaalsContact C-N 3.26Å
157	D	75.1	Confident	84.5	Confident	149 Å²	149	79.5 Å²	79.5	80%	0.797	41%	0.407	S	S	*	.	S	Bend	trans	-79.6	-17	178.2	-64.2	-26.3	0	0	0	111.1	D155 V159	D155-D157 WeakPolarHBondContact OD1-CB 3.39Å; D155-D157 PolarHBondContact OD1-N 2.91Å; D157-V159 PolarHBondContact O-N 3.12Å
158	V	76.7	Confident	84.3	Confident	62 Å²	62	77 Å²	77	38%	0.376	40%	0.395	S	S	.	.	S	Bend	trans	-81.4	112.7	172	-174.8	0	0	0	0	110.1	D155 R156 H160	D155-V158 HydrophobicContact CB-CG2 4.09Å; R156-V158 VanDerWaalsContact C-N 3.26Å; V158-H160 PolarHBondContact O-CD2 3.25Å; V158-H160 PolarHBondContact O-N 3.01Å
159	V	73.8	Confident	84.1	Confident	142 Å²	142	79.7 Å²	79.7	86%	0.861	41%	0.41	S	S	*	.			trans	-71.9	103.3	175.6	-177.5	0	0	0	0	109.6	D157	D157-V159 PolarHBondContact O-N 3.12Å
160	H	78.6	Confident	84.1	Confident	53 Å²	53	84.4 Å²	84.4	25%	0.245	44%	0.435	C	S	.	.			trans	-88.2	141.8	174.8	-63.1	-59.9	0	0	0	112.1	E152 V158 E164 A165	E152-H160 PolarHBondContact O-CE1 3.4Å; V158-H160 PolarHBondContact O-CD2 3.25Å; V158-H160 PolarHBondContact O-N 3.01Å; H160-E164 HydrophobicContact CB-CB 4.05Å; H160-A165 HydrophobicContact CB-CB 4.47Å
161	T	81.4	Confident	84.1	Confident	78 Å²	78	83.4 Å²	83.4	48%	0.479	43%	0.43	S	S	.	.			trans	-63.3	160.1	165.1	62.5	0	0	0	0	110.8	E163 E164 A165	T161-E163 PolarHBondContact O-N 3.01Å; T161-E164 WeakPolarHBondContact CB-OE2 3.49Å; T161-E164 PolarHBondContact N-OE2 3.42Å; T161-E164 PolarHBondContact O-N 2.98Å; T161-E164 WeakPolarHBondContact OG1-CB 3.33Å; T161-E164 VanDerWaalsContact OG1-CD 3.23Å; T161-E164 WeakPolarHBondContact OG1-CG 3.42Å; T161-E164 PolarHBondContact OG1-N 3.45Å; T161-E164 PolarHBondContact OG1-OE2 3.21Å; T161-A165 PolarHBondContact O-N 2.96Å
162	S	78.3	Confident	84.3	Confident	113 Å²	113	82.9 Å²	82.9	79%	0.79	42%	0.421	S	S	*	.	H	α-helix	trans	-60	-30	178.1	-54.7	0	0	0	0	113	R166	S162-R166 PolarHBondContact O-N 3.06Å
163	E	82.3	Confident	84.5	Confident	153 Å²	153	83.1 Å²	83.1	72%	0.715	42%	0.424	S	S	*	.	H	α-helix	trans	-71.5	-44.7	176.4	-62.9	-168	160.2	0	0	112	T161 R166 R167	T161-E163 PolarHBondContact O-N 3.01Å; E163-R166 PolarHBondContact O-N 3.3Å; E163-R167 PolarHBondContact O-N 2.9Å
164	E	85.4	Confident	84.8	Confident	71 Å²	71	84.1 Å²	84.1	33%	0.332	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-44.1	176.7	-72.7	165.7	148.9	0	0	111.6	H160 T161 R166 R167 N168	H160-E164 HydrophobicContact CB-CB 4.05Å; T161-E164 WeakPolarHBondContact CB-OE2 3.49Å; T161-E164 PolarHBondContact N-OE2 3.42Å; T161-E164 PolarHBondContact O-N 2.98Å; T161-E164 WeakPolarHBondContact OG1-CB 3.33Å; T161-E164 VanDerWaalsContact OG1-CD 3.23Å; T161-E164 WeakPolarHBondContact OG1-CG 3.42Å; T161-E164 PolarHBondContact OG1-N 3.45Å; T161-E164 PolarHBondContact OG1-OE2 3.21Å; E164-R166 VanDerWaalsContact C-N 3.28Å; E164-R166 PolarHBondContact O-N 3.01Å; E164-R167 WeakPolarHBondContact O-CB 3.48Å; E164-R167 PolarHBondContact O-N 3.16Å; E164-R167 VanDerWaalsContact O-N 3.15Å; E164-N168 WeakPolarHBondContact O-CB 3.45Å; E164-N168 PolarHBondContact O-N 3.04Å; E164-N168 PolarHBondContact O-OD1 3.46Å
165	A	85.6	Confident	85.3	Confident	44 Å²	44	82.6 Å²	82.6	36%	0.364	42%	0.421	S	S	.	.	H	α-helix	trans	-59.2	-40.3	177	0	0	0	0	0	112.1	H160 T161 T169	H160-A165 HydrophobicContact CB-CB 4.47Å; T161-A165 PolarHBondContact O-N 2.96Å; A165-T169 PolarHBondContact O-N 3Å; A165-T169 PolarHBondContact O-OG1 3.2Å
166	R	87.9	Confident	85.9	Confident	190 Å²	190	84.8 Å²	84.8	72%	0.717	42%	0.424	S	S	*	.	H	α-helix	trans	-65.6	-44.9	175.3	-172.7	-177.1	67.2	156.3	-1.4	111.5	S162 E163 E164 T169 L170	S162-R166 PolarHBondContact O-N 3.06Å; E163-R166 PolarHBondContact O-N 3.3Å; E164-R166 VanDerWaalsContact C-N 3.28Å; E164-R166 PolarHBondContact O-N 3.01Å; R166-T169 PolarHBondContact O-N 3.18Å; R166-L170 PolarHBondContact O-N 3.36Å
167	R	90.1	Very high	86.7	Confident	79 Å²	79	81.3 Å²	81.3	30%	0.298	42%	0.418	S	S	.	.	H	α-helix	trans	-60.4	-48.2	175.9	-179.7	-169.9	63.5	177.8	-6.9	111.2	E163 E164 T169 L170 I171	E163-R167 PolarHBondContact O-N 2.9Å; E164-R167 WeakPolarHBondContact O-CB 3.48Å; E164-R167 PolarHBondContact O-N 3.16Å; E164-R167 VanDerWaalsContact O-N 3.15Å; R167-T169 VanDerWaalsContact C-N 3.27Å; R167-T169 PolarHBondContact O-N 3.31Å; R167-L170 WeakPolarHBondContact O-CB 3.46Å; R167-L170 PolarHBondContact O-N 3.34Å; R167-L170 VanDerWaalsContact O-N 3.1Å; R167-I171 HydrophobicContact CG-CD1 3.9Å; R167-I171 HydrophobicContact CG-CG1 4.44Å; R167-I171 WeakPolarHBondContact O-CG1 3.44Å; R167-I171 PolarHBondContact O-N 2.92Å
168	N	91.4	Very high	87.4	Confident	4 Å²	4	79.3 Å²	79.3	2%	0.021	40%	0.404	C	S	.	.	H	α-helix	trans	-62.5	-36.3	-177.9	-69.6	6.4	0	0	0	111.4	E152 L153 E164 K172	E152-N168 PolarHBondContact O-ND2 3.38Å; L153-N168 HydrophobicContact CD2-CB 3.95Å; E164-N168 WeakPolarHBondContact O-CB 3.45Å; E164-N168 PolarHBondContact O-N 3.04Å; E164-N168 PolarHBondContact O-OD1 3.46Å; N168-K172 WeakPolarHBondContact O-CG 3.09Å; N168-K172 PolarHBondContact O-N 3.38Å; N168-K172 VanDerWaalsContact O-N 3.11Å
169	T	91.1	Very high	88.1	Confident	71 Å²	71	77 Å²	77	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-48.7	172.4	-56.4	0	0	0	0	111.3	A165 R166 R167 I171 K172 D173	A165-T169 PolarHBondContact O-N 3Å; A165-T169 PolarHBondContact O-OG1 3.2Å; R166-T169 PolarHBondContact O-N 3.18Å; R167-T169 VanDerWaalsContact C-N 3.27Å; R167-T169 PolarHBondContact O-N 3.31Å; T169-I171 PolarHBondContact O-N 3.09Å; T169-K172 PolarHBondContact O-N 2.93Å; T169-D173 PolarHBondContact O-N 3.07Å
170	L	93.1	Very high	89.1	Confident	98 Å²	98	70.3 Å²	70.3	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-39.3	179.7	-176.9	61.3	0	0	0	112.9	L118 R166 R167 T174	L118-L170 HydrophobicContact CD1-CB 4.26Å; L118-L170 HydrophobicContact CD1-CD2 3.6Å; L118-L170 HydrophobicContact CD1-CG 3.74Å; L118-L170 HydrophobicContact CD2-CG 4.31Å; R166-L170 PolarHBondContact O-N 3.36Å; R167-L170 WeakPolarHBondContact O-CB 3.46Å; R167-L170 PolarHBondContact O-N 3.34Å; R167-L170 VanDerWaalsContact O-N 3.1Å; L170-T174 WeakPolarHBondContact O-CB 3.47Å; L170-T174 PolarHBondContact O-N 3.11Å; L170-T174 PolarHBondContact O-OG1 2.81Å
171	I	94	Very high	89.8	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60	-50.5	174.5	-69.4	169.3	0	0	0	110.1	F113 V114 Y117 L118 L153 R167 T169 D173 T174 M175	F113-I171 HydrophobicContact CE1-CG2 3.82Å; F113-I171 HydrophobicContact CZ-CG2 4.12Å; V114-I171 HydrophobicContact CG1-CD1 4.23Å; V114-I171 WeakPolarHBondContact O-CD1 3.41Å; Y117-I171 HydrophobicContact CD1-CG2 3.99Å; Y117-I171 HydrophobicContact CE1-CG2 4.41Å; L118-I171 HydrophobicContact CD1-CG1 3.83Å; L118-I171 HydrophobicContact CD2-CG1 4.3Å; L118-I171 HydrophobicContact CG-CG1 3.89Å; L153-I171 HydrophobicContact CD1-CG2 3.7Å; L153-I171 HydrophobicContact CD2-CB 4.32Å; L153-I171 HydrophobicContact CD2-CD1 4.02Å; L153-I171 HydrophobicContact CD2-CG2 4.13Å; R167-I171 HydrophobicContact CG-CD1 3.9Å; R167-I171 HydrophobicContact CG-CG1 4.44Å; R167-I171 WeakPolarHBondContact O-CG1 3.44Å; R167-I171 PolarHBondContact O-N 2.92Å; T169-I171 PolarHBondContact O-N 3.09Å; I171-D173 PolarHBondContact O-N 3.28Å; I171-T174 PolarHBondContact O-N 3.28Å; I171-M175 HydrophobicContact CG2-CG 4.3Å; I171-M175 HydrophobicContact CG2-SD 3.96Å; I171-M175 VanDerWaalsContact O-CG 3.31Å; I171-M175 WeakPolarHBondContact O-CG 3.45Å; I171-M175 PolarHBondContact O-N 3.38Å
172	K	93.8	Very high	90.3	Very high	41 Å²	41	72.4 Å²	72.4	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-43.7	-179.1	-73.4	-175.7	-62.6	-155.3	0	112.5	L153 V154 N168 T169 M175 R176 W215	L153-K172 PolarHBondContact O-NZ 3.49Å; V154-K172 HydrophobicContact CG2-CD 3.84Å; N168-K172 WeakPolarHBondContact O-CG 3.09Å; N168-K172 PolarHBondContact O-N 3.38Å; N168-K172 VanDerWaalsContact O-N 3.11Å; T169-K172 PolarHBondContact O-N 2.93Å; K172-M175 PolarHBondContact O-N 3.15Å; K172-R176 WeakPolarHBondContact O-CG 3.28Å; K172-R176 PolarHBondContact O-N 3.06Å; K172-W215 HydrophobicContact CB-CE3 4.15Å; K172-W215 HydrophobicContact CB-CZ3 4.02Å; K172-W215 HydrophobicContact CD-CD2 4.29Å; K172-W215 HydrophobicContact CD-CE3 4.22Å; K172-W215 HydrophobicContact CG-CE3 4.12Å; K172-W215 HydrophobicContact CG-CH2 4.37Å; K172-W215 HydrophobicContact CG-CZ3 4.03Å
173	D	93.1	Very high	91.1	Very high	64 Å²	64	67.1 Å²	67.1	34%	0.342	33%	0.326	S	S	.	.	H	α-helix	trans	-64.7	-42.4	178	-69.2	-26.1	0	0	0	111.4	T169 I171 M175 R176 E177	T169-D173 PolarHBondContact O-N 3.07Å; I171-D173 PolarHBondContact O-N 3.28Å; D173-M175 VanDerWaalsContact C-N 3.33Å; D173-M175 PolarHBondContact O-N 3.1Å; D173-R176 PolarHBondContact O-N 3.04Å; D173-R176 IonicContact OD1-CZ 3.26Å; D173-R176 IonicContact OD1-NH1 3.79Å; D173-R176 PolarHBondContact OD1-NH1 3.49Å; D173-E177 PolarHBondContact O-N 3.47Å
174	T	93	Very high	91.7	Very high	25 Å²	25	60.1 Å²	60.1	15%	0.153	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-38.2	175.7	-53.8	0	0	0	0	111.8	Y117 L118 L170 I171 E177 Q178	Y117-T174 HydrophobicContact CE1-CG2 4Å; L118-T174 HydrophobicContact CD2-CG2 3.96Å; L118-T174 VanDerWaalsContact CD2-OG1 3.31Å; L118-T174 WeakPolarHBondContact CD2-OG1 3.49Å; L170-T174 WeakPolarHBondContact O-CB 3.47Å; L170-T174 PolarHBondContact O-N 3.11Å; L170-T174 PolarHBondContact O-OG1 2.81Å; I171-T174 PolarHBondContact O-N 3.28Å; T174-E177 PolarHBondContact O-N 3.13Å; T174-Q178 HydrophobicContact CG2-CG 4.36Å; T174-Q178 WeakPolarHBondContact O-CB 3.48Å; T174-Q178 WeakPolarHBondContact O-CG 2.99Å; T174-Q178 PolarHBondContact O-N 3.19Å; T174-Q178 VanDerWaalsContact O-N 3.09Å
175	M	93.8	Very high	92	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-46.6	175.1	-73.2	179.3	72.3	0	0	111.7	F113 Y117 F125 L153 I171 K172 D173 E177 Q178 C179 I180 L183 Y212 W215	F113-M175 HydrophobicContact CE1-SD 3.96Å; F113-M175 HydrophobicContact CZ-CE 4.19Å; F113-M175 HydrophobicContact CZ-CG 4.14Å; F113-M175 HydrophobicContact CZ-SD 3.6Å; Y117-M175 HydrophobicContact CD1-CG 4.46Å; Y117-M175 HydrophobicContact CE1-CG 3.57Å; F125-M175 HydrophobicContact CE2-CE 3.75Å; F125-M175 HydrophobicContact CZ-CE 3.6Å; L153-M175 HydrophobicContact CD1-SD 4.27Å; I171-M175 HydrophobicContact CG2-CG 4.3Å; I171-M175 HydrophobicContact CG2-SD 3.96Å; I171-M175 VanDerWaalsContact O-CG 3.31Å; I171-M175 WeakPolarHBondContact O-CG 3.45Å; I171-M175 PolarHBondContact O-N 3.38Å; K172-M175 PolarHBondContact O-N 3.15Å; D173-M175 VanDerWaalsContact C-N 3.33Å; D173-M175 PolarHBondContact O-N 3.1Å; M175-E177 PolarHBondContact O-N 3.26Å; M175-Q178 PolarHBondContact O-N 3.36Å; M175-C179 VanDerWaalsContact CA-SG 3.57Å; M175-C179 PolarHBondContact O-N 2.98Å; M175-C179 PolarHBondContact O-SG 3.44Å; M175-C179 VanDerWaalsContact O-SG 3.4Å; M175-I180 HydrophobicContact CB-CD1 4.34Å; M175-I180 HydrophobicContact CB-CG1 4.18Å; M175-I180 HydrophobicContact CE-CD1 4.17Å; M175-I180 WeakPolarHBondContact O-CG1 3.4Å; M175-I180 PolarHBondContact O-N 3.3Å; M175-L183 HydrophobicContact CE-CD1 4.35Å; M175-Y212 HydrophobicContact CE-CE1 4.3Å; M175-W215 HydrophobicContact CB-CH2 4.25Å; M175-W215 HydrophobicContact CB-CZ3 4.38Å; M175-W215 HydrophobicContact CE-CH2 3.84Å; M175-W215 HydrophobicContact CE-CZ2 4.42Å; M175-W215 HydrophobicContact SD-CH2 3.9Å
176	R	92.9	Very high	92.4	Very high	109 Å²	109	58.4 Å²	58.4	41%	0.411	28%	0.28	S	S	.	.	H	α-helix	trans	-55.7	-40.4	179.3	-73.6	171.8	-179.6	160.3	-5.6	112	K172 D173 W215	K172-R176 WeakPolarHBondContact O-CG 3.28Å; K172-R176 PolarHBondContact O-N 3.06Å; D173-R176 PolarHBondContact O-N 3.04Å; D173-R176 IonicContact OD1-CZ 3.26Å; D173-R176 IonicContact OD1-NH1 3.79Å; D173-R176 PolarHBondContact OD1-NH1 3.49Å; R176-W215 HydrophobicContact CG-CE3 4.47Å; R176-W215 HydrophobicContact CG-CZ3 4.25Å; R176-W215 PolarHBondContact NE-O 2.93Å; R176-W215 PolarHBondContact NH2-O 3.23Å
177	E	89.8	Confident	92.8	Very high	161 Å²	161	49.3 Å²	49.3	75%	0.752	25%	0.246	S	C	*	.	H	α-helix	trans	-76.2	-37.3	-179.2	-67.9	-179.5	179.9	0	0	113.4	D173 T174 M175	D173-E177 PolarHBondContact O-N 3.47Å; T174-E177 PolarHBondContact O-N 3.13Å; M175-E177 PolarHBondContact O-N 3.26Å
178	Q	88.9	Confident	93	Very high	108 Å²	108	47.1 Å²	47.1	51%	0.505	24%	0.237	S	C	.	.	H	α-helix	trans	-106.6	-37.8	-164.9	-62.4	-174	5.4	0	0	115.1	T174 M175	T174-Q178 HydrophobicContact CG2-CG 4.36Å; T174-Q178 WeakPolarHBondContact O-CB 3.48Å; T174-Q178 WeakPolarHBondContact O-CG 2.99Å; T174-Q178 PolarHBondContact O-N 3.19Å; T174-Q178 VanDerWaalsContact O-N 3.09Å; M175-Q178 PolarHBondContact O-N 3.36Å
179	C	91.8	Very high	93	Very high	13 Å²	13	50.9 Å²	50.9	9%	0.088	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-28.3	-166	67	0	0	0	0	115.1	Y117 F125 M175 N182 L183	Y117-C179 PolarHBondContact OH-SG 2.92Å; Y117-C179 VanDerWaalsContact OH-SG 3.34Å; F125-C179 HydrophobicContact CD2-CB 3.99Å; M175-C179 VanDerWaalsContact CA-SG 3.57Å; M175-C179 PolarHBondContact O-N 2.98Å; M175-C179 PolarHBondContact O-SG 3.44Å; M175-C179 VanDerWaalsContact O-SG 3.4Å; C179-N182 WeakPolarHBondContact O-CB 3.39Å; C179-N182 PolarHBondContact O-N 3.02Å; C179-L183 WeakPolarHBondContact O-CG 3.47Å; C179-L183 PolarHBondContact O-N 2.94Å
180	I	94.6	Very high	93.1	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-52.1	-46.7	-175.9	-71	-55.4	0	0	0	113.4	M175 N182 L183 V184 Y212 W215 I216 L220	M175-I180 HydrophobicContact CB-CD1 4.34Å; M175-I180 HydrophobicContact CB-CG1 4.18Å; M175-I180 HydrophobicContact CE-CD1 4.17Å; M175-I180 WeakPolarHBondContact O-CG1 3.4Å; M175-I180 PolarHBondContact O-N 3.3Å; I180-N182 VanDerWaalsContact C-N 3.26Å; I180-N182 PolarHBondContact O-N 2.93Å; I180-L183 HydrophobicContact CD1-CD1 4.05Å; I180-L183 PolarHBondContact O-N 3.44Å; I180-L183 VanDerWaalsContact O-N 3.12Å; I180-V184 HydrophobicContact CG2-CG2 4.22Å; I180-V184 WeakPolarHBondContact O-CG2 3.34Å; I180-V184 PolarHBondContact O-N 2.91Å; I180-Y212 HydrophobicContact CD1-CD1 4.32Å; I180-W215 HydrophobicContact CD1-CH2 3.76Å; I180-W215 HydrophobicContact CD1-CZ2 4.48Å; I180-W215 HydrophobicContact CD1-CZ3 4.16Å; I180-W215 HydrophobicContact CG1-CH2 4.48Å; I180-W215 HydrophobicContact CG1-CZ3 4.42Å; I180-I216 HydrophobicContact CD1-CG2 3.73Å; I180-I216 HydrophobicContact CG1-CG2 4.05Å; I180-I216 HydrophobicContact CG2-CB 3.95Å; I180-I216 HydrophobicContact CG2-CG2 3.82Å; I180-L220 HydrophobicContact CG2-CD1 3.6Å
181	P	93.2	Very high	93.2	Very high	59 Å²	59	43.1 Å²	43.1	38%	0.383	21%	0.211	S	C	.	.	H	α-helix	trans	-58.7	-36.4	178.9	-26.2	35.8	0	0	0	113.7	E185	P181-E185 PolarHBondContact O-N 3.39Å; P181-E185 VanDerWaalsContact O-N 3.13Å
182	N	92.3	Very high	93	Very high	115 Å²	115	48.2 Å²	48.2	62%	0.615	24%	0.235	S	C	*	.	H	α-helix	trans	-73.7	-36.1	177.6	-63	-34	0	0	0	111.7	C179 I180 E185 S186	C179-N182 WeakPolarHBondContact O-CB 3.39Å; C179-N182 PolarHBondContact O-N 3.02Å; I180-N182 VanDerWaalsContact C-N 3.26Å; I180-N182 PolarHBondContact O-N 2.93Å; N182-E185 PolarHBondContact O-N 3.32Å; N182-S186 PolarHBondContact O-N 3.13Å
183	L	94.3	Very high	92.9	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-45	174.1	-60.9	179.6	0	0	0	110.5	F125 Y142 L146 M175 C179 I180 E185 S186 W187	F125-L183 HydrophobicContact CB-CD2 3.9Å; F125-L183 HydrophobicContact CD1-CD1 4.39Å; F125-L183 HydrophobicContact CD1-CD2 3.71Å; F125-L183 HydrophobicContact CD2-CD1 4.41Å; F125-L183 HydrophobicContact CD2-CD2 4.35Å; F125-L183 HydrophobicContact CE1-CD1 4.3Å; F125-L183 HydrophobicContact CE1-CD2 4.35Å; F125-L183 HydrophobicContact CE2-CD1 4.31Å; F125-L183 HydrophobicContact CG-CD1 4.46Å; F125-L183 HydrophobicContact CG-CD2 3.72Å; F125-L183 HydrophobicContact CZ-CD1 4.25Å; Y142-L183 WeakPolarHBondContact OH-CD2 3.44Å; L146-L183 HydrophobicContact CD2-CD1 4.46Å; M175-L183 HydrophobicContact CE-CD1 4.35Å; C179-L183 WeakPolarHBondContact O-CG 3.47Å; C179-L183 PolarHBondContact O-N 2.94Å; I180-L183 HydrophobicContact CD1-CD1 4.05Å; I180-L183 PolarHBondContact O-N 3.44Å; I180-L183 VanDerWaalsContact O-N 3.12Å; L183-E185 VanDerWaalsContact C-N 3.33Å; L183-E185 PolarHBondContact O-N 2.98Å; L183-S186 WeakPolarHBondContact O-CA 3.39Å; L183-S186 WeakPolarHBondContact O-CB 3.44Å; L183-S186 PolarHBondContact O-N 3.16Å; L183-S186 PolarHBondContact O-OG 3.31Å; L183-W187 HydrophobicContact CB-CH2 4.27Å; L183-W187 HydrophobicContact CB-CZ2 3.75Å; L183-W187 HydrophobicContact CD1-CZ2 4.47Å; L183-W187 PolarHBondContact O-N 2.95Å
184	V	95.1	Very high	92.8	Very high	7 Å²	7	47.6 Å²	47.6	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-46.2	175.9	173.5	0	0	0	0	111.1	I180 S186 W187 Y188 I216 L220 I221 F226	I180-V184 HydrophobicContact CG2-CG2 4.22Å; I180-V184 WeakPolarHBondContact O-CG2 3.34Å; I180-V184 PolarHBondContact O-N 2.91Å; V184-S186 VanDerWaalsContact C-N 3.3Å; V184-S186 PolarHBondContact O-N 3.36Å; V184-W187 HydrophobicContact CB-CE3 4.23Å; V184-W187 HydrophobicContact CB-CZ3 4.44Å; V184-W187 HydrophobicContact CG2-CE3 3.85Å; V184-W187 HydrophobicContact CG2-CH2 4.41Å; V184-W187 HydrophobicContact CG2-CZ3 3.58Å; V184-W187 PolarHBondContact O-N 2.99Å; V184-Y188 PolarHBondContact O-N 3.09Å; V184-I216 HydrophobicContact CG2-CD1 4.25Å; V184-L220 HydrophobicContact CG1-CB 4.21Å; V184-L220 HydrophobicContact CG2-CB 4.11Å; V184-L220 HydrophobicContact CG2-CD1 4.22Å; V184-I221 HydrophobicContact CG1-CD1 3.7Å; V184-I221 HydrophobicContact CG2-CD1 4.14Å; V184-F226 HydrophobicContact CG1-CE1 4.48Å; V184-F226 HydrophobicContact CG1-CE2 3.54Å; V184-F226 HydrophobicContact CG1-CZ 3.49Å; V184-F226 VanDerWaalsContact CG1-CZ 3.49Å; V184-F226 WeakPolarHBondContact O-CZ 3.14Å
185	E	93.4	Very high	92.4	Very high	64 Å²	64	48 Å²	48	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-62.1	-38.1	176.1	-174.4	59.4	-149.2	0	0	112.2	P181 N182 L183 Y188 Q189 R225	P181-E185 PolarHBondContact O-N 3.39Å; P181-E185 VanDerWaalsContact O-N 3.13Å; N182-E185 PolarHBondContact O-N 3.32Å; L183-E185 VanDerWaalsContact C-N 3.33Å; L183-E185 PolarHBondContact O-N 2.98Å; E185-Y188 WeakPolarHBondContact O-CB 3.03Å; E185-Y188 PolarHBondContact O-N 3.49Å; E185-Q189 WeakPolarHBondContact O-CG 3.43Å; E185-Q189 PolarHBondContact O-N 3.12Å; E185-R225 IonicContact OE1-CZ 3.94Å; E185-R225 IonicContact OE1-NH1 3.4Å; E185-R225 IonicContact OE1-NH2 3.4Å; E185-R225 PolarHBondContact OE1-NH2 3.14Å; E185-R225 IonicContact OE2-CZ 3.09Å; E185-R225 IonicContact OE2-NH1 2.87Å; E185-R225 PolarHBondContact OE2-NH1 2.95Å; E185-R225 IonicContact OE2-NH2 2.83Å; E185-R225 PolarHBondContact OE2-NH2 3.4Å
186	S	93.8	Very high	92	Very high	14 Å²	14	56.8 Å²	56.8	10%	0.098	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-41.3	175.4	79.1	0	0	0	0	112.2	Y142 N182 L183 V184 Y188 Q189 I190	Y142-S186 PolarHBondContact OH-OG 2.92Å; N182-S186 PolarHBondContact O-N 3.13Å; L183-S186 WeakPolarHBondContact O-CA 3.39Å; L183-S186 WeakPolarHBondContact O-CB 3.44Å; L183-S186 PolarHBondContact O-N 3.16Å; L183-S186 PolarHBondContact O-OG 3.31Å; V184-S186 VanDerWaalsContact C-N 3.3Å; V184-S186 PolarHBondContact O-N 3.36Å; S186-Y188 VanDerWaalsContact C-N 3.33Å; S186-Y188 PolarHBondContact O-N 3.48Å; S186-Q189 PolarHBondContact O-N 3.31Å; S186-I190 WeakPolarHBondContact O-CD1 3.48Å; S186-I190 VanDerWaalsContact O-CG1 3.23Å; S186-I190 WeakPolarHBondContact O-CG1 3.31Å; S186-I190 PolarHBondContact O-N 3.2Å
187	W	94.9	Very high	91.8	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-41.8	176.1	-55.1	-28	0	0	0	111	L146 L183 V184 Q189 I190 L191 V208 V209 Y212 I216 I221	L146-W187 HydrophobicContact CD1-CZ2 4.14Å; L183-W187 HydrophobicContact CB-CH2 4.27Å; L183-W187 HydrophobicContact CB-CZ2 3.75Å; L183-W187 HydrophobicContact CD1-CZ2 4.47Å; L183-W187 PolarHBondContact O-N 2.95Å; V184-W187 HydrophobicContact CB-CE3 4.23Å; V184-W187 HydrophobicContact CB-CZ3 4.44Å; V184-W187 HydrophobicContact CG2-CE3 3.85Å; V184-W187 HydrophobicContact CG2-CH2 4.41Å; V184-W187 HydrophobicContact CG2-CZ3 3.58Å; V184-W187 PolarHBondContact O-N 2.99Å; W187-Q189 VanDerWaalsContact C-N 3.34Å; W187-Q189 PolarHBondContact O-N 3.02Å; W187-I190 PolarHBondContact O-N 3Å; W187-L191 WeakPolarHBondContact O-CB 3.49Å; W187-L191 VanDerWaalsContact O-CG 3.23Å; W187-L191 WeakPolarHBondContact O-CG 3.43Å; W187-L191 PolarHBondContact O-N 3.17Å; W187-V208 HydrophobicContact CZ2-CG1 4.06Å; W187-V209 HydrophobicContact CB-CG2 3.98Å; W187-V209 HydrophobicContact CD2-CG2 4.06Å; W187-V209 HydrophobicContact CE3-CG2 3.79Å; W187-V209 HydrophobicContact CG-CG2 4.17Å; W187-Y212 AromaticContact CH2-CD1 3.66Å; W187-Y212 HydrophobicContact CH2-CD1 3.66Å; W187-Y212 HydrophobicContact CH2-CD2 4.49Å; W187-Y212 HydrophobicContact CH2-CE1 4.39Å; W187-Y212 AromaticContact CH2-CG 3.72Å; W187-Y212 HydrophobicContact CH2-CG 3.72Å; W187-Y212 HydrophobicContact CZ2-CD1 4.04Å; W187-Y212 HydrophobicContact CZ2-CE1 4.34Å; W187-Y212 HydrophobicContact CZ2-CG 4.15Å; W187-I216 HydrophobicContact CZ3-CD1 4.19Å; W187-I221 HydrophobicContact CE3-CD1 4.48Å
188	Y	94.4	Very high	91.8	Very high	32 Å²	32	51.3 Å²	51.3	13%	0.125	26%	0.255	C	S	.	.	H	α-helix	trans	-58.1	-47	174.7	-170.4	-85.9	0	0	0	112	V184 E185 S186 I190 L191 Q192 R225 F226 M229	V184-Y188 PolarHBondContact O-N 3.09Å; E185-Y188 WeakPolarHBondContact O-CB 3.03Å; E185-Y188 PolarHBondContact O-N 3.49Å; S186-Y188 VanDerWaalsContact C-N 3.33Å; S186-Y188 PolarHBondContact O-N 3.48Å; Y188-I190 VanDerWaalsContact C-N 3.34Å; Y188-I190 PolarHBondContact O-N 3.36Å; Y188-L191 PolarHBondContact O-N 3.47Å; Y188-Q192 HydrophobicContact CE1-CB 4.36Å; Y188-Q192 WeakPolarHBondContact O-CB 3.47Å; Y188-Q192 PolarHBondContact O-N 2.66Å; Y188-R225 HydrophobicContact CD2-CG 4.11Å; Y188-R225 VanDerWaalsContact CE1-NE 3.3Å; Y188-R225 HydrophobicContact CE2-CG 3.35Å; Y188-F226 HydrophobicContact CD2-CD1 4.29Å; Y188-F226 AromaticContact CD2-CD2 3.82Å; Y188-F226 HydrophobicContact CD2-CD2 3.82Å; Y188-F226 HydrophobicContact CD2-CE1 4.13Å; Y188-F226 AromaticContact CD2-CE2 3.64Å; Y188-F226 HydrophobicContact CD2-CE2 3.64Å; Y188-F226 HydrophobicContact CD2-CG 4.16Å; Y188-F226 AromaticContact CD2-CZ 3.82Å; Y188-F226 HydrophobicContact CD2-CZ 3.82Å; Y188-F226 HydrophobicContact CG-CE2 4.15Å; Y188-F226 HydrophobicContact CG-CZ 4.16Å; Y188-M229 HydrophobicContact CD2-CE 3.36Å; Y188-M229 HydrophobicContact CD2-SD 3.83Å; Y188-M229 HydrophobicContact CE2-CB 4.37Å; Y188-M229 HydrophobicContact CE2-CE 3.61Å; Y188-M229 HydrophobicContact CE2-SD 3.62Å; Y188-M229 HydrophobicContact CG-CE 4.15Å; Y188-M229 HydrophobicContact CG-SD 4.39Å
189	Q	92.9	Very high	91.9	Very high	83 Å²	83	48.8 Å²	48.8	39%	0.388	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-39.5	-179.8	-70	176.5	4.4	0	0	111.9	E185 S186 W187 N193	E185-Q189 WeakPolarHBondContact O-CG 3.43Å; E185-Q189 PolarHBondContact O-N 3.12Å; S186-Q189 PolarHBondContact O-N 3.31Å; W187-Q189 VanDerWaalsContact C-N 3.34Å; W187-Q189 PolarHBondContact O-N 3.02Å; Q189-N193 VanDerWaalsContact O-CB 3.24Å; Q189-N193 WeakPolarHBondContact O-CB 3.45Å; Q189-N193 PolarHBondContact O-N 2.97Å; Q189-N193 PolarHBondContact O-ND2 3.5Å
190	I	93.2	Very high	91.8	Very high	7 Å²	7	53.4 Å²	53.4	4%	0.036	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-52.3	175.1	-69.7	161	0	0	0	109.9	V139 Y142 L143 S186 W187 Y188 Q192 N193 Y194 V201 C205	V139-I190 HydrophobicContact CG1-CB 4.45Å; V139-I190 HydrophobicContact CG1-CD1 3.73Å; V139-I190 HydrophobicContact CG1-CG1 3.84Å; V139-I190 HydrophobicContact CG1-CG2 3.73Å; V139-I190 HydrophobicContact CG2-CG1 4.43Å; Y142-I190 HydrophobicContact CD1-CD1 4.23Å; Y142-I190 HydrophobicContact CE1-CD1 4.11Å; L143-I190 HydrophobicContact CD2-CD1 4.46Å; S186-I190 WeakPolarHBondContact O-CD1 3.48Å; S186-I190 VanDerWaalsContact O-CG1 3.23Å; S186-I190 WeakPolarHBondContact O-CG1 3.31Å; S186-I190 PolarHBondContact O-N 3.2Å; W187-I190 PolarHBondContact O-N 3Å; Y188-I190 VanDerWaalsContact C-N 3.34Å; Y188-I190 PolarHBondContact O-N 3.36Å; I190-Q192 VanDerWaalsContact C-N 3.33Å; I190-Q192 PolarHBondContact O-N 3.13Å; I190-N193 PolarHBondContact O-N 3.04Å; I190-Y194 HydrophobicContact CG2-CD2 4.05Å; I190-Y194 WeakPolarHBondContact O-CB 3.47Å; I190-Y194 VanDerWaalsContact O-CD2 3.32Å; I190-Y194 WeakPolarHBondContact O-CD2 3.35Å; I190-Y194 PolarHBondContact O-N 2.91Å; I190-V201 HydrophobicContact CG2-CG1 4.01Å; I190-C205 HydrophobicContact CG2-CB 3.95Å
191	L	93.6	Very high	91.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-44.7	179.6	-72.1	175.8	0	0	0	111.5	W187 Y188 Q195 T202 C205 L206 M229	W187-L191 WeakPolarHBondContact O-CB 3.49Å; W187-L191 VanDerWaalsContact O-CG 3.23Å; W187-L191 WeakPolarHBondContact O-CG 3.43Å; W187-L191 PolarHBondContact O-N 3.17Å; Y188-L191 PolarHBondContact O-N 3.47Å; L191-Q195 WeakPolarHBondContact O-CB 3.48Å; L191-Q195 PolarHBondContact O-N 3.29Å; L191-Q195 VanDerWaalsContact O-N 3.14Å; L191-T202 HydrophobicContact CD2-CG2 3.73Å; L191-C205 HydrophobicContact CD2-CB 3.76Å; L191-C205 HydrophobicContact CG-CB 4.29Å; L191-L206 HydrophobicContact CD1-CD2 4.25Å; L191-L206 HydrophobicContact CD2-CD2 3.94Å; L191-L206 HydrophobicContact CD2-CG 3.89Å; L191-M229 HydrophobicContact CB-CE 3.73Å; L191-M229 HydrophobicContact CB-SD 3.61Å; L191-M229 HydrophobicContact CD1-CE 3.44Å; L191-M229 VanDerWaalsContact CD1-CE 3.44Å; L191-M229 HydrophobicContact CD1-SD 4.43Å; L191-M229 HydrophobicContact CG-CE 4.23Å
192	Q	91.4	Very high	91.8	Very high	107 Å²	107	50.7 Å²	50.7	50%	0.5	25%	0.252	S	S	.	.	H	α-helix	trans	-68.2	-41.1	179.5	-173.2	176.5	17.6	0	0	113.3	Y188 I190	Y188-Q192 HydrophobicContact CE1-CB 4.36Å; Y188-Q192 WeakPolarHBondContact O-CB 3.47Å; Y188-Q192 PolarHBondContact O-N 2.66Å; I190-Q192 VanDerWaalsContact C-N 3.33Å; I190-Q192 PolarHBondContact O-N 3.13Å
193	N	91.1	Very high	91.9	Very high	73 Å²	73	46.1 Å²	46.1	39%	0.39	23%	0.229	S	C	.	.	H	α-helix	trans	-75	-32.9	-175.7	-72.7	-19.8	0	0	0	112.5	L134 Q189 I190 T197	L134-N193 WeakPolarHBondContact CD1-ND2 3.41Å; L134-N193 VanDerWaalsContact CD2-ND2 3.31Å; L134-N193 WeakPolarHBondContact CD2-ND2 3.33Å; Q189-N193 VanDerWaalsContact O-CB 3.24Å; Q189-N193 WeakPolarHBondContact O-CB 3.45Å; Q189-N193 PolarHBondContact O-N 2.97Å; Q189-N193 PolarHBondContact O-ND2 3.5Å; I190-N193 PolarHBondContact O-N 3.04Å; N193-T197 PolarHBondContact O-OG1 3.24Å
194	Y	89.9	Confident	91.9	Very high	18 Å²	18	47.1 Å²	47.1	7%	0.071	23%	0.234	C	C	.	.	H	α-helix	trans	-101.8	-6.6	-173.1	-67.3	-64.1	0	0	0	115.5	L134 P136 V139 I190 Y196 T197 N198 V201 T202	L134-Y194 PolarHBondContact O-OH 3.48Å; P136-Y194 HydrophobicContact CB-CE1 4.04Å; P136-Y194 WeakPolarHBondContact CD-OH 3.3Å; P136-Y194 HydrophobicContact CG-CE1 3.7Å; P136-Y194 WeakPolarHBondContact CG-OH 3.36Å; V139-Y194 HydrophobicContact CG2-CE2 4.34Å; I190-Y194 HydrophobicContact CG2-CD2 4.05Å; I190-Y194 WeakPolarHBondContact O-CB 3.47Å; I190-Y194 VanDerWaalsContact O-CD2 3.32Å; I190-Y194 WeakPolarHBondContact O-CD2 3.35Å; I190-Y194 PolarHBondContact O-N 2.91Å; Y194-Y196 PolarHBondContact O-N 3.47Å; Y194-T197 WeakPolarHBondContact CA-OG1 3.32Å; Y194-T197 WeakPolarHBondContact CD1-OG1 3.37Å; Y194-T197 PolarHBondContact O-N 3.02Å; Y194-N198 HydrophobicContact CD1-CB 3.86Å; Y194-N198 HydrophobicContact CG-CB 4.38Å; Y194-N198 PolarHBondContact O-N 3.4Å; Y194-V201 HydrophobicContact CD2-CG1 4.09Å; Y194-V201 HydrophobicContact CG-CG1 4.37Å; Y194-T202 WeakPolarHBondContact CB-OG1 3.4Å; Y194-T202 PolarHBondContact O-OG1 2.76Å
195	Q	84.9	Confident	92	Very high	35 Å²	35	46.8 Å²	46.8	16%	0.164	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.2	-41.1	-177.8	-176.3	174	10.3	0	0	114.8	L191 H233 I236	L191-Q195 WeakPolarHBondContact O-CB 3.48Å; L191-Q195 PolarHBondContact O-N 3.29Å; L191-Q195 VanDerWaalsContact O-N 3.14Å; Q195-H233 WeakPolarHBondContact CG-NE2 3.46Å; Q195-H233 PolarHBondContact NE2-CD2 3.14Å; Q195-H233 VanDerWaalsContact NE2-CD2 3.35Å; Q195-I236 HydrophobicContact CG-CD1 3.71Å
196	Y	86.5	Confident	92.1	Very high	184 Å²	184	43.8 Å²	43.8	72%	0.722	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-2.6	-177.7	-52.8	-72.8	0	0	0	114.3	Y194 I236	Y194-Y196 PolarHBondContact O-N 3.47Å; Y196-I236 HydrophobicContact CD1-CD1 4.41Å; Y196-I236 HydrophobicContact CE1-CD1 3.89Å
197	T	87.4	Confident	92.2	Very high	108 Å²	108	47.1 Å²	47.1	66%	0.663	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-28.2	-170.9	59.9	0	0	0	0	113.2	N193 Y194	N193-T197 PolarHBondContact O-OG1 3.24Å; Y194-T197 WeakPolarHBondContact CA-OG1 3.32Å; Y194-T197 WeakPolarHBondContact CD1-OG1 3.37Å; Y194-T197 PolarHBondContact O-N 3.02Å
198	N	89.4	Confident	92.2	Very high	46 Å²	46	47.1 Å²	47.1	25%	0.246	23%	0.232	C	C	.	.			trans	-149.6	99.2	178.2	-168.1	-33.6	0	0	0	110.9	Y194 E200 V201 T202	Y194-N198 HydrophobicContact CD1-CB 3.86Å; Y194-N198 HydrophobicContact CG-CB 4.38Å; Y194-N198 PolarHBondContact O-N 3.4Å; N198-E200 PolarHBondContact OD1-N 2.82Å; N198-V201 HydrophobicContact CB-CB 4.36Å; N198-V201 WeakPolarHBondContact ND2-CG2 3.49Å; N198-V201 PolarHBondContact OD1-N 3.32Å; N198-V201 VanDerWaalsContact OD1-N 3.08Å; N198-T202 PolarHBondContact O-N 3.23Å; N198-T202 PolarHBondContact O-OG1 3.37Å
199	S	91.2	Very high	92.3	Very high	55 Å²	55	45.7 Å²	45.7	39%	0.385	23%	0.226	S	C	.	.	H	α-helix	trans	-67.9	-41.3	179.9	51.9	0	0	0	0	112.6	V201 T202 C203	S199-V201 PolarHBondContact O-N 3.24Å; S199-T202 WeakPolarHBondContact O-CB 3.28Å; S199-T202 PolarHBondContact O-N 3.28Å; S199-T202 VanDerWaalsContact O-N 3.09Å; S199-C203 PolarHBondContact O-N 3.49Å; S199-C203 PolarHBondContact O-SG 3.21Å; S199-C203 VanDerWaalsContact O-SG 3.33Å
200	E	90.9	Very high	92.3	Very high	110 Å²	110	42 Å²	42	51%	0.514	21%	0.211	S	C	.	.	H	α-helix	trans	-58.3	-46.9	-178.7	-172.5	-175.1	171.3	0	0	111.8	N198 T202 C203 Q204	N198-E200 PolarHBondContact OD1-N 2.82Å; E200-T202 VanDerWaalsContact C-N 3.31Å; E200-T202 PolarHBondContact O-N 2.74Å; E200-C203 PolarHBondContact O-N 3.44Å; E200-Q204 WeakPolarHBondContact O-CG 3.24Å; E200-Q204 PolarHBondContact O-N 3.41Å
201	V	92.8	Very high	92.3	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.024	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-36.3	177.4	171.3	0	0	0	0	111.4	V139 D140 L143 I190 Y194 N198 S199 C205	V139-V201 HydrophobicContact CB-CG1 4.32Å; V139-V201 HydrophobicContact CG1-CG1 3.56Å; D140-V201 HydrophobicContact CB-CG2 4.45Å; L143-V201 HydrophobicContact CD1-CG1 4.15Å; I190-V201 HydrophobicContact CG2-CG1 4.01Å; Y194-V201 HydrophobicContact CD2-CG1 4.09Å; Y194-V201 HydrophobicContact CG-CG1 4.37Å; N198-V201 HydrophobicContact CB-CB 4.36Å; N198-V201 WeakPolarHBondContact ND2-CG2 3.49Å; N198-V201 PolarHBondContact OD1-N 3.32Å; N198-V201 VanDerWaalsContact OD1-N 3.08Å; S199-V201 PolarHBondContact O-N 3.24Å; V201-C205 WeakPolarHBondContact O-CB 3.38Å; V201-C205 PolarHBondContact O-N 3.3Å
202	T	94.4	Very high	92.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.5	-44.6	178.4	-54.4	0	0	0	0	110.8	L191 Y194 N198 S199 E200 C205 L206 L239	L191-T202 HydrophobicContact CD2-CG2 3.73Å; Y194-T202 WeakPolarHBondContact CB-OG1 3.4Å; Y194-T202 PolarHBondContact O-OG1 2.76Å; N198-T202 PolarHBondContact O-N 3.23Å; N198-T202 PolarHBondContact O-OG1 3.37Å; S199-T202 WeakPolarHBondContact O-CB 3.28Å; S199-T202 PolarHBondContact O-N 3.28Å; S199-T202 VanDerWaalsContact O-N 3.09Å; E200-T202 VanDerWaalsContact C-N 3.31Å; E200-T202 PolarHBondContact O-N 2.74Å; T202-C205 WeakPolarHBondContact O-CB 3.46Å; T202-C205 PolarHBondContact O-N 3.29Å; T202-L206 WeakPolarHBondContact O-CG 3.42Å; T202-L206 PolarHBondContact O-N 3.36Å; T202-L239 HydrophobicContact CG2-CD1 3.79Å; T202-L239 HydrophobicContact CG2-CD2 3.86Å; T202-L239 HydrophobicContact CG2-CG 4.45Å
203	C	94.4	Very high	92.4	Very high	20 Å²	20	37.6 Å²	37.6	14%	0.135	19%	0.194	C	C	.	.	H	α-helix	trans	-58.4	-52.1	173.2	-69.4	0	0	0	0	111.8	S199 E200 C205 L206 E207 E242	S199-C203 PolarHBondContact O-N 3.49Å; S199-C203 PolarHBondContact O-SG 3.21Å; S199-C203 VanDerWaalsContact O-SG 3.33Å; E200-C203 PolarHBondContact O-N 3.44Å; C203-C205 PolarHBondContact O-N 3.2Å; C203-C205 VanDerWaalsContact O-N 3.17Å; C203-L206 WeakPolarHBondContact O-CA 3.43Å; C203-L206 WeakPolarHBondContact O-CB 3.32Å; C203-L206 PolarHBondContact O-N 2.9Å; C203-E207 PolarHBondContact O-N 3.11Å; C203-E242 HydrophobicContact CB-CG 3.9Å
204	Q	94.6	Very high	92.3	Very high	22 Å²	22	37 Å²	37	10%	0.103	20%	0.195	C	C	.	.	H	α-helix	trans	-57	-35.1	176.1	-72.2	176.1	10.4	0	0	112.6	D140 L143 E200 V208	D140-Q204 PolarHBondContact OD1-NE2 3Å; D140-Q204 PolarHBondContact OD1-OE1 2.97Å; D140-Q204 VanDerWaalsContact OD1-OE1 3.11Å; L143-Q204 HydrophobicContact CB-CB 4.48Å; L143-Q204 HydrophobicContact CD1-CB 3.91Å; E200-Q204 WeakPolarHBondContact O-CG 3.24Å; E200-Q204 PolarHBondContact O-N 3.41Å; Q204-V208 WeakPolarHBondContact O-CG2 3.26Å; Q204-V208 PolarHBondContact O-N 3.1Å; Q204-V208 VanDerWaalsContact O-N 3.07Å
205	C	96.3	Very high	92.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-71.1	-36.2	177.2	-167.8	0	0	0	0	111.7	L143 I190 L191 V201 T202 C203 V208 V209	L143-C205 HydrophobicContact CD1-CB 3.84Å; L143-C205 HydrophobicContact CD2-CB 4.1Å; I190-C205 HydrophobicContact CG2-CB 3.95Å; L191-C205 HydrophobicContact CD2-CB 3.76Å; L191-C205 HydrophobicContact CG-CB 4.29Å; V201-C205 WeakPolarHBondContact O-CB 3.38Å; V201-C205 PolarHBondContact O-N 3.3Å; T202-C205 WeakPolarHBondContact O-CB 3.46Å; T202-C205 PolarHBondContact O-N 3.29Å; C203-C205 PolarHBondContact O-N 3.2Å; C203-C205 VanDerWaalsContact O-N 3.17Å; C205-V208 PolarHBondContact O-N 3.47Å; C205-V209 VanDerWaalsContact O-CG2 3.24Å; C205-V209 WeakPolarHBondContact O-CG2 3.35Å; C205-V209 PolarHBondContact O-N 3.17Å
206	L	96.1	Very high	92.7	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-42.6	173.8	-68.6	167.3	0	0	0	111.3	L191 T202 C203 V208 V209 G210 L230 E242 A243 C246	L191-L206 HydrophobicContact CD1-CD2 4.25Å; L191-L206 HydrophobicContact CD2-CD2 3.94Å; L191-L206 HydrophobicContact CD2-CG 3.89Å; T202-L206 WeakPolarHBondContact O-CG 3.42Å; T202-L206 PolarHBondContact O-N 3.36Å; C203-L206 WeakPolarHBondContact O-CA 3.43Å; C203-L206 WeakPolarHBondContact O-CB 3.32Å; C203-L206 PolarHBondContact O-N 2.9Å; L206-V208 PolarHBondContact O-N 3.45Å; L206-V209 PolarHBondContact O-N 3.46Å; L206-G210 PolarHBondContact O-N 3.06Å; L206-L230 HydrophobicContact CD2-CD2 3.34Å; L206-E242 HydrophobicContact CB-CB 4.02Å; L206-E242 HydrophobicContact CD1-CB 3.87Å; L206-A243 HydrophobicContact CD1-CB 4.14Å; L206-C246 HydrophobicContact CD2-CB 4.48Å
207	E	95.4	Very high	92.9	Very high	85 Å²	85	31.2 Å²	31.2	40%	0.397	18%	0.178	S	C	.	.	H	α-helix	trans	-57.1	-47.8	173.4	-69.6	172.5	-151.9	0	0	111.5	C203 V209 G210 A211 E242	C203-E207 PolarHBondContact O-N 3.11Å; E207-V209 PolarHBondContact O-N 2.99Å; E207-G210 PolarHBondContact O-N 3.41Å; E207-A211 PolarHBondContact O-N 2.94Å; E207-E242 WeakPolarHBondContact CG-OE2 3.37Å
208	V	95.8	Very high	93	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.7	-45.9	176.4	166.9	0	0	0	0	111.4	L143 L146 M147 W187 Q204 C205 L206 G210 A211 Y212	L143-V208 HydrophobicContact CB-CG2 4.09Å; L143-V208 HydrophobicContact CD2-CB 4.31Å; L143-V208 HydrophobicContact CD2-CG1 4.44Å; L143-V208 HydrophobicContact CD2-CG2 4.03Å; L146-V208 HydrophobicContact CB-CG1 3.99Å; L146-V208 HydrophobicContact CB-CG2 4.29Å; L146-V208 HydrophobicContact CD1-CG1 3.69Å; M147-V208 HydrophobicContact CG-CG2 3.61Å; M147-V208 HydrophobicContact SD-CB 4.31Å; M147-V208 HydrophobicContact SD-CG2 3.69Å; W187-V208 HydrophobicContact CZ2-CG1 4.06Å; Q204-V208 WeakPolarHBondContact O-CG2 3.26Å; Q204-V208 PolarHBondContact O-N 3.1Å; Q204-V208 VanDerWaalsContact O-N 3.07Å; C205-V208 PolarHBondContact O-N 3.47Å; L206-V208 PolarHBondContact O-N 3.45Å; V208-G210 VanDerWaalsContact C-N 3.32Å; V208-G210 PolarHBondContact O-N 2.72Å; V208-A211 PolarHBondContact O-N 3.03Å; V208-Y212 HydrophobicContact CG1-CD2 4.06Å; V208-Y212 HydrophobicContact CG1-CE2 4.16Å; V208-Y212 VanDerWaalsContact O-CD2 3.22Å; V208-Y212 WeakPolarHBondContact O-CD2 3.37Å; V208-Y212 PolarHBondContact O-N 3.44Å; V208-Y212 VanDerWaalsContact O-N 3.1Å
209	V	95.8	Very high	93	Very high	1 Å²	1	28 Å²	28	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-60.6	-45.7	177.5	174	0	0	0	0	109.9	W187 C205 L206 E207 A211 Y212 V213 I221	W187-V209 HydrophobicContact CB-CG2 3.98Å; W187-V209 HydrophobicContact CD2-CG2 4.06Å; W187-V209 HydrophobicContact CE3-CG2 3.79Å; W187-V209 HydrophobicContact CG-CG2 4.17Å; C205-V209 VanDerWaalsContact O-CG2 3.24Å; C205-V209 WeakPolarHBondContact O-CG2 3.35Å; C205-V209 PolarHBondContact O-N 3.17Å; L206-V209 PolarHBondContact O-N 3.46Å; E207-V209 PolarHBondContact O-N 2.99Å; V209-A211 PolarHBondContact O-N 3.22Å; V209-Y212 PolarHBondContact O-N 3.27Å; V209-V213 HydrophobicContact CG1-CG2 4.18Å; V209-V213 WeakPolarHBondContact O-CB 3.49Å; V209-V213 WeakPolarHBondContact O-CG2 3.43Å; V209-V213 PolarHBondContact O-N 2.92Å; V209-I221 HydrophobicContact CG1-CD1 4.02Å; V209-I221 HydrophobicContact CG1-CG1 4.46Å; V209-I221 HydrophobicContact CG1-CG2 4.24Å
210	G	93.7	Very high	93.1	Very high	6 Å²	6	27.5 Å²	27.5	6%	0.062	16%	0.155	C	C	.	.	H	α-helix	trans	-55.7	-50.7	176.5	0	0	0	0	0	113	L206 E207 V208 Y212 V213	L206-G210 PolarHBondContact O-N 3.06Å; E207-G210 PolarHBondContact O-N 3.41Å; V208-G210 VanDerWaalsContact C-N 3.32Å; V208-G210 PolarHBondContact O-N 2.72Å; G210-Y212 PolarHBondContact O-N 2.93Å; G210-V213 PolarHBondContact O-N 3.4Å
211	A	93	Very high	93.1	Very high	22 Å²	22	22.3 Å²	22.3	18%	0.182	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-46.4	179.6	0	0	0	0	0	112.5	M147 E207 V208 V209 V213 S214	M147-A211 HydrophobicContact CE-CB 4.07Å; M147-A211 HydrophobicContact SD-CB 3.96Å; E207-A211 PolarHBondContact O-N 2.94Å; V208-A211 PolarHBondContact O-N 3.03Å; V209-A211 PolarHBondContact O-N 3.22Å; A211-V213 PolarHBondContact O-N 2.87Å; A211-S214 PolarHBondContact O-OG 3.5Å
212	Y	94.4	Very high	92.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-72.6	-28.9	-176.8	-83.2	-112.3	0	0	0	113.3	L146 D150 M175 I180 W187 V208 V209 G210 S214 W215 I216	L146-Y212 WeakPolarHBondContact CA-OH 3.49Å; L146-Y212 HydrophobicContact CB-CE2 3.96Å; L146-Y212 WeakPolarHBondContact CD2-OH 3.49Å; L146-Y212 PolarHBondContact O-OH 2.81Å; D150-Y212 HydrophobicContact CB-CE2 3.97Å; M175-Y212 HydrophobicContact CE-CE1 4.3Å; I180-Y212 HydrophobicContact CD1-CD1 4.32Å; W187-Y212 AromaticContact CH2-CD1 3.66Å; W187-Y212 HydrophobicContact CH2-CD1 3.66Å; W187-Y212 HydrophobicContact CH2-CD2 4.49Å; W187-Y212 HydrophobicContact CH2-CE1 4.39Å; W187-Y212 AromaticContact CH2-CG 3.72Å; W187-Y212 HydrophobicContact CH2-CG 3.72Å; W187-Y212 HydrophobicContact CZ2-CD1 4.04Å; W187-Y212 HydrophobicContact CZ2-CE1 4.34Å; W187-Y212 HydrophobicContact CZ2-CG 4.15Å; V208-Y212 HydrophobicContact CG1-CD2 4.06Å; V208-Y212 HydrophobicContact CG1-CE2 4.16Å; V208-Y212 VanDerWaalsContact O-CD2 3.22Å; V208-Y212 WeakPolarHBondContact O-CD2 3.37Å; V208-Y212 PolarHBondContact O-N 3.44Å; V208-Y212 VanDerWaalsContact O-N 3.1Å; V209-Y212 PolarHBondContact O-N 3.27Å; G210-Y212 PolarHBondContact O-N 2.93Å; Y212-S214 PolarHBondContact O-N 3.08Å; Y212-S214 VanDerWaalsContact O-N 3.08Å; Y212-W215 AromaticContact CD1-CE2 3.93Å; Y212-W215 HydrophobicContact CD1-CH2 4.21Å; Y212-W215 AromaticContact CD1-CZ2 3.41Å; Y212-W215 HydrophobicContact CD1-CZ2 3.41Å; Y212-W215 VanDerWaalsContact CD1-CZ2 3.41Å; Y212-W215 HydrophobicContact CE1-CH2 4.2Å; Y212-W215 AromaticContact CE1-CZ2 3.48Å; Y212-W215 HydrophobicContact CE1-CZ2 3.48Å; Y212-W215 VanDerWaalsContact CE1-CZ2 3.48Å; Y212-W215 HydrophobicContact CG-CZ2 4.3Å; Y212-W215 PolarHBondContact O-N 3.02Å; Y212-W215 VanDerWaalsContact O-N 3.09Å; Y212-I216 HydrophobicContact CD1-CG2 4.33Å; Y212-I216 WeakPolarHBondContact O-CG1 3.46Å; Y212-I216 WeakPolarHBondContact O-CG2 3.4Å; Y212-I216 PolarHBondContact O-N 3.42Å; Y212-I216 VanDerWaalsContact O-N 3.1Å
213	V	92.8	Very high	92.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-52.2	-34.6	179.1	157.6	0	0	0	0	111.8	V209 G210 A211 W215 L218 I221 E249 V250 K253	V209-V213 HydrophobicContact CG1-CG2 4.18Å; V209-V213 WeakPolarHBondContact O-CB 3.49Å; V209-V213 WeakPolarHBondContact O-CG2 3.43Å; V209-V213 PolarHBondContact O-N 2.92Å; G210-V213 PolarHBondContact O-N 3.4Å; A211-V213 PolarHBondContact O-N 2.87Å; V213-W215 PolarHBondContact O-N 3.09Å; V213-W215 VanDerWaalsContact O-N 3.11Å; V213-L218 HydrophobicContact CG1-CD1 4.32Å; V213-I221 HydrophobicContact CG2-CB 4.37Å; V213-I221 HydrophobicContact CG2-CG1 4.1Å; V213-I221 HydrophobicContact CG2-CG2 4.15Å; V213-E249 HydrophobicContact CG1-CB 4.38Å; V213-E249 WeakPolarHBondContact CG1-O 3.47Å; V213-V250 HydrophobicContact CG1-CG2 4.04Å; V213-V250 HydrophobicContact CG2-CG2 4.04Å; V213-K253 HydrophobicContact CG1-CB 4.45Å; V213-K253 HydrophobicContact CG1-CD 4.28Å; V213-K253 VanDerWaalsContact O-CD 3.23Å; V213-K253 WeakPolarHBondContact O-CD 3.5Å; V213-K253 WeakPolarHBondContact O-CE 3.33Å; V213-K253 PolarHBondContact O-NZ 3.47Å
214	S	88.7	Confident	92.4	Very high	59 Å²	59	31.3 Å²	31.3	41%	0.413	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.1	-179.3	70.3	0	0	0	0	114.2	A211 Y212	A211-S214 PolarHBondContact O-OG 3.5Å; Y212-S214 PolarHBondContact O-N 3.08Å; Y212-S214 VanDerWaalsContact O-N 3.08Å
215	W	90.4	Very high	92.3	Very high	17 Å²	17	35.3 Å²	35.3	6%	0.064	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-8.9	-173.9	66.1	-92.4	0	0	0	116.2	D150 V154 K172 M175 R176 I180 Y212 V213	D150-W215 PolarHBondContact OD1-NE1 3.5Å; V154-W215 HydrophobicContact CG2-CG 4.26Å; K172-W215 HydrophobicContact CB-CE3 4.15Å; K172-W215 HydrophobicContact CB-CZ3 4.02Å; K172-W215 HydrophobicContact CD-CD2 4.29Å; K172-W215 HydrophobicContact CD-CE3 4.22Å; K172-W215 HydrophobicContact CG-CE3 4.12Å; K172-W215 HydrophobicContact CG-CH2 4.37Å; K172-W215 HydrophobicContact CG-CZ3 4.03Å; M175-W215 HydrophobicContact CB-CH2 4.25Å; M175-W215 HydrophobicContact CB-CZ3 4.38Å; M175-W215 HydrophobicContact CE-CH2 3.84Å; M175-W215 HydrophobicContact CE-CZ2 4.42Å; M175-W215 HydrophobicContact SD-CH2 3.9Å; R176-W215 HydrophobicContact CG-CE3 4.47Å; R176-W215 HydrophobicContact CG-CZ3 4.25Å; R176-W215 PolarHBondContact NE-O 2.93Å; R176-W215 PolarHBondContact NH2-O 3.23Å; I180-W215 HydrophobicContact CD1-CH2 3.76Å; I180-W215 HydrophobicContact CD1-CZ2 4.48Å; I180-W215 HydrophobicContact CD1-CZ3 4.16Å; I180-W215 HydrophobicContact CG1-CH2 4.48Å; I180-W215 HydrophobicContact CG1-CZ3 4.42Å; Y212-W215 AromaticContact CD1-CE2 3.93Å; Y212-W215 HydrophobicContact CD1-CH2 4.21Å; Y212-W215 AromaticContact CD1-CZ2 3.41Å; Y212-W215 HydrophobicContact CD1-CZ2 3.41Å; Y212-W215 VanDerWaalsContact CD1-CZ2 3.41Å; Y212-W215 HydrophobicContact CE1-CH2 4.2Å; Y212-W215 AromaticContact CE1-CZ2 3.48Å; Y212-W215 HydrophobicContact CE1-CZ2 3.48Å; Y212-W215 VanDerWaalsContact CE1-CZ2 3.48Å; Y212-W215 HydrophobicContact CG-CZ2 4.3Å; Y212-W215 PolarHBondContact O-N 3.02Å; Y212-W215 VanDerWaalsContact O-N 3.09Å; V213-W215 PolarHBondContact O-N 3.09Å; V213-W215 VanDerWaalsContact O-N 3.11Å
216	I	93.1	Very high	92.1	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.041	20%	0.197	C	C	.	.	S	Bend	trans	-79.6	-177.1	174.7	65.9	178.4	0	0	0	112.6	I180 V184 W187 Y212 I221 K253	I180-I216 HydrophobicContact CD1-CG2 3.73Å; I180-I216 HydrophobicContact CG1-CG2 4.05Å; I180-I216 HydrophobicContact CG2-CB 3.95Å; I180-I216 HydrophobicContact CG2-CG2 3.82Å; V184-I216 HydrophobicContact CG2-CD1 4.25Å; W187-I216 HydrophobicContact CZ3-CD1 4.19Å; Y212-I216 HydrophobicContact CD1-CG2 4.33Å; Y212-I216 WeakPolarHBondContact O-CG1 3.46Å; Y212-I216 WeakPolarHBondContact O-CG2 3.4Å; Y212-I216 PolarHBondContact O-N 3.42Å; Y212-I216 VanDerWaalsContact O-N 3.1Å; I216-I221 HydrophobicContact CD1-CG1 3.94Å; I216-K253 VanDerWaalsContact O-CE 3.31Å; I216-K253 WeakPolarHBondContact O-CE 3.15Å; I216-K253 PolarHBondContact O-NZ 3.41Å
217	D	91.1	Very high	91.8	Very high	92 Å²	92	36.6 Å²	36.6	49%	0.492	20%	0.202	S	C	.	.			trans	-74.5	129.3	166.2	-176.9	-1.9	0	0	0	109.8	S219 L220	D217-S219 VanDerWaalsContact C-N 3.3Å; D217-S219 PolarHBondContact O-N 3.44Å; D217-S219 PolarHBondContact OD1-N 3.47Å; D217-S219 PolarHBondContact OD1-OG 3.4Å; D217-S219 PolarHBondContact OD2-OG 2.99Å; D217-L220 HydrophobicContact CB-CD1 4.23Å; D217-L220 HydrophobicContact CB-CG 4.29Å
218	L	88.5	Confident	91.6	Very high	17 Å²	17	37.2 Å²	37.2	9%	0.089	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-68.6	-29	-178	-168.4	56.2	0	0	0	112.6	V213 L220 I221 A222 V250 K253 M255 L263	V213-L218 HydrophobicContact CG1-CD1 4.32Å; L218-L220 PolarHBondContact O-N 3.4Å; L218-L220 VanDerWaalsContact O-N 3.09Å; L218-I221 PolarHBondContact O-N 3.1Å; L218-A222 HydrophobicContact CD1-CB 4.07Å; L218-A222 HydrophobicContact CD2-CB 4.32Å; L218-A222 HydrophobicContact CG-CB 3.75Å; L218-A222 WeakPolarHBondContact O-CB 3.41Å; L218-A222 PolarHBondContact O-N 2.84Å; L218-V250 HydrophobicContact CD1-CG1 4.19Å; L218-K253 VanDerWaalsContact CA-NZ 3.33Å; L218-K253 HydrophobicContact CB-CD 3.85Å; L218-K253 HydrophobicContact CD1-CD 3.66Å; L218-K253 HydrophobicContact CD2-CD 4.07Å; L218-K253 HydrophobicContact CG-CD 4.04Å; L218-M255 HydrophobicContact CD2-CE 3.65Å; L218-M255 HydrophobicContact CD2-SD 4.19Å; L218-L263 HydrophobicContact CD2-CD2 3.72Å
219	S	90.3	Very high	91.5	Very high	70 Å²	70	38.1 Å²	38.1	49%	0.49	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-58.4	-26.2	-178.1	70.3	0	0	0	0	113	D217 I221 N223	D217-S219 VanDerWaalsContact C-N 3.3Å; D217-S219 PolarHBondContact O-N 3.44Å; D217-S219 PolarHBondContact OD1-N 3.47Å; D217-S219 PolarHBondContact OD1-OG 3.4Å; D217-S219 PolarHBondContact OD2-OG 2.99Å; S219-I221 VanDerWaalsContact C-N 3.34Å; S219-I221 PolarHBondContact O-N 3.01Å; S219-N223 PolarHBondContact O-ND2 3.38Å; S219-N223 VanDerWaalsContact O-ND2 3.08Å
220	L	91.9	Very high	91.4	Very high	44 Å²	44	38.1 Å²	38.1	23%	0.23	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-70.4	-27.8	178.7	-59.6	176.8	0	0	0	113.1	I180 V184 D217 L218 N223	I180-L220 HydrophobicContact CG2-CD1 3.6Å; V184-L220 HydrophobicContact CG1-CB 4.21Å; V184-L220 HydrophobicContact CG2-CB 4.11Å; V184-L220 HydrophobicContact CG2-CD1 4.22Å; D217-L220 HydrophobicContact CB-CD1 4.23Å; D217-L220 HydrophobicContact CB-CG 4.29Å; L218-L220 PolarHBondContact O-N 3.4Å; L218-L220 VanDerWaalsContact O-N 3.09Å; L220-N223 VanDerWaalsContact C-ND2 3.27Å; L220-N223 PolarHBondContact O-ND2 3.01Å
221	I	92.6	Very high	91.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-41.7	-178.4	-57.9	-61.9	0	0	0	111.7	V184 W187 V209 V213 I216 L218 S219 N223 F226 V250	V184-I221 HydrophobicContact CG1-CD1 3.7Å; V184-I221 HydrophobicContact CG2-CD1 4.14Å; W187-I221 HydrophobicContact CE3-CD1 4.48Å; V209-I221 HydrophobicContact CG1-CD1 4.02Å; V209-I221 HydrophobicContact CG1-CG1 4.46Å; V209-I221 HydrophobicContact CG1-CG2 4.24Å; V213-I221 HydrophobicContact CG2-CB 4.37Å; V213-I221 HydrophobicContact CG2-CG1 4.1Å; V213-I221 HydrophobicContact CG2-CG2 4.15Å; I216-I221 HydrophobicContact CD1-CG1 3.94Å; L218-I221 PolarHBondContact O-N 3.1Å; S219-I221 VanDerWaalsContact C-N 3.34Å; S219-I221 PolarHBondContact O-N 3.01Å; I221-N223 PolarHBondContact O-N 3.34Å; I221-F226 HydrophobicContact CD1-CD1 4.12Å; I221-F226 HydrophobicContact CD1-CE1 3.88Å; I221-F226 HydrophobicContact CD1-CZ 4.11Å; I221-F226 WeakPolarHBondContact O-CB 3.36Å; I221-V250 HydrophobicContact CG2-CG2 4.01Å
222	A	88.4	Confident	91.2	Very high	31 Å²	31	38.6 Å²	38.6	26%	0.256	22%	0.217	S	C	.	.	S	Bend	trans	-82.4	59.3	-179.6	0	0	0	0	0	112	L218 V250 L263	L218-A222 HydrophobicContact CD1-CB 4.07Å; L218-A222 HydrophobicContact CD2-CB 4.32Å; L218-A222 HydrophobicContact CG-CB 3.75Å; L218-A222 WeakPolarHBondContact O-CB 3.41Å; L218-A222 PolarHBondContact O-N 2.84Å; A222-V250 HydrophobicContact CB-CG1 4.49Å; A222-L263 HydrophobicContact CB-CD1 3.9Å
223	N	90.4	Very high	91.1	Very high	48 Å²	48	38.6 Å²	38.6	26%	0.257	22%	0.217	S	C	.	.	S	Bend	trans	-127.5	161	173.6	57.3	67.4	0	0	0	110.7	S219 L220 I221 R225 F226 I227	S219-N223 PolarHBondContact O-ND2 3.38Å; S219-N223 VanDerWaalsContact O-ND2 3.08Å; L220-N223 VanDerWaalsContact C-ND2 3.27Å; L220-N223 PolarHBondContact O-ND2 3.01Å; I221-N223 PolarHBondContact O-N 3.34Å; N223-R225 PolarHBondContact O-N 3.37Å; N223-R225 VanDerWaalsContact O-N 3.1Å; N223-R225 WeakPolarHBondContact OD1-CB 3.38Å; N223-R225 PolarHBondContact OD1-N 3Å; N223-F226 PolarHBondContact O-N 3.34Å; N223-F226 PolarHBondContact OD1-N 3.27Å; N223-I227 WeakPolarHBondContact O-CG1 3.24Å; N223-I227 PolarHBondContact O-N 3.28Å
224	D	87.9	Confident	91	Very high	135 Å²	135	38.7 Å²	38.7	72%	0.722	22%	0.217	S	C	*	.	H	α-helix	trans	-54.6	-35.3	-175.4	-62.3	-21.6	0	0	0	112.8	N228	D224-N228 VanDerWaalsContact O-CB 3.25Å; D224-N228 WeakPolarHBondContact O-CB 3.47Å; D224-N228 PolarHBondContact O-N 2.96Å; D224-N228 PolarHBondContact O-ND2 2.85Å
225	R	91.7	Very high	91	Very high	106 Å²	106	40.1 Å²	40.1	40%	0.4	23%	0.227	S	C	.	.	H	α-helix	trans	-64.6	-51.5	-179.6	174	-179.9	175.8	-156.6	2.3	111.3	E185 Y188 N223	E185-R225 IonicContact OE1-CZ 3.94Å; E185-R225 IonicContact OE1-NH1 3.4Å; E185-R225 IonicContact OE1-NH2 3.4Å; E185-R225 PolarHBondContact OE1-NH2 3.14Å; E185-R225 IonicContact OE2-CZ 3.09Å; E185-R225 IonicContact OE2-NH1 2.87Å; E185-R225 PolarHBondContact OE2-NH1 2.95Å; E185-R225 IonicContact OE2-NH2 2.83Å; E185-R225 PolarHBondContact OE2-NH2 3.4Å; Y188-R225 HydrophobicContact CD2-CG 4.11Å; Y188-R225 VanDerWaalsContact CE1-NE 3.3Å; Y188-R225 HydrophobicContact CE2-CG 3.35Å; N223-R225 PolarHBondContact O-N 3.37Å; N223-R225 VanDerWaalsContact O-N 3.1Å; N223-R225 WeakPolarHBondContact OD1-CB 3.38Å; N223-R225 PolarHBondContact OD1-N 3Å
226	F	92.1	Very high	91	Very high	5 Å²	5	41.2 Å²	41.2	2%	0.022	23%	0.234	C	C	.	.	H	α-helix	trans	-73	-44	-178.7	-99.9	-90.9	0	0	0	112.9	V184 Y188 I221 N223 N228 M229 L230	V184-F226 HydrophobicContact CG1-CE1 4.48Å; V184-F226 HydrophobicContact CG1-CE2 3.54Å; V184-F226 HydrophobicContact CG1-CZ 3.49Å; V184-F226 VanDerWaalsContact CG1-CZ 3.49Å; V184-F226 WeakPolarHBondContact O-CZ 3.14Å; Y188-F226 HydrophobicContact CD2-CD1 4.29Å; Y188-F226 AromaticContact CD2-CD2 3.82Å; Y188-F226 HydrophobicContact CD2-CD2 3.82Å; Y188-F226 HydrophobicContact CD2-CE1 4.13Å; Y188-F226 AromaticContact CD2-CE2 3.64Å; Y188-F226 HydrophobicContact CD2-CE2 3.64Å; Y188-F226 HydrophobicContact CD2-CG 4.16Å; Y188-F226 AromaticContact CD2-CZ 3.82Å; Y188-F226 HydrophobicContact CD2-CZ 3.82Å; Y188-F226 HydrophobicContact CG-CE2 4.15Å; Y188-F226 HydrophobicContact CG-CZ 4.16Å; I221-F226 HydrophobicContact CD1-CD1 4.12Å; I221-F226 HydrophobicContact CD1-CE1 3.88Å; I221-F226 HydrophobicContact CD1-CZ 4.11Å; I221-F226 WeakPolarHBondContact O-CB 3.36Å; N223-F226 PolarHBondContact O-N 3.34Å; N223-F226 PolarHBondContact OD1-N 3.27Å; F226-N228 PolarHBondContact O-N 3.25Å; F226-M229 HydrophobicContact CD1-CE 3.85Å; F226-M229 HydrophobicContact CE1-CE 3.98Å; F226-M229 WeakPolarHBondContact O-CB 3.37Å; F226-M229 PolarHBondContact O-N 2.63Å; F226-M229 VanDerWaalsContact O-N 3.14Å; F226-L230 WeakPolarHBondContact O-CG 3.45Å; F226-L230 PolarHBondContact O-N 3.36Å
227	I	90.8	Very high	90.7	Very high	22 Å²	22	48.2 Å²	48.2	11%	0.113	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-41.9	-177.3	-64.5	-62.8	0	0	0	111.1	N223 M229 L230 L231 L247 L267	N223-I227 WeakPolarHBondContact O-CG1 3.24Å; N223-I227 PolarHBondContact O-N 3.28Å; I227-M229 VanDerWaalsContact C-N 3.28Å; I227-M229 PolarHBondContact O-N 2.93Å; I227-L230 HydrophobicContact CD1-CD1 4.4Å; I227-L230 PolarHBondContact O-N 3.41Å; I227-L231 HydrophobicContact CG2-CD1 3.85Å; I227-L231 HydrophobicContact CG2-CG 4.41Å; I227-L231 WeakPolarHBondContact O-CD1 3.48Å; I227-L231 VanDerWaalsContact O-CG 3.26Å; I227-L231 WeakPolarHBondContact O-CG 3.4Å; I227-L231 PolarHBondContact O-N 2.78Å; I227-L247 HydrophobicContact CD1-CD2 3.94Å; I227-L267 HydrophobicContact CG2-CD1 4.21Å
228	N	91	Very high	90.7	Very high	99 Å²	99	48.4 Å²	48.4	53%	0.529	27%	0.271	S	S	.	.	H	α-helix	trans	-63	-34	175.9	-74.9	-43.4	0	0	0	112.8	D224 F226 G232	D224-N228 VanDerWaalsContact O-CB 3.25Å; D224-N228 WeakPolarHBondContact O-CB 3.47Å; D224-N228 PolarHBondContact O-N 2.96Å; D224-N228 PolarHBondContact O-ND2 2.85Å; F226-N228 PolarHBondContact O-N 3.25Å; N228-G232 PolarHBondContact O-N 3.21Å
229	M	93.3	Very high	90.9	Very high	18 Å²	18	47.7 Å²	47.7	9%	0.089	27%	0.267	C	S	.	.	H	α-helix	trans	-67.6	-44.8	174.8	-176	175.6	60.9	0	0	111.5	Y188 L191 F226 I227 L231 G232 H233	Y188-M229 HydrophobicContact CD2-CE 3.36Å; Y188-M229 HydrophobicContact CD2-SD 3.83Å; Y188-M229 HydrophobicContact CE2-CB 4.37Å; Y188-M229 HydrophobicContact CE2-CE 3.61Å; Y188-M229 HydrophobicContact CE2-SD 3.62Å; Y188-M229 HydrophobicContact CG-CE 4.15Å; Y188-M229 HydrophobicContact CG-SD 4.39Å; L191-M229 HydrophobicContact CB-CE 3.73Å; L191-M229 HydrophobicContact CB-SD 3.61Å; L191-M229 HydrophobicContact CD1-CE 3.44Å; L191-M229 VanDerWaalsContact CD1-CE 3.44Å; L191-M229 HydrophobicContact CD1-SD 4.43Å; L191-M229 HydrophobicContact CG-CE 4.23Å; F226-M229 HydrophobicContact CD1-CE 3.85Å; F226-M229 HydrophobicContact CE1-CE 3.98Å; F226-M229 WeakPolarHBondContact O-CB 3.37Å; F226-M229 PolarHBondContact O-N 2.63Å; F226-M229 VanDerWaalsContact O-N 3.14Å; I227-M229 VanDerWaalsContact C-N 3.28Å; I227-M229 PolarHBondContact O-N 2.93Å; M229-L231 VanDerWaalsContact C-N 3.32Å; M229-L231 PolarHBondContact O-N 3.23Å; M229-G232 PolarHBondContact O-N 2.87Å; M229-H233 PolarHBondContact O-CD2 3.18Å; M229-H233 PolarHBondContact O-N 3.27Å
230	L	92.8	Very high	91	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-41.5	176	-66.5	178.1	0	0	0	111.9	L206 F226 I227 G232 H233 M234 L247	L206-L230 HydrophobicContact CD2-CD2 3.34Å; F226-L230 WeakPolarHBondContact O-CG 3.45Å; F226-L230 PolarHBondContact O-N 3.36Å; I227-L230 HydrophobicContact CD1-CD1 4.4Å; I227-L230 PolarHBondContact O-N 3.41Å; L230-G232 VanDerWaalsContact C-N 3.34Å; L230-G232 PolarHBondContact O-N 3.1Å; L230-H233 CarbonylContact O-C 3.35Å; L230-H233 WeakPolarHBondContact O-CB 3.41Å; L230-H233 PolarHBondContact O-N 2.9Å; L230-H233 VanDerWaalsContact O-N 3.14Å; L230-M234 WeakPolarHBondContact O-CG 3.22Å; L230-M234 PolarHBondContact O-N 2.88Å; L230-L247 HydrophobicContact CB-CD2 4.25Å; L230-L247 HydrophobicContact CB-CG 4.42Å; L230-L247 HydrophobicContact CD1-CD2 3.64Å; L230-L247 HydrophobicContact CD1-CG 4.21Å
231	L	91.2	Very high	91	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-37.8	175.7	-67.9	162.7	0	0	0	112.6	I227 M229 H233 M234 S235 V270 L271 F276	I227-L231 HydrophobicContact CG2-CD1 3.85Å; I227-L231 HydrophobicContact CG2-CG 4.41Å; I227-L231 WeakPolarHBondContact O-CD1 3.48Å; I227-L231 VanDerWaalsContact O-CG 3.26Å; I227-L231 WeakPolarHBondContact O-CG 3.4Å; I227-L231 PolarHBondContact O-N 2.78Å; M229-L231 VanDerWaalsContact C-N 3.32Å; M229-L231 PolarHBondContact O-N 3.23Å; L231-H233 VanDerWaalsContact C-N 3.3Å; L231-H233 PolarHBondContact O-N 3.17Å; L231-M234 HydrophobicContact CD2-SD 4.37Å; L231-M234 PolarHBondContact O-N 2.88Å; L231-S235 PolarHBondContact O-N 3Å; L231-S235 PolarHBondContact O-OG 3.22Å; L231-V270 HydrophobicContact CD1-CB 4.14Å; L231-V270 HydrophobicContact CD1-CG1 3.15Å; L231-V270 HydrophobicContact CG-CG1 4.46Å; L231-L271 HydrophobicContact CD2-CD2 3.56Å; L231-L271 HydrophobicContact CD2-CG 4.26Å; L231-F276 HydrophobicContact CD2-CE2 4.16Å
232	G	91.2	Very high	91.1	Very high	28 Å²	28	48.5 Å²	48.5	29%	0.289	26%	0.261	S	S	.	.	H	α-helix	trans	-60.7	-40.3	171	0	0	0	0	0	111.9	N228 M229 L230 S235	N228-G232 PolarHBondContact O-N 3.21Å; M229-G232 PolarHBondContact O-N 2.87Å; L230-G232 VanDerWaalsContact C-N 3.34Å; L230-G232 PolarHBondContact O-N 3.1Å; G232-S235 WeakPolarHBondContact O-CB 3.47Å; G232-S235 PolarHBondContact O-N 3.25Å
233	H	92.8	Very high	91.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-70.1	-34.4	176	-66.1	-178.5	0	0	0	112.8	Q195 M229 L230 L231 S235 I236 L239 A243	Q195-H233 WeakPolarHBondContact CG-NE2 3.46Å; Q195-H233 PolarHBondContact NE2-CD2 3.14Å; Q195-H233 VanDerWaalsContact NE2-CD2 3.35Å; M229-H233 PolarHBondContact O-CD2 3.18Å; M229-H233 PolarHBondContact O-N 3.27Å; L230-H233 CarbonylContact O-C 3.35Å; L230-H233 WeakPolarHBondContact O-CB 3.41Å; L230-H233 PolarHBondContact O-N 2.9Å; L230-H233 VanDerWaalsContact O-N 3.14Å; L231-H233 VanDerWaalsContact C-N 3.3Å; L231-H233 PolarHBondContact O-N 3.17Å; H233-S235 PolarHBondContact O-N 3.04Å; H233-I236 WeakPolarHBondContact O-CB 3.47Å; H233-I236 PolarHBondContact O-N 2.87Å; H233-L239 HydrophobicContact CB-CB 4.23Å; H233-L239 HydrophobicContact CB-CD1 4.38Å; H233-A243 HydrophobicContact CB-CB 3.81Å
234	M	91.3	Very high	91.7	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-21.9	171.5	-73.4	-174.2	71.8	0	0	113.6	L230 L231 I236 R240 A243 C244 L247 L271 F276 F287 F291	L230-M234 WeakPolarHBondContact O-CG 3.22Å; L230-M234 PolarHBondContact O-N 2.88Å; L231-M234 HydrophobicContact CD2-SD 4.37Å; L231-M234 PolarHBondContact O-N 2.88Å; M234-I236 VanDerWaalsContact C-N 3.3Å; M234-R240 VanDerWaalsContact O-CB 3.25Å; M234-R240 WeakPolarHBondContact O-CB 3.45Å; M234-A243 HydrophobicContact CG-CB 3.73Å; M234-C244 HydrophobicContact CE-CB 4.24Å; M234-L247 HydrophobicContact SD-CD1 3.39Å; M234-L247 WeakPolarHBondContact SD-CD1 3.4Å; M234-L271 HydrophobicContact CE-CD2 4.07Å; M234-L271 HydrophobicContact SD-CD2 3.89Å; M234-F276 HydrophobicContact CB-CE1 3.78Å; M234-F276 HydrophobicContact CB-CE2 4.07Å; M234-F276 HydrophobicContact CB-CZ 3.37Å; M234-F276 HydrophobicContact CE-CD1 4.09Å; M234-F276 HydrophobicContact CE-CD2 4.37Å; M234-F276 HydrophobicContact CE-CE1 4.15Å; M234-F276 HydrophobicContact CE-CE2 4.41Å; M234-F276 HydrophobicContact CE-CG 4.22Å; M234-F276 HydrophobicContact CE-CZ 4.33Å; M234-F276 HydrophobicContact SD-CE2 4.42Å; M234-F287 HydrophobicContact CE-CE2 3.81Å; M234-F287 HydrophobicContact CE-CZ 3.65Å; M234-F291 HydrophobicContact CE-CD2 4.29Å
235	S	88.8	Confident	92	Very high	89 Å²	89	39.3 Å²	39.3	62%	0.622	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.2	175.7	-51.1	0	0	0	0	113	L231 G232 H233	L231-S235 PolarHBondContact O-N 3Å; L231-S235 PolarHBondContact O-OG 3.22Å; G232-S235 WeakPolarHBondContact O-CB 3.47Å; G232-S235 PolarHBondContact O-N 3.25Å; H233-S235 PolarHBondContact O-N 3.04Å
236	I	89.6	Confident	92.2	Very high	41 Å²	41	34.3 Å²	34.3	21%	0.21	19%	0.189	C	C	.	.	S	Bend	trans	-108.7	118.3	179.8	-61.5	170.8	0	0	0	108.4	Q195 Y196 H233 M234 V238 L239 R240	Q195-I236 HydrophobicContact CG-CD1 3.71Å; Y196-I236 HydrophobicContact CD1-CD1 4.41Å; Y196-I236 HydrophobicContact CE1-CD1 3.89Å; H233-I236 WeakPolarHBondContact O-CB 3.47Å; H233-I236 PolarHBondContact O-N 2.87Å; M234-I236 VanDerWaalsContact C-N 3.3Å; I236-V238 VanDerWaalsContact C-N 3.31Å; I236-V238 PolarHBondContact O-N 3.4Å; I236-V238 VanDerWaalsContact O-N 3.14Å; I236-L239 HydrophobicContact CB-CB 4.27Å; I236-L239 HydrophobicContact CB-CD1 4.22Å; I236-L239 HydrophobicContact CB-CG 4.33Å; I236-L239 HydrophobicContact CD1-CD1 3.98Å; I236-L239 HydrophobicContact CG2-CB 4.34Å; I236-L239 HydrophobicContact CG2-CD1 4.03Å; I236-L239 HydrophobicContact CG2-CG 3.95Å; I236-L239 PolarHBondContact O-N 3.11Å; I236-R240 WeakPolarHBondContact O-CB 3.37Å; I236-R240 PolarHBondContact O-N 3.35Å
237	E	87.6	Confident	92.3	Very high	154 Å²	154	34.1 Å²	34.1	72%	0.72	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47	-46.7	-173.6	-165.4	179	169.2	0	0	113.9	L239 R240	E237-L239 VanDerWaalsContact C-N 3.33Å; E237-L239 PolarHBondContact O-N 3.48Å; E237-R240 WeakPolarHBondContact O-CG 3.06Å
238	V	90.5	Very high	92.5	Very high	97 Å²	97	34.2 Å²	34.2	59%	0.588	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-17.4	-176.1	-169.6	0	0	0	0	113.4	I236	I236-V238 VanDerWaalsContact C-N 3.31Å; I236-V238 PolarHBondContact O-N 3.4Å; I236-V238 VanDerWaalsContact O-N 3.14Å
239	L	92	Very high	92.7	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-13	-173.9	-57.3	-179.5	0	0	0	113.2	T202 H233 I236 E237 E241 E242 A243	T202-L239 HydrophobicContact CG2-CD1 3.79Å; T202-L239 HydrophobicContact CG2-CD2 3.86Å; T202-L239 HydrophobicContact CG2-CG 4.45Å; H233-L239 HydrophobicContact CB-CB 4.23Å; H233-L239 HydrophobicContact CB-CD1 4.38Å; I236-L239 HydrophobicContact CB-CB 4.27Å; I236-L239 HydrophobicContact CB-CD1 4.22Å; I236-L239 HydrophobicContact CB-CG 4.33Å; I236-L239 HydrophobicContact CD1-CD1 3.98Å; I236-L239 HydrophobicContact CG2-CB 4.34Å; I236-L239 HydrophobicContact CG2-CD1 4.03Å; I236-L239 HydrophobicContact CG2-CG 3.95Å; I236-L239 PolarHBondContact O-N 3.11Å; E237-L239 VanDerWaalsContact C-N 3.33Å; E237-L239 PolarHBondContact O-N 3.48Å; L239-E241 PolarHBondContact O-N 2.75Å; L239-E242 PolarHBondContact O-N 2.86Å; L239-A243 WeakPolarHBondContact O-CB 3.32Å; L239-A243 PolarHBondContact O-N 3.22Å
240	R	92.5	Very high	92.7	Very high	25 Å²	25	31.7 Å²	31.7	9%	0.094	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-36.2	-165	66.7	-171.4	-57.5	-167.9	9.3	114	M234 I236 E237 C244 E282 D284 F287	M234-R240 VanDerWaalsContact O-CB 3.25Å; M234-R240 WeakPolarHBondContact O-CB 3.45Å; I236-R240 WeakPolarHBondContact O-CB 3.37Å; I236-R240 PolarHBondContact O-N 3.35Å; E237-R240 WeakPolarHBondContact O-CG 3.06Å; R240-C244 VanDerWaalsContact O-CB 3.24Å; R240-C244 WeakPolarHBondContact O-CB 3.35Å; R240-C244 PolarHBondContact O-N 3.39Å; R240-E282 IonicContact CZ-OE1 3.73Å; R240-E282 IonicContact CZ-OE2 3.14Å; R240-E282 IonicContact NH1-OE1 3.73Å; R240-E282 PolarHBondContact NH1-OE1 3.19Å; R240-E282 IonicContact NH1-OE2 4Å; R240-E282 IonicContact NH2-OE1 3.91Å; R240-E282 PolarHBondContact NH2-OE1 3.01Å; R240-E282 VanDerWaalsContact NH2-OE1 3.13Å; R240-E282 IonicContact NH2-OE2 2.9Å; R240-E282 PolarHBondContact NH2-OE2 3.45Å; R240-D284 WeakPolarHBondContact CD-OD2 3.48Å; R240-D284 IonicContact CZ-OD2 3.04Å; R240-D284 IonicContact NE-OD2 3.96Å; R240-D284 IonicContact NH1-OD2 3.96Å; R240-D284 PolarHBondContact NH1-OD2 2.8Å; R240-F287 HydrophobicContact CB-CD2 3.8Å; R240-F287 HydrophobicContact CB-CE2 3.91Å; R240-F287 HydrophobicContact CG-CB 4.17Å; R240-F287 HydrophobicContact CG-CD2 3.53Å; R240-F287 HydrophobicContact CG-CE2 4.17Å; R240-F287 HydrophobicContact CG-CG 4.08Å
241	E	93.2	Very high	92.7	Very high	61 Å²	61	31.6 Å²	31.6	29%	0.285	17%	0.172	S	C	.	.	H	α-helix	trans	-63.9	-55	177.6	-71.1	-177.7	-123.3	0	0	111.2	L239 A243 C244 D245 R290	L239-E241 PolarHBondContact O-N 2.75Å; E241-A243 VanDerWaalsContact C-N 3.31Å; E241-A243 PolarHBondContact O-N 2.89Å; E241-C244 WeakPolarHBondContact O-CA 3.16Å; E241-C244 WeakPolarHBondContact O-CB 3.31Å; E241-C244 PolarHBondContact O-N 3.04Å; E241-D245 PolarHBondContact O-N 3.09Å; E241-R290 HydrophobicContact CB-CG 4Å; E241-R290 HydrophobicContact CG-CG 3.97Å; E241-R290 IonicContact OE2-NE 3.01Å
242	E	94.7	Very high	92.8	Very high	44 Å²	44	34.1 Å²	34.1	21%	0.206	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-35.2	179.9	-64.2	-54.9	146.3	0	0	112.5	C203 L206 E207 L239 C244 C246	C203-E242 HydrophobicContact CB-CG 3.9Å; L206-E242 HydrophobicContact CB-CB 4.02Å; L206-E242 HydrophobicContact CD1-CB 3.87Å; E207-E242 WeakPolarHBondContact CG-OE2 3.37Å; L239-E242 PolarHBondContact O-N 2.86Å; E242-C244 VanDerWaalsContact C-N 3.31Å; E242-C246 VanDerWaalsContact O-CB 3.29Å; E242-C246 WeakPolarHBondContact O-CB 3.42Å; E242-C246 PolarHBondContact O-N 3.07Å
243	A	94.8	Very high	92.8	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.8	-37.8	174.1	0	0	0	0	0	111.3	L206 H233 M234 L239 E241 L247	L206-A243 HydrophobicContact CD1-CB 4.14Å; H233-A243 HydrophobicContact CB-CB 3.81Å; M234-A243 HydrophobicContact CG-CB 3.73Å; L239-A243 WeakPolarHBondContact O-CB 3.32Å; L239-A243 PolarHBondContact O-N 3.22Å; E241-A243 VanDerWaalsContact C-N 3.31Å; E241-A243 PolarHBondContact O-N 2.89Å; A243-L247 WeakPolarHBondContact O-CG 3.32Å; A243-L247 PolarHBondContact O-N 3.21Å; A243-L247 VanDerWaalsContact O-N 3.12Å
244	C	95.3	Very high	92.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-45.8	176.3	-171.2	0	0	0	0	112.1	M234 R240 E241 E242 C246 L247 F248 F287 R290 F291	M234-C244 HydrophobicContact CE-CB 4.24Å; R240-C244 VanDerWaalsContact O-CB 3.24Å; R240-C244 WeakPolarHBondContact O-CB 3.35Å; R240-C244 PolarHBondContact O-N 3.39Å; E241-C244 WeakPolarHBondContact O-CA 3.16Å; E241-C244 WeakPolarHBondContact O-CB 3.31Å; E241-C244 PolarHBondContact O-N 3.04Å; E242-C244 VanDerWaalsContact C-N 3.31Å; C244-C246 VanDerWaalsContact C-N 3.32Å; C244-C246 PolarHBondContact O-N 3.06Å; C244-L247 PolarHBondContact O-N 3.2Å; C244-F248 PolarHBondContact O-N 3Å; C244-F287 HydrophobicContact CB-CE2 4.22Å; C244-R290 HydrophobicContact CB-CB 4.23Å; C244-R290 VanDerWaalsContact SG-C 3.6Å; C244-R290 PolarHBondContact SG-O 3.01Å; C244-F291 VanDerWaalsContact SG-CA 3.59Å
245	D	95.3	Very high	92.4	Very high	21 Å²	21	40.2 Å²	40.2	11%	0.112	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-38.3	175.3	-91.5	-35	0	0	0	111.4	E241 L247 F248 E249 R290 K293	E241-D245 PolarHBondContact O-N 3.09Å; D245-L247 VanDerWaalsContact C-N 3.34Å; D245-L247 PolarHBondContact O-N 3.33Å; D245-F248 WeakPolarHBondContact O-CB 3.28Å; D245-F248 PolarHBondContact O-N 3.24Å; D245-F248 VanDerWaalsContact O-N 3.1Å; D245-E249 PolarHBondContact O-N 3.4Å; D245-R290 IonicContact OD1-NH1 3.66Å; D245-R290 WeakPolarHBondContact OD2-CD 3.38Å; D245-R290 IonicContact OD2-CZ 2.88Å; D245-R290 IonicContact OD2-NE 3.47Å; D245-R290 IonicContact OD2-NH1 3.82Å; D245-R290 PolarHBondContact OD2-NH1 2.85Å; D245-K293 IonicContact OD1-NZ 3.03Å; D245-K293 PolarHBondContact OD1-NZ 3.12Å
246	C	95.1	Very high	92.5	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-41.2	172.9	-177.9	0	0	0	0	112.3	L206 E242 C244 F248 E249 V250	L206-C246 HydrophobicContact CD2-CB 4.48Å; E242-C246 VanDerWaalsContact O-CB 3.29Å; E242-C246 WeakPolarHBondContact O-CB 3.42Å; E242-C246 PolarHBondContact O-N 3.07Å; C244-C246 VanDerWaalsContact C-N 3.32Å; C244-C246 PolarHBondContact O-N 3.06Å; C246-F248 VanDerWaalsContact C-N 3.32Å; C246-E249 PolarHBondContact O-N 3.39Å; C246-V250 WeakPolarHBondContact O-CG2 3.38Å; C246-V250 PolarHBondContact O-N 2.99Å
247	L	95.2	Very high	92.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-33.9	174.1	-73.9	176.6	0	0	0	112.2	I227 L230 M234 A243 C244 D245 V250 V251 L267 L271 L294	I227-L247 HydrophobicContact CD1-CD2 3.94Å; L230-L247 HydrophobicContact CB-CD2 4.25Å; L230-L247 HydrophobicContact CB-CG 4.42Å; L230-L247 HydrophobicContact CD1-CD2 3.64Å; L230-L247 HydrophobicContact CD1-CG 4.21Å; M234-L247 HydrophobicContact SD-CD1 3.39Å; M234-L247 WeakPolarHBondContact SD-CD1 3.4Å; A243-L247 WeakPolarHBondContact O-CG 3.32Å; A243-L247 PolarHBondContact O-N 3.21Å; A243-L247 VanDerWaalsContact O-N 3.12Å; C244-L247 PolarHBondContact O-N 3.2Å; D245-L247 VanDerWaalsContact C-N 3.34Å; D245-L247 PolarHBondContact O-N 3.33Å; L247-V250 WeakPolarHBondContact O-CB 3.45Å; L247-V250 PolarHBondContact O-N 2.81Å; L247-V251 WeakPolarHBondContact O-CG2 3.41Å; L247-V251 PolarHBondContact O-N 2.91Å; L247-L267 HydrophobicContact CD1-CD1 4.4Å; L247-L267 HydrophobicContact CD2-CD1 4Å; L247-L267 HydrophobicContact CD2-CD2 4.4Å; L247-L271 HydrophobicContact CD1-CD2 4.42Å; L247-L294 HydrophobicContact CB-CD1 4.17Å; L247-L294 HydrophobicContact CB-CD2 4.23Å
248	F	95.3	Very high	93	Very high	25 Å²	25	32.5 Å²	32.5	11%	0.11	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-42.9	175.4	170.3	-102.4	0	0	0	111.3	C244 D245 C246 V250 V251 N252 K293 L294	C244-F248 PolarHBondContact O-N 3Å; D245-F248 WeakPolarHBondContact O-CB 3.28Å; D245-F248 PolarHBondContact O-N 3.24Å; D245-F248 VanDerWaalsContact O-N 3.1Å; C246-F248 VanDerWaalsContact C-N 3.32Å; F248-V250 VanDerWaalsContact C-N 3.33Å; F248-V250 PolarHBondContact O-N 3.07Å; F248-V251 WeakPolarHBondContact O-CB 2.87Å; F248-V251 PolarHBondContact O-N 3.21Å; F248-V251 VanDerWaalsContact O-N 3.11Å; F248-N252 VanDerWaalsContact CD1-ND2 3.3Å; F248-N252 WeakPolarHBondContact CD1-ND2 3.43Å; F248-N252 WeakPolarHBondContact CD2-ND2 3.23Å; F248-N252 WeakPolarHBondContact CE1-ND2 3.41Å; F248-N252 WeakPolarHBondContact CE2-ND2 3.39Å; F248-N252 WeakPolarHBondContact CZ-ND2 3.35Å; F248-N252 PolarHBondContact O-N 3.38Å; F248-N252 PolarHBondContact O-ND2 2.91Å; F248-K293 HydrophobicContact CD2-CG 4.12Å; F248-K293 WeakPolarHBondContact CD2-O 3.47Å; F248-K293 HydrophobicContact CE1-CD 4.35Å; F248-K293 HydrophobicContact CE1-CG 4.34Å; F248-K293 HydrophobicContact CE2-CG 3.75Å; F248-K293 VanDerWaalsContact CE2-O 3.29Å; F248-K293 WeakPolarHBondContact CE2-O 3.41Å; F248-K293 HydrophobicContact CZ-CD 4.29Å; F248-K293 HydrophobicContact CZ-CG 3.83Å; F248-L294 HydrophobicContact CB-CB 4.5Å; F248-L294 HydrophobicContact CB-CD1 4.03Å
249	E	94.3	Very high	93.1	Very high	63 Å²	63	31.7 Å²	31.7	29%	0.294	18%	0.178	S	C	.	.	H	α-helix	trans	-63.1	-37.8	174.5	-67.4	-52.6	135.5	0	0	112.7	V213 D245 C246 V251 N252 K253	V213-E249 HydrophobicContact CG1-CB 4.38Å; V213-E249 WeakPolarHBondContact CG1-O 3.47Å; D245-E249 PolarHBondContact O-N 3.4Å; C246-E249 PolarHBondContact O-N 3.39Å; E249-V251 VanDerWaalsContact C-N 3.3Å; E249-V251 PolarHBondContact O-N 3.3Å; E249-N252 PolarHBondContact O-N 2.7Å; E249-K253 PolarHBondContact O-N 3.17Å
250	V	93.6	Very high	93.1	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-42.2	172.1	168.2	0	0	0	0	111.2	V213 L218 I221 A222 C246 L247 F248 L263	V213-V250 HydrophobicContact CG1-CG2 4.04Å; V213-V250 HydrophobicContact CG2-CG2 4.04Å; L218-V250 HydrophobicContact CD1-CG1 4.19Å; I221-V250 HydrophobicContact CG2-CG2 4.01Å; A222-V250 HydrophobicContact CB-CG1 4.49Å; C246-V250 WeakPolarHBondContact O-CG2 3.38Å; C246-V250 PolarHBondContact O-N 2.99Å; L247-V250 WeakPolarHBondContact O-CB 3.45Å; L247-V250 PolarHBondContact O-N 2.81Å; F248-V250 VanDerWaalsContact C-N 3.33Å; F248-V250 PolarHBondContact O-N 3.07Å; V250-L263 HydrophobicContact CG1-CD2 4.41Å
251	V	93.6	Very high	93.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-69.2	-38.9	177.8	171	0	0	0	0	111.9	L247 F248 E249 K253 K260 V264 L267 L294 M298 S301	L247-V251 WeakPolarHBondContact O-CG2 3.41Å; L247-V251 PolarHBondContact O-N 2.91Å; F248-V251 WeakPolarHBondContact O-CB 2.87Å; F248-V251 PolarHBondContact O-N 3.21Å; F248-V251 VanDerWaalsContact O-N 3.11Å; E249-V251 VanDerWaalsContact C-N 3.3Å; E249-V251 PolarHBondContact O-N 3.3Å; V251-K253 PolarHBondContact O-N 2.82Å; V251-K260 VanDerWaalsContact O-CE 3.22Å; V251-K260 WeakPolarHBondContact O-CE 3.37Å; V251-K260 PolarHBondContact O-NZ 3.46Å; V251-V264 HydrophobicContact CG1-CG2 4.26Å; V251-L267 HydrophobicContact CG2-CD2 3.63Å; V251-L294 HydrophobicContact CG2-CD1 4.01Å; V251-M298 HydrophobicContact CG1-CB 4.44Å; V251-M298 HydrophobicContact CG1-CG 3.96Å; V251-M298 HydrophobicContact CG2-CE 4.22Å; V251-M298 HydrophobicContact CG2-CG 4.02Å; V251-S301 PolarHBondContact O-OG 3.33Å
252	N	91.8	Very high	93.1	Very high	63 Å²	63	34.4 Å²	34.4	34%	0.337	19%	0.19	S	C	.	.	H	α-helix	trans	-79.5	-15	-175.3	-73.3	-31.3	0	0	0	115.4	F248 E249 G254	F248-N252 VanDerWaalsContact CD1-ND2 3.3Å; F248-N252 WeakPolarHBondContact CD1-ND2 3.43Å; F248-N252 WeakPolarHBondContact CD2-ND2 3.23Å; F248-N252 WeakPolarHBondContact CE1-ND2 3.41Å; F248-N252 WeakPolarHBondContact CE2-ND2 3.39Å; F248-N252 WeakPolarHBondContact CZ-ND2 3.35Å; F248-N252 PolarHBondContact O-N 3.38Å; F248-N252 PolarHBondContact O-ND2 2.91Å; E249-N252 PolarHBondContact O-N 2.7Å; N252-G254 PolarHBondContact O-N 3.28Å
253	K	91.3	Very high	93.1	Very high	25 Å²	25	33.8 Å²	33.8	11%	0.109	19%	0.187	C	C	.	.	S	Bend	trans	-53.4	132.1	179.5	-173.9	178	-173.1	154.1	0	112.8	V213 I216 L218 E249 V251 M255 K260	V213-K253 HydrophobicContact CG1-CB 4.45Å; V213-K253 HydrophobicContact CG1-CD 4.28Å; V213-K253 VanDerWaalsContact O-CD 3.23Å; V213-K253 WeakPolarHBondContact O-CD 3.5Å; V213-K253 WeakPolarHBondContact O-CE 3.33Å; V213-K253 PolarHBondContact O-NZ 3.47Å; I216-K253 VanDerWaalsContact O-CE 3.31Å; I216-K253 WeakPolarHBondContact O-CE 3.15Å; I216-K253 PolarHBondContact O-NZ 3.41Å; L218-K253 VanDerWaalsContact CA-NZ 3.33Å; L218-K253 HydrophobicContact CB-CD 3.85Å; L218-K253 HydrophobicContact CD1-CD 3.66Å; L218-K253 HydrophobicContact CD2-CD 4.07Å; L218-K253 HydrophobicContact CG-CD 4.04Å; E249-K253 PolarHBondContact O-N 3.17Å; V251-K253 PolarHBondContact O-N 2.82Å; K253-M255 PolarHBondContact O-N 2.63Å; K253-K260 WeakPolarHBondContact O-CE 3.45Å; K253-K260 PolarHBondContact O-NZ 3.1Å
254	G	87.8	Confident	93	Very high	75 Å²	75	33.8 Å²	33.8	77%	0.773	19%	0.187	S	C	*	.			trans	-63.4	127.1	176.8	0	0	0	0	0	112.7	N252	N252-G254 PolarHBondContact O-N 3.28Å
255	M	88	Confident	93	Very high	57 Å²	57	36 Å²	36	28%	0.281	20%	0.198	S	C	.	.			trans	-152.3	176.8	175	73.8	-155.3	-56.2	0	0	111.9	L218 K253 D259 K260 L263	L218-M255 HydrophobicContact CD2-CE 3.65Å; L218-M255 HydrophobicContact CD2-SD 4.19Å; K253-M255 PolarHBondContact O-N 2.63Å; M255-D259 HydrophobicContact CE-CB 4.13Å; M255-K260 HydrophobicContact CG-CB 3.48Å; M255-K260 VanDerWaalsContact CG-CB 3.48Å; M255-K260 HydrophobicContact CG-CD 4.11Å; M255-K260 VanDerWaalsContact CG-CE 3.5Å; M255-K260 HydrophobicContact CG-CG 4.25Å; M255-K260 WeakPolarHBondContact SD-CA 3.36Å; M255-K260 HydrophobicContact SD-CB 3.73Å; M255-K260 HydrophobicContact SD-CD 3.56Å; M255-K260 VanDerWaalsContact SD-CD 3.56Å; M255-K260 WeakPolarHBondContact SD-CE 3.47Å; M255-K260 HydrophobicContact SD-CG 4.2Å; M255-K260 PolarHBondContact SD-NZ 3Å; M255-L263 HydrophobicContact CE-CD2 4.14Å; M255-L263 HydrophobicContact SD-CD2 3.82Å
256	D	92.1	Very high	92.8	Very high	89 Å²	89	38.2 Å²	38.2	48%	0.476	22%	0.215	S	C	.	.			trans	-60.2	140.5	174.1	-176.1	-88.9	0	0	0	111.1	V258 D259 K260	D256-V258 VanDerWaalsContact C-N 3.31Å; D256-V258 PolarHBondContact O-N 3.37Å; D256-V258 PolarHBondContact OD1-N 3.07Å; D256-D259 PolarHBondContact O-N 3.48Å; D256-K260 WeakPolarHBondContact O-CB 3.2Å; D256-K260 PolarHBondContact O-N 2.96Å
257	P	92.5	Very high	92.7	Very high	9 Å²	9	38.4 Å²	38.4	6%	0.058	22%	0.216	C	C	.	.	H	α-helix	trans	-54.3	-39.1	-176.8	-29.9	37.9	0	0	0	115.5	M261 S305 K308 L309	P257-M261 PolarHBondContact O-N 3.39Å; P257-S305 PolarHBondContact O-OG 3.44Å; P257-K308 HydrophobicContact CG-CB 3.69Å; P257-K308 HydrophobicContact CG-CD 3.88Å; P257-K308 HydrophobicContact CG-CG 4.46Å; P257-L309 HydrophobicContact CB-CD1 4.01Å; P257-L309 HydrophobicContact CB-CD2 3.89Å; P257-L309 HydrophobicContact CB-CG 3.65Å; P257-L309 HydrophobicContact CG-CG 4.45Å
258	V	93.6	Very high	92.6	Very high	24 Å²	24	38.9 Å²	38.9	15%	0.145	22%	0.219	C	C	.	.	H	α-helix	trans	-73.4	-42.2	-176.2	179.7	0	0	0	0	110.5	D256 K260 M261 K262 L309 N317	D256-V258 VanDerWaalsContact C-N 3.31Å; D256-V258 PolarHBondContact O-N 3.37Å; D256-V258 PolarHBondContact OD1-N 3.07Å; V258-K260 VanDerWaalsContact C-N 3.34Å; V258-M261 PolarHBondContact O-N 2.88Å; V258-K262 WeakPolarHBondContact O-CG 3.33Å; V258-K262 PolarHBondContact O-N 3.39Å; V258-K262 VanDerWaalsContact O-N 3.14Å; V258-L309 HydrophobicContact CG2-CD2 3.91Å; V258-N317 HydrophobicContact CG2-CB 4.21Å
259	D	92.4	Very high	92.3	Very high	80 Å²	80	43.4 Å²	43.4	43%	0.428	24%	0.24	S	C	.	.	H	α-helix	trans	-69.9	-34.4	177.8	-65.2	-29.5	0	0	0	111.4	M255 D256 K262 L263	M255-D259 HydrophobicContact CE-CB 4.13Å; D256-D259 PolarHBondContact O-N 3.48Å; D259-K262 PolarHBondContact O-N 3.4Å; D259-K262 IonicContact OD1-NZ 3.73Å; D259-L263 WeakPolarHBondContact O-CB 3.45Å; D259-L263 PolarHBondContact O-N 3.39Å
260	K	93.6	Very high	92.2	Very high	10 Å²	10	42.7 Å²	42.7	4%	0.043	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-46.2	171.6	-176.5	57.5	78.8	-164	0	111.7	V251 K253 M255 D256 V258 K262 L263 V264	V251-K260 VanDerWaalsContact O-CE 3.22Å; V251-K260 WeakPolarHBondContact O-CE 3.37Å; V251-K260 PolarHBondContact O-NZ 3.46Å; K253-K260 WeakPolarHBondContact O-CE 3.45Å; K253-K260 PolarHBondContact O-NZ 3.1Å; M255-K260 HydrophobicContact CG-CB 3.48Å; M255-K260 VanDerWaalsContact CG-CB 3.48Å; M255-K260 HydrophobicContact CG-CD 4.11Å; M255-K260 VanDerWaalsContact CG-CE 3.5Å; M255-K260 HydrophobicContact CG-CG 4.25Å; M255-K260 WeakPolarHBondContact SD-CA 3.36Å; M255-K260 HydrophobicContact SD-CB 3.73Å; M255-K260 HydrophobicContact SD-CD 3.56Å; M255-K260 VanDerWaalsContact SD-CD 3.56Å; M255-K260 WeakPolarHBondContact SD-CE 3.47Å; M255-K260 HydrophobicContact SD-CG 4.2Å; M255-K260 PolarHBondContact SD-NZ 3Å; D256-K260 WeakPolarHBondContact O-CB 3.2Å; D256-K260 PolarHBondContact O-N 2.96Å; V258-K260 VanDerWaalsContact C-N 3.34Å; K260-K262 PolarHBondContact O-N 2.95Å; K260-L263 PolarHBondContact O-N 2.75Å; K260-V264 HydrophobicContact CD-CG2 4.02Å; K260-V264 HydrophobicContact CG-CG2 4.45Å; K260-V264 WeakPolarHBondContact O-CG2 3.34Å; K260-V264 PolarHBondContact O-N 3.49Å
261	M	93.4	Very high	92.1	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.059	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-47.7	178.6	-177.3	-179.4	70.9	0	0	111.1	P257 V258 L263 V264 E265 L302 E320 A321	P257-M261 PolarHBondContact O-N 3.39Å; V258-M261 PolarHBondContact O-N 2.88Å; M261-L263 PolarHBondContact O-N 3.25Å; M261-V264 PolarHBondContact O-N 2.67Å; M261-E265 WeakPolarHBondContact O-CB 3.3Å; M261-E265 WeakPolarHBondContact O-CG 3.29Å; M261-E265 PolarHBondContact O-N 3.48Å; M261-L302 HydrophobicContact CB-CD2 4.31Å; M261-L302 HydrophobicContact CG-CD2 4.1Å; M261-E320 HydrophobicContact CE-CB 4.04Å; M261-E320 HydrophobicContact SD-CB 4.04Å; M261-A321 VanDerWaalsContact SD-CA 3.52Å; M261-A321 HydrophobicContact SD-CB 3.75Å; M261-A321 PolarHBondContact SD-N 3.43Å; M261-A321 VanDerWaalsContact SD-N 3.4Å
262	K	92.4	Very high	91.9	Very high	124 Å²	124	48.5 Å²	48.5	54%	0.539	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-42.7	177.8	-68.7	172	-172.3	161.7	0	112.8	V258 D259 K260 S266	V258-K262 WeakPolarHBondContact O-CG 3.33Å; V258-K262 PolarHBondContact O-N 3.39Å; V258-K262 VanDerWaalsContact O-N 3.14Å; D259-K262 PolarHBondContact O-N 3.4Å; D259-K262 IonicContact OD1-NZ 3.73Å; K260-K262 PolarHBondContact O-N 2.95Å; K262-S266 VanDerWaalsContact O-CB 3.29Å; K262-S266 WeakPolarHBondContact O-CB 3.12Å; K262-S266 PolarHBondContact O-N 2.84Å
263	L	92.9	Very high	91.8	Very high	30 Å²	30	50.7 Å²	50.7	16%	0.157	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-50.5	177.4	175	68.9	0	0	0	111.2	L218 A222 V250 M255 D259 K260 M261 S266 L267	L218-L263 HydrophobicContact CD2-CD2 3.72Å; A222-L263 HydrophobicContact CB-CD1 3.9Å; V250-L263 HydrophobicContact CG1-CD2 4.41Å; M255-L263 HydrophobicContact CE-CD2 4.14Å; M255-L263 HydrophobicContact SD-CD2 3.82Å; D259-L263 WeakPolarHBondContact O-CB 3.45Å; D259-L263 PolarHBondContact O-N 3.39Å; K260-L263 PolarHBondContact O-N 2.75Å; M261-L263 PolarHBondContact O-N 3.25Å; L263-S266 PolarHBondContact O-N 3.41Å; L263-L267 WeakPolarHBondContact O-CB 3.5Å; L263-L267 PolarHBondContact O-N 2.98Å
264	V	94.2	Very high	91.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-42.7	-178.4	174	0	0	0	0	111.2	V251 K260 M261 L267 C268 M298 L302	V251-V264 HydrophobicContact CG1-CG2 4.26Å; K260-V264 HydrophobicContact CD-CG2 4.02Å; K260-V264 HydrophobicContact CG-CG2 4.45Å; K260-V264 WeakPolarHBondContact O-CG2 3.34Å; K260-V264 PolarHBondContact O-N 3.49Å; M261-V264 PolarHBondContact O-N 2.67Å; V264-L267 PolarHBondContact O-N 3.37Å; V264-C268 WeakPolarHBondContact O-CB 3.33Å; V264-C268 PolarHBondContact O-N 3.32Å; V264-M298 HydrophobicContact CG1-CB 3.82Å; V264-M298 HydrophobicContact CG1-CG 4.02Å; V264-M298 HydrophobicContact CG1-SD 4.4Å; V264-L302 HydrophobicContact CB-CD2 4.06Å; V264-L302 HydrophobicContact CB-CG 4.33Å; V264-L302 HydrophobicContact CG1-CD1 3.86Å; V264-L302 HydrophobicContact CG1-CD2 4.07Å; V264-L302 HydrophobicContact CG1-CG 3.86Å
265	E	93.9	Very high	91.5	Very high	48 Å²	48	50 Å²	50	22%	0.224	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-44.5	176.4	-75.1	-57.1	112.5	0	0	112.2	M261 C268 Q269 A324 K328	M261-E265 WeakPolarHBondContact O-CB 3.3Å; M261-E265 WeakPolarHBondContact O-CG 3.29Å; M261-E265 PolarHBondContact O-N 3.48Å; E265-C268 PolarHBondContact O-N 3.34Å; E265-Q269 WeakPolarHBondContact O-CG 3.37Å; E265-Q269 PolarHBondContact O-N 2.93Å; E265-A324 HydrophobicContact CG-CB 4.3Å; E265-A324 VanDerWaalsContact OE1-CB 3.22Å; E265-A324 WeakPolarHBondContact OE1-CB 3.39Å; E265-K328 WeakPolarHBondContact OE1-CE 3.25Å; E265-K328 IonicContact OE1-NZ 3.89Å; E265-K328 PolarHBondContact OE1-NZ 3.06Å; E265-K328 IonicContact OE2-NZ 3.02Å
266	S	92.7	Very high	91.5	Very high	67 Å²	67	48.5 Å²	48.5	47%	0.469	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-50.2	176.6	-176.6	0	0	0	0	110.9	K262 L263 C268 Q269 V270	K262-S266 VanDerWaalsContact O-CB 3.29Å; K262-S266 WeakPolarHBondContact O-CB 3.12Å; K262-S266 PolarHBondContact O-N 2.84Å; L263-S266 PolarHBondContact O-N 3.41Å; S266-C268 VanDerWaalsContact C-N 3.34Å; S266-C268 PolarHBondContact O-N 3.44Å; S266-Q269 PolarHBondContact O-N 3.2Å; S266-V270 WeakPolarHBondContact O-CG2 3.29Å; S266-V270 PolarHBondContact O-N 2.96Å; S266-V270 VanDerWaalsContact O-N 3.14Å
267	L	92.1	Very high	91.3	Very high	6 Å²	6	46.2 Å²	46.2	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-40.8	179.7	-175.2	61.3	0	0	0	111.9	I227 L247 V251 L263 V264 Q269 V270 L271 M298	I227-L267 HydrophobicContact CG2-CD1 4.21Å; L247-L267 HydrophobicContact CD1-CD1 4.4Å; L247-L267 HydrophobicContact CD2-CD1 4Å; L247-L267 HydrophobicContact CD2-CD2 4.4Å; V251-L267 HydrophobicContact CG2-CD2 3.63Å; L263-L267 WeakPolarHBondContact O-CB 3.5Å; L263-L267 PolarHBondContact O-N 2.98Å; V264-L267 PolarHBondContact O-N 3.37Å; L267-Q269 PolarHBondContact O-N 3.43Å; L267-V270 PolarHBondContact O-N 2.94Å; L267-L271 HydrophobicContact CD1-CD1 4.41Å; L267-L271 HydrophobicContact CD1-CG 4.36Å; L267-L271 HydrophobicContact CG-CD1 3.99Å; L267-L271 HydrophobicContact CG-CG 4.4Å; L267-L271 WeakPolarHBondContact O-CB 3.29Å; L267-L271 WeakPolarHBondContact O-CG 3.38Å; L267-L271 PolarHBondContact O-N 3.44Å; L267-M298 HydrophobicContact CB-CE 4.47Å; L267-M298 HydrophobicContact CD2-CE 3.47Å; L267-M298 VanDerWaalsContact CD2-CE 3.47Å; L267-M298 HydrophobicContact CG-CE 3.77Å
268	C	92.1	Very high	90.9	Very high	10 Å²	10	48.4 Å²	48.4	7%	0.068	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-44.6	176	-178.6	0	0	0	0	111.9	V264 E265 S266 V270 L271 Q272 F277	V264-C268 WeakPolarHBondContact O-CB 3.33Å; V264-C268 PolarHBondContact O-N 3.32Å; E265-C268 PolarHBondContact O-N 3.34Å; S266-C268 VanDerWaalsContact C-N 3.34Å; S266-C268 PolarHBondContact O-N 3.44Å; C268-V270 VanDerWaalsContact C-N 3.35Å; C268-V270 PolarHBondContact O-N 3.37Å; C268-L271 PolarHBondContact O-N 2.89Å; C268-Q272 WeakPolarHBondContact O-CB 3.13Å; C268-Q272 PolarHBondContact O-N 3.24Å; C268-F277 VanDerWaalsContact SG-CZ 3.58Å
269	Q	91	Very high	90.4	Very high	119 Å²	119	47.7 Å²	47.7	56%	0.556	27%	0.272	S	S	*	.	H	α-helix	trans	-62.6	-41.4	177.7	-73.5	175.4	8.8	0	0	112.2	E265 S266 L267 S273	E265-Q269 WeakPolarHBondContact O-CG 3.37Å; E265-Q269 PolarHBondContact O-N 2.93Å; S266-Q269 PolarHBondContact O-N 3.2Å; L267-Q269 PolarHBondContact O-N 3.43Å; Q269-S273 WeakPolarHBondContact O-CB 3.46Å; Q269-S273 PolarHBondContact O-N 3.02Å; Q269-S273 PolarHBondContact O-OG 3.42Å
270	V	90.9	Very high	89.8	Confident	48 Å²	48	50.8 Å²	50.8	29%	0.291	29%	0.289	S	S	.	.	H	α-helix	trans	-72.2	-41.5	-179.3	-170.5	0	0	0	0	111.2	L231 S266 L267 C268 Q272 S273 A274	L231-V270 HydrophobicContact CD1-CB 4.14Å; L231-V270 HydrophobicContact CD1-CG1 3.15Å; L231-V270 HydrophobicContact CG-CG1 4.46Å; S266-V270 WeakPolarHBondContact O-CG2 3.29Å; S266-V270 PolarHBondContact O-N 2.96Å; S266-V270 VanDerWaalsContact O-N 3.14Å; L267-V270 PolarHBondContact O-N 2.94Å; C268-V270 VanDerWaalsContact C-N 3.35Å; C268-V270 PolarHBondContact O-N 3.37Å; V270-Q272 VanDerWaalsContact C-N 3.34Å; V270-Q272 PolarHBondContact O-N 3.01Å; V270-S273 PolarHBondContact O-N 2.9Å; V270-A274 WeakPolarHBondContact O-CB 3.48Å; V270-A274 PolarHBondContact O-N 3.11Å
271	L	91.7	Very high	89.1	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-43.3	174.2	-73.8	169.2	0	0	0	112.1	L231 M234 L247 L267 C268 A274 G275 F276 F277 L294 M298	L231-L271 HydrophobicContact CD2-CD2 3.56Å; L231-L271 HydrophobicContact CD2-CG 4.26Å; M234-L271 HydrophobicContact CE-CD2 4.07Å; M234-L271 HydrophobicContact SD-CD2 3.89Å; L247-L271 HydrophobicContact CD1-CD2 4.42Å; L267-L271 HydrophobicContact CD1-CD1 4.41Å; L267-L271 HydrophobicContact CD1-CG 4.36Å; L267-L271 HydrophobicContact CG-CD1 3.99Å; L267-L271 HydrophobicContact CG-CG 4.4Å; L267-L271 WeakPolarHBondContact O-CB 3.29Å; L267-L271 WeakPolarHBondContact O-CG 3.38Å; L267-L271 PolarHBondContact O-N 3.44Å; C268-L271 PolarHBondContact O-N 2.89Å; L271-A274 PolarHBondContact O-N 2.92Å; L271-G275 PolarHBondContact O-N 3.24Å; L271-F276 HydrophobicContact CD2-CD2 3.8Å; L271-F276 HydrophobicContact CD2-CE2 4.43Å; L271-F276 HydrophobicContact CD2-CG 4.42Å; L271-F276 PolarHBondContact O-N 2.78Å; L271-F277 HydrophobicContact CB-CD1 4.35Å; L271-F277 HydrophobicContact CB-CE1 3.71Å; L271-F277 HydrophobicContact CB-CZ 4.48Å; L271-F277 HydrophobicContact CD1-CE1 4.48Å; L271-L294 HydrophobicContact CD1-CD2 4.1Å; L271-M298 HydrophobicContact CD1-CE 3.34Å; L271-M298 HydrophobicContact CD1-SD 4.48Å
272	Q	90.4	Very high	88.7	Confident	122 Å²	122	60.1 Å²	60.1	57%	0.57	33%	0.332	S	S	*	.	H	α-helix	trans	-62.8	-43.4	175.9	-174.4	179.3	9	0	0	111.4	C268 V270 A274 G275 F277	C268-Q272 WeakPolarHBondContact O-CB 3.13Å; C268-Q272 PolarHBondContact O-N 3.24Å; V270-Q272 VanDerWaalsContact C-N 3.34Å; V270-Q272 PolarHBondContact O-N 3.01Å; Q272-A274 VanDerWaalsContact C-N 3.27Å; Q272-A274 PolarHBondContact O-N 3.35Å; Q272-G275 PolarHBondContact O-N 3.21Å; Q272-G275 VanDerWaalsContact O-N 3.11Å; Q272-F277 HydrophobicContact CB-CD2 4.12Å; Q272-F277 HydrophobicContact CB-CE2 4.24Å; Q272-F277 HydrophobicContact CB-CG 4.32Å; Q272-F277 HydrophobicContact CG-CD2 4.18Å; Q272-F277 HydrophobicContact CG-CG 4.49Å
273	S	88.6	Confident	88.3	Confident	108 Å²	108	63.1 Å²	63.1	76%	0.755	35%	0.348	S	S	*	.	H	α-helix	trans	-66.4	-29.9	178.8	-58.2	0	0	0	0	112.7	Q269 V270 G275	Q269-S273 WeakPolarHBondContact O-CB 3.46Å; Q269-S273 PolarHBondContact O-N 3.02Å; Q269-S273 PolarHBondContact O-OG 3.42Å; V270-S273 PolarHBondContact O-N 2.9Å; S273-G275 VanDerWaalsContact C-N 3.29Å
274	A	87.1	Confident	88.1	Confident	51 Å²	51	63.5 Å²	63.5	42%	0.421	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-7	175	0	0	0	0	0	113.6	V270 L271 Q272 F276	V270-A274 WeakPolarHBondContact O-CB 3.48Å; V270-A274 PolarHBondContact O-N 3.11Å; L271-A274 PolarHBondContact O-N 2.92Å; Q272-A274 VanDerWaalsContact C-N 3.27Å; Q272-A274 PolarHBondContact O-N 3.35Å; A274-F276 HydrophobicContact CB-CD2 3.64Å; A274-F276 HydrophobicContact CB-CE2 3.52Å
275	G	86.5	Confident	88	Confident	36 Å²	36	66.3 Å²	66.3	37%	0.371	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.3	0.6	173.3	0	0	0	0	0	115.9	L271 Q272 S273 F277 S278	L271-G275 PolarHBondContact O-N 3.24Å; Q272-G275 PolarHBondContact O-N 3.21Å; Q272-G275 VanDerWaalsContact O-N 3.11Å; S273-G275 VanDerWaalsContact C-N 3.29Å; G275-F277 PolarHBondContact O-N 3.45Å; G275-S278 PolarHBondContact O-N 3.26Å; G275-S278 PolarHBondContact O-OG 2.85Å; G275-S278 VanDerWaalsContact O-OG 3.11Å
276	F	88.2	Confident	87.9	Confident	24 Å²	24	69.1 Å²	69.1	11%	0.105	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-7.8	-175.5	-65.6	-68.8	0	0	0	115.1	L231 M234 L271 A274 S278 F287 F291	L231-F276 HydrophobicContact CD2-CE2 4.16Å; M234-F276 HydrophobicContact CB-CE1 3.78Å; M234-F276 HydrophobicContact CB-CE2 4.07Å; M234-F276 HydrophobicContact CB-CZ 3.37Å; M234-F276 HydrophobicContact CE-CD1 4.09Å; M234-F276 HydrophobicContact CE-CD2 4.37Å; M234-F276 HydrophobicContact CE-CE1 4.15Å; M234-F276 HydrophobicContact CE-CE2 4.41Å; M234-F276 HydrophobicContact CE-CG 4.22Å; M234-F276 HydrophobicContact CE-CZ 4.33Å; M234-F276 HydrophobicContact SD-CE2 4.42Å; L271-F276 HydrophobicContact CD2-CD2 3.8Å; L271-F276 HydrophobicContact CD2-CE2 4.43Å; L271-F276 HydrophobicContact CD2-CG 4.42Å; L271-F276 PolarHBondContact O-N 2.78Å; A274-F276 HydrophobicContact CB-CD2 3.64Å; A274-F276 HydrophobicContact CB-CE2 3.52Å; F276-S278 VanDerWaalsContact C-N 3.29Å; F276-F287 HydrophobicContact CD1-CE1 4.38Å; F276-F287 AromaticContact CD1-CZ 3.96Å; F276-F287 HydrophobicContact CD1-CZ 3.96Å; F276-F287 HydrophobicContact CE1-CZ 4.26Å; F276-F291 HydrophobicContact CB-CE2 3.99Å; F276-F291 HydrophobicContact CB-CZ 4.19Å; F276-F291 WeakPolarHBondContact O-CE1 3.47Å; F276-F291 WeakPolarHBondContact O-CZ 3.48Å
277	F	87.2	Confident	87.9	Confident	41 Å²	41	66 Å²	66	18%	0.18	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	0.7	179.9	-77.6	27.1	0	0	0	112.5	C268 L271 Q272 G275 I279 F291 L331	C268-F277 VanDerWaalsContact SG-CZ 3.58Å; L271-F277 HydrophobicContact CB-CD1 4.35Å; L271-F277 HydrophobicContact CB-CE1 3.71Å; L271-F277 HydrophobicContact CB-CZ 4.48Å; L271-F277 HydrophobicContact CD1-CE1 4.48Å; Q272-F277 HydrophobicContact CB-CD2 4.12Å; Q272-F277 HydrophobicContact CB-CE2 4.24Å; Q272-F277 HydrophobicContact CB-CG 4.32Å; Q272-F277 HydrophobicContact CG-CD2 4.18Å; Q272-F277 HydrophobicContact CG-CG 4.49Å; G275-F277 PolarHBondContact O-N 3.45Å; F277-I279 PolarHBondContact O-N 3.09Å; F277-F291 AromaticContact CD1-CZ 3.79Å; F277-F291 HydrophobicContact CD1-CZ 3.79Å; F277-F291 AromaticContact CE1-CZ 3.89Å; F277-F291 HydrophobicContact CE1-CZ 3.89Å; F277-L331 HydrophobicContact CB-CD1 4.38Å; F277-L331 HydrophobicContact CD1-CD2 4.43Å; F277-L331 HydrophobicContact CD2-CD1 4.29Å; F277-L331 HydrophobicContact CD2-CD2 3.98Å; F277-L331 HydrophobicContact CE1-CD2 4.22Å; F277-L331 HydrophobicContact CE2-CD2 3.77Å; F277-L331 HydrophobicContact CG-CD1 4.28Å; F277-L331 HydrophobicContact CG-CD2 4.31Å; F277-L331 HydrophobicContact CZ-CD2 3.89Å
278	S	84.1	Confident	88	Confident	56 Å²	56	65.9 Å²	65.9	39%	0.392	36%	0.361	S	S	.	.			trans	-83.2	62.4	179	-48	0	0	0	0	111	G275 F276 D280 Q281	G275-S278 PolarHBondContact O-N 3.26Å; G275-S278 PolarHBondContact O-OG 2.85Å; G275-S278 VanDerWaalsContact O-OG 3.11Å; F276-S278 VanDerWaalsContact C-N 3.29Å; S278-D280 VanDerWaalsContact C-N 3.28Å; S278-D280 PolarHBondContact O-N 3.33Å; S278-Q281 PolarHBondContact O-N 2.9Å
279	I	83.6	Confident	88.1	Confident	8 Å²	8	66.4 Å²	66.4	4%	0.041	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-53.8	-43.7	-172.8	-60	165.7	0	0	0	111.9	F277 Q281 E282 L288 L331 Q334 L335	F277-I279 PolarHBondContact O-N 3.09Å; I279-Q281 PolarHBondContact O-N 3.42Å; I279-E282 PolarHBondContact O-N 3.3Å; I279-L288 HydrophobicContact CG2-CD1 4.4Å; I279-L288 HydrophobicContact CG2-CD2 4.17Å; I279-L331 HydrophobicContact CD1-CD1 3.42Å; I279-L331 VanDerWaalsContact CD1-CD1 3.42Å; I279-L331 HydrophobicContact CD1-CG 4.31Å; I279-L331 HydrophobicContact CG1-CD1 4.12Å; I279-Q334 HydrophobicContact CD1-CB 3.78Å; I279-L335 HydrophobicContact CD1-CD1 4.48Å; I279-L335 HydrophobicContact CD1-CD2 3.55Å; I279-L335 HydrophobicContact CD1-CG 3.64Å; I279-L335 HydrophobicContact CG1-CD2 4.18Å; I279-L335 HydrophobicContact CG2-CD2 4.3Å
280	D	78.3	Confident	88.2	Confident	146 Å²	146	65 Å²	65	78%	0.781	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-64.8	-12.7	-177.4	-56.9	-35.7	0	0	0	114	S278	S278-D280 VanDerWaalsContact C-N 3.28Å; S278-D280 PolarHBondContact O-N 3.33Å
281	Q	80.6	Confident	88.4	Confident	164 Å²	164	62.7 Å²	62.7	77%	0.766	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-101.1	-5.7	178.8	-62.2	-179.9	2.3	0	0	112.5	S278 I279	S278-Q281 PolarHBondContact O-N 2.9Å; I279-Q281 PolarHBondContact O-N 3.42Å
282	E	85.2	Confident	88.6	Confident	54 Å²	54	62.7 Å²	62.7	25%	0.252	34%	0.342	S	S	.	.			trans	-93.7	114.9	-177.8	-172.6	65.2	-117.3	0	0	109.7	R240 I279 D284 F287 L288	R240-E282 IonicContact CZ-OE1 3.73Å; R240-E282 IonicContact CZ-OE2 3.14Å; R240-E282 IonicContact NH1-OE1 3.73Å; R240-E282 PolarHBondContact NH1-OE1 3.19Å; R240-E282 IonicContact NH1-OE2 4Å; R240-E282 IonicContact NH2-OE1 3.91Å; R240-E282 PolarHBondContact NH2-OE1 3.01Å; R240-E282 VanDerWaalsContact NH2-OE1 3.13Å; R240-E282 IonicContact NH2-OE2 2.9Å; R240-E282 PolarHBondContact NH2-OE2 3.45Å; I279-E282 PolarHBondContact O-N 3.3Å; E282-D284 HydrophobicContact CG-CB 4.49Å; E282-D284 WeakPolarHBondContact OE1-CB 3.48Å; E282-F287 HydrophobicContact CG-CD1 4.12Å; E282-L288 HydrophobicContact CB-CD1 4Å; E282-L288 HydrophobicContact CB-CD2 3.93Å; E282-L288 HydrophobicContact CB-CG 4Å; E282-L288 HydrophobicContact CG-CD1 3.99Å; E282-L288 HydrophobicContact CG-CD2 3.77Å; E282-L288 HydrophobicContact CG-CG 3.55Å
283	E	83.4	Confident	88.9	Confident	186 Å²	186	59.7 Å²	59.7	87%	0.869	33%	0.327	S	S	*	.			trans	-91.1	-14.1	179.8	-62.9	-177.8	173.2	0	0	112.3	V285	E283-V285 PolarHBondContact O-N 3.23Å
284	D	89.2	Confident	89.2	Confident	38 Å²	38	54.5 Å²	54.5	20%	0.203	29%	0.291	C	S	.	.			trans	-83.5	96.6	-179.1	-175.4	-11.6	0	0	0	111.1	R240 E282 D286 F287 L288	R240-D284 WeakPolarHBondContact CD-OD2 3.48Å; R240-D284 IonicContact CZ-OD2 3.04Å; R240-D284 IonicContact NE-OD2 3.96Å; R240-D284 IonicContact NH1-OD2 3.96Å; R240-D284 PolarHBondContact NH1-OD2 2.8Å; E282-D284 HydrophobicContact CG-CB 4.49Å; E282-D284 WeakPolarHBondContact OE1-CB 3.48Å; D284-D286 VanDerWaalsContact C-N 3.35Å; D284-D286 PolarHBondContact OD1-N 2.82Å; D284-F287 HydrophobicContact CB-CB 4.13Å; D284-F287 PolarHBondContact OD1-N 3.08Å; D284-F287 WeakPolarHBondContact OD2-CB 3.41Å; D284-L288 WeakPolarHBondContact O-CG 3.49Å; D284-L288 PolarHBondContact O-N 2.81Å
285	V	90.7	Very high	89.7	Confident	59 Å²	59	52.4 Å²	52.4	36%	0.358	27%	0.273	S	S	.	.	H	α-helix	trans	-64.3	-38	-179.2	179.2	0	0	0	0	111.7	E283 L288 A289 D340 I343	E283-V285 PolarHBondContact O-N 3.23Å; V285-L288 CarbonylContact O-C 3.5Å; V285-L288 PolarHBondContact O-N 3.1Å; V285-A289 WeakPolarHBondContact O-CB 3.37Å; V285-A289 PolarHBondContact O-N 3.48Å; V285-D340 HydrophobicContact CG1-CB 4.23Å; V285-D340 WeakPolarHBondContact CG1-OD2 2.87Å; V285-I343 HydrophobicContact CG1-CD1 3.86Å
286	D	91.5	Very high	90.2	Very high	108 Å²	108	51.5 Å²	51.5	58%	0.578	26%	0.259	S	S	*	.	H	α-helix	trans	-65.2	-45.9	-179	-69.9	-41	0	0	0	110.5	D284 A289 R290	D284-D286 VanDerWaalsContact C-N 3.35Å; D284-D286 PolarHBondContact OD1-N 2.82Å; D286-A289 WeakPolarHBondContact O-CB 2.92Å; D286-A289 PolarHBondContact O-N 2.65Å; D286-R290 PolarHBondContact O-N 2.84Å
287	F	93.1	Very high	90.6	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-44.3	171.7	172.5	-103.7	0	0	0	112.4	M234 R240 C244 F276 E282 D284 A289 R290 F291	M234-F287 HydrophobicContact CE-CE2 3.81Å; M234-F287 HydrophobicContact CE-CZ 3.65Å; R240-F287 HydrophobicContact CB-CD2 3.8Å; R240-F287 HydrophobicContact CB-CE2 3.91Å; R240-F287 HydrophobicContact CG-CB 4.17Å; R240-F287 HydrophobicContact CG-CD2 3.53Å; R240-F287 HydrophobicContact CG-CE2 4.17Å; R240-F287 HydrophobicContact CG-CG 4.08Å; C244-F287 HydrophobicContact CB-CE2 4.22Å; F276-F287 HydrophobicContact CD1-CE1 4.38Å; F276-F287 AromaticContact CD1-CZ 3.96Å; F276-F287 HydrophobicContact CD1-CZ 3.96Å; F276-F287 HydrophobicContact CE1-CZ 4.26Å; E282-F287 HydrophobicContact CG-CD1 4.12Å; D284-F287 HydrophobicContact CB-CB 4.13Å; D284-F287 PolarHBondContact OD1-N 3.08Å; D284-F287 WeakPolarHBondContact OD2-CB 3.41Å; F287-A289 PolarHBondContact O-N 3.11Å; F287-R290 PolarHBondContact O-N 3.09Å; F287-R290 VanDerWaalsContact O-N 3.11Å; F287-F291 HydrophobicContact CD1-CB 4.49Å; F287-F291 HydrophobicContact CE1-CB 4.15Å; F287-F291 HydrophobicContact CE1-CG 4.41Å; F287-F291 HydrophobicContact CZ-CB 4.28Å; F287-F291 HydrophobicContact CZ-CD2 4.28Å; F287-F291 HydrophobicContact CZ-CG 4.5Å; F287-F291 WeakPolarHBondContact O-CB 3.31Å; F287-F291 PolarHBondContact O-N 2.94Å
288	L	94	Very high	91	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-61	-33.6	177.8	-80.6	178.8	0	0	0	112.2	I279 E282 D284 V285 F291 S292 I343	I279-L288 HydrophobicContact CG2-CD1 4.4Å; I279-L288 HydrophobicContact CG2-CD2 4.17Å; E282-L288 HydrophobicContact CB-CD1 4Å; E282-L288 HydrophobicContact CB-CD2 3.93Å; E282-L288 HydrophobicContact CB-CG 4Å; E282-L288 HydrophobicContact CG-CD1 3.99Å; E282-L288 HydrophobicContact CG-CD2 3.77Å; E282-L288 HydrophobicContact CG-CG 3.55Å; D284-L288 WeakPolarHBondContact O-CG 3.49Å; D284-L288 PolarHBondContact O-N 2.81Å; V285-L288 CarbonylContact O-C 3.5Å; V285-L288 PolarHBondContact O-N 3.1Å; L288-F291 PolarHBondContact O-N 3.49Å; L288-S292 VanDerWaalsContact O-CB 3.24Å; L288-S292 WeakPolarHBondContact O-CB 3.3Å; L288-S292 PolarHBondContact O-N 2.87Å; L288-S292 PolarHBondContact O-OG 3.45Å; L288-I343 HydrophobicContact CB-CD1 3.5Å; L288-I343 HydrophobicContact CB-CG1 4.24Å; L288-I343 HydrophobicContact CD1-CD1 4.17Å
289	A	93.9	Very high	91.6	Very high	21 Å²	21	46 Å²	46	17%	0.174	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-47.6	172.8	0	0	0	0	0	110.7	V285 D286 F287 F291 S292 K293 I343 N346	V285-A289 WeakPolarHBondContact O-CB 3.37Å; V285-A289 PolarHBondContact O-N 3.48Å; D286-A289 WeakPolarHBondContact O-CB 2.92Å; D286-A289 PolarHBondContact O-N 2.65Å; F287-A289 PolarHBondContact O-N 3.11Å; A289-F291 PolarHBondContact O-N 3.11Å; A289-S292 PolarHBondContact O-N 3.09Å; A289-S292 PolarHBondContact O-OG 3.29Å; A289-K293 PolarHBondContact O-N 3.26Å; A289-I343 HydrophobicContact CB-CG1 4.31Å; A289-N346 PolarHBondContact O-ND2 3.28Å
290	R	94.6	Very high	92.2	Very high	88 Å²	88	48.6 Å²	48.6	33%	0.332	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-40.6	174.2	-57.5	-57	-179.9	164	-9	112.7	E241 C244 D245 D286 F287 K293 L294	E241-R290 HydrophobicContact CB-CG 4Å; E241-R290 HydrophobicContact CG-CG 3.97Å; E241-R290 IonicContact OE2-NE 3.01Å; C244-R290 HydrophobicContact CB-CB 4.23Å; C244-R290 VanDerWaalsContact SG-C 3.6Å; C244-R290 PolarHBondContact SG-O 3.01Å; D245-R290 IonicContact OD1-NH1 3.66Å; D245-R290 WeakPolarHBondContact OD2-CD 3.38Å; D245-R290 IonicContact OD2-CZ 2.88Å; D245-R290 IonicContact OD2-NE 3.47Å; D245-R290 IonicContact OD2-NH1 3.82Å; D245-R290 PolarHBondContact OD2-NH1 2.85Å; D286-R290 PolarHBondContact O-N 2.84Å; F287-R290 PolarHBondContact O-N 3.09Å; F287-R290 VanDerWaalsContact O-N 3.11Å; R290-K293 WeakPolarHBondContact O-CB 3.23Å; R290-K293 PolarHBondContact O-N 3.42Å; R290-L294 PolarHBondContact O-N 3.29Å
291	F	95.3	Very high	93	Very high	1 Å²	1	42.4 Å²	42.4	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-40.6	179.6	-174.8	-105.6	0	0	0	112.1	M234 C244 F276 F277 F287 L288 A289 K293 L294 V295	M234-F291 HydrophobicContact CE-CD2 4.29Å; C244-F291 VanDerWaalsContact SG-CA 3.59Å; F276-F291 HydrophobicContact CB-CE2 3.99Å; F276-F291 HydrophobicContact CB-CZ 4.19Å; F276-F291 WeakPolarHBondContact O-CE1 3.47Å; F276-F291 WeakPolarHBondContact O-CZ 3.48Å; F277-F291 AromaticContact CD1-CZ 3.79Å; F277-F291 HydrophobicContact CD1-CZ 3.79Å; F277-F291 AromaticContact CE1-CZ 3.89Å; F277-F291 HydrophobicContact CE1-CZ 3.89Å; F287-F291 HydrophobicContact CD1-CB 4.49Å; F287-F291 HydrophobicContact CE1-CB 4.15Å; F287-F291 HydrophobicContact CE1-CG 4.41Å; F287-F291 HydrophobicContact CZ-CB 4.28Å; F287-F291 HydrophobicContact CZ-CD2 4.28Å; F287-F291 HydrophobicContact CZ-CG 4.5Å; F287-F291 WeakPolarHBondContact O-CB 3.31Å; F287-F291 PolarHBondContact O-N 2.94Å; L288-F291 PolarHBondContact O-N 3.49Å; A289-F291 PolarHBondContact O-N 3.11Å; F291-K293 VanDerWaalsContact C-N 3.3Å; F291-K293 PolarHBondContact O-N 3.02Å; F291-L294 HydrophobicContact CD2-CD2 4.36Å; F291-L294 HydrophobicContact CE2-CD2 4.49Å; F291-L294 WeakPolarHBondContact O-CA 3.15Å; F291-L294 WeakPolarHBondContact O-CB 3.47Å; F291-L294 PolarHBondContact O-N 3.25Å; F291-L294 VanDerWaalsContact O-N 3.11Å; F291-V295 HydrophobicContact CD1-CG2 4.14Å; F291-V295 HydrophobicContact CE1-CG2 3.73Å; F291-V295 HydrophobicContact CE2-CG2 4.49Å; F291-V295 HydrophobicContact CZ-CG2 3.92Å; F291-V295 WeakPolarHBondContact O-CG2 3.45Å; F291-V295 PolarHBondContact O-N 3.25Å
292	S	95.8	Very high	93.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-39	175.9	70.1	0	0	0	0	111.7	L288 A289 V295 N296 N346	L288-S292 VanDerWaalsContact O-CB 3.24Å; L288-S292 WeakPolarHBondContact O-CB 3.3Å; L288-S292 PolarHBondContact O-N 2.87Å; L288-S292 PolarHBondContact O-OG 3.45Å; A289-S292 PolarHBondContact O-N 3.09Å; A289-S292 PolarHBondContact O-OG 3.29Å; S292-V295 PolarHBondContact O-N 3.44Å; S292-N296 WeakPolarHBondContact O-CB 3.37Å; S292-N296 PolarHBondContact O-N 3.41Å; S292-N346 VanDerWaalsContact OG-CB 3.26Å; S292-N346 WeakPolarHBondContact OG-CB 3.16Å; S292-N346 PolarHBondContact OG-ND2 3.21Å
293	K	96	Very high	94.2	Very high	59 Å²	59	32.4 Å²	32.4	26%	0.257	16%	0.162	S	C	.	.	H	α-helix	trans	-63	-41.3	172.1	-177.5	-175.1	169.8	-153.9	0	111.9	D245 F248 A289 R290 F291 N296 G297	D245-K293 IonicContact OD1-NZ 3.03Å; D245-K293 PolarHBondContact OD1-NZ 3.12Å; F248-K293 HydrophobicContact CD2-CG 4.12Å; F248-K293 WeakPolarHBondContact CD2-O 3.47Å; F248-K293 HydrophobicContact CE1-CD 4.35Å; F248-K293 HydrophobicContact CE1-CG 4.34Å; F248-K293 HydrophobicContact CE2-CG 3.75Å; F248-K293 VanDerWaalsContact CE2-O 3.29Å; F248-K293 WeakPolarHBondContact CE2-O 3.41Å; F248-K293 HydrophobicContact CZ-CD 4.29Å; F248-K293 HydrophobicContact CZ-CG 3.83Å; A289-K293 PolarHBondContact O-N 3.26Å; R290-K293 WeakPolarHBondContact O-CB 3.23Å; R290-K293 PolarHBondContact O-N 3.42Å; F291-K293 VanDerWaalsContact C-N 3.3Å; F291-K293 PolarHBondContact O-N 3.02Å; K293-N296 PolarHBondContact O-N 2.98Å; K293-G297 PolarHBondContact O-N 3.07Å
294	L	96.1	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.5	-50.1	172.3	175.1	62.4	0	0	0	111.8	L247 F248 V251 L271 R290 F291 N296 G297 M298	L247-L294 HydrophobicContact CB-CD1 4.17Å; L247-L294 HydrophobicContact CB-CD2 4.23Å; F248-L294 HydrophobicContact CB-CB 4.5Å; F248-L294 HydrophobicContact CB-CD1 4.03Å; V251-L294 HydrophobicContact CG2-CD1 4.01Å; L271-L294 HydrophobicContact CD1-CD2 4.1Å; R290-L294 PolarHBondContact O-N 3.29Å; F291-L294 HydrophobicContact CD2-CD2 4.36Å; F291-L294 HydrophobicContact CE2-CD2 4.49Å; F291-L294 WeakPolarHBondContact O-CA 3.15Å; F291-L294 WeakPolarHBondContact O-CB 3.47Å; F291-L294 PolarHBondContact O-N 3.25Å; F291-L294 VanDerWaalsContact O-N 3.11Å; L294-N296 VanDerWaalsContact C-N 3.32Å; L294-N296 PolarHBondContact O-N 3.23Å; L294-G297 PolarHBondContact O-N 3.48Å; L294-M298 HydrophobicContact CD1-CE 3.69Å; L294-M298 HydrophobicContact CD1-CG 4.48Å; L294-M298 HydrophobicContact CD2-CE 4.01Å; L294-M298 HydrophobicContact CG-CE 3.71Å; L294-M298 WeakPolarHBondContact O-CG 3.42Å; L294-M298 PolarHBondContact O-N 2.79Å
295	V	96.6	Very high	95	Very high	6 Å²	6	25.4 Å²	25.4	4%	0.036	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-42	178	176.1	0	0	0	0	111.3	F291 S292 M298 G299 L331 L335 I347	F291-V295 HydrophobicContact CD1-CG2 4.14Å; F291-V295 HydrophobicContact CE1-CG2 3.73Å; F291-V295 HydrophobicContact CE2-CG2 4.49Å; F291-V295 HydrophobicContact CZ-CG2 3.92Å; F291-V295 WeakPolarHBondContact O-CG2 3.45Å; F291-V295 PolarHBondContact O-N 3.25Å; S292-V295 PolarHBondContact O-N 3.44Å; V295-M298 WeakPolarHBondContact O-CB 3.31Å; V295-M298 PolarHBondContact O-N 3.43Å; V295-G299 PolarHBondContact O-N 3.29Å; V295-L331 HydrophobicContact CB-CD2 4.5Å; V295-L331 HydrophobicContact CG1-CD2 3.79Å; V295-L331 HydrophobicContact CG1-CG 4.26Å; V295-L331 HydrophobicContact CG2-CD2 3.79Å; V295-L335 HydrophobicContact CB-CD1 3.87Å; V295-L335 HydrophobicContact CG1-CD1 3.85Å; V295-L335 HydrophobicContact CG2-CD1 4.08Å; V295-I347 HydrophobicContact CB-CD1 4.4Å; V295-I347 HydrophobicContact CG1-CD1 4Å
296	N	96.9	Very high	95.2	Very high	18 Å²	18	23.1 Å²	23.1	10%	0.096	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-48.9	174	177.5	69.8	0	0	0	111.5	S292 K293 L294 M298 G299 Q300 N346 I347 F350	S292-N296 WeakPolarHBondContact O-CB 3.37Å; S292-N296 PolarHBondContact O-N 3.41Å; K293-N296 PolarHBondContact O-N 2.98Å; L294-N296 VanDerWaalsContact C-N 3.32Å; L294-N296 PolarHBondContact O-N 3.23Å; N296-M298 VanDerWaalsContact C-N 3.32Å; N296-M298 PolarHBondContact O-N 3Å; N296-G299 PolarHBondContact O-N 3.44Å; N296-Q300 PolarHBondContact ND2-OE1 3.07Å; N296-Q300 WeakPolarHBondContact O-CG 3.45Å; N296-Q300 PolarHBondContact O-N 3.39Å; N296-N346 WeakPolarHBondContact CB-O 3.49Å; N296-N346 PolarHBondContact OD1-O 2.96Å; N296-I347 HydrophobicContact CB-CD1 3.87Å; N296-F350 WeakPolarHBondContact OD1-CB 3.22Å; N296-F350 PolarHBondContact OD1-N 3.33Å
297	G	96.3	Very high	95.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.7	-38.9	176.9	0	0	0	0	0	113.2	K293 L294 S301	K293-G297 PolarHBondContact O-N 3.07Å; L294-G297 PolarHBondContact O-N 3.48Å; G297-S301 WeakPolarHBondContact O-CB 3.3Å; G297-S301 PolarHBondContact O-N 3.22Å; G297-S301 PolarHBondContact O-OG 3.17Å
298	M	95.9	Very high	95.4	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.025	12%	0.119	C	C	.	.	H	α-helix	trans	-62.5	-49.4	173.9	-70.5	-174.8	-174.7	0	0	111.7	V251 V264 L267 L271 L294 V295 N296 S301 L302	V251-M298 HydrophobicContact CG1-CB 4.44Å; V251-M298 HydrophobicContact CG1-CG 3.96Å; V251-M298 HydrophobicContact CG2-CE 4.22Å; V251-M298 HydrophobicContact CG2-CG 4.02Å; V264-M298 HydrophobicContact CG1-CB 3.82Å; V264-M298 HydrophobicContact CG1-CG 4.02Å; V264-M298 HydrophobicContact CG1-SD 4.4Å; L267-M298 HydrophobicContact CB-CE 4.47Å; L267-M298 HydrophobicContact CD2-CE 3.47Å; L267-M298 VanDerWaalsContact CD2-CE 3.47Å; L267-M298 HydrophobicContact CG-CE 3.77Å; L271-M298 HydrophobicContact CD1-CE 3.34Å; L271-M298 HydrophobicContact CD1-SD 4.48Å; L294-M298 HydrophobicContact CD1-CE 3.69Å; L294-M298 HydrophobicContact CD1-CG 4.48Å; L294-M298 HydrophobicContact CD2-CE 4.01Å; L294-M298 HydrophobicContact CG-CE 3.71Å; L294-M298 WeakPolarHBondContact O-CG 3.42Å; L294-M298 PolarHBondContact O-N 2.79Å; V295-M298 WeakPolarHBondContact O-CB 3.31Å; V295-M298 PolarHBondContact O-N 3.43Å; N296-M298 VanDerWaalsContact C-N 3.32Å; N296-M298 PolarHBondContact O-N 3Å; M298-S301 PolarHBondContact O-N 3.01Å; M298-L302 WeakPolarHBondContact O-CG 3.27Å; M298-L302 PolarHBondContact O-N 3.05Å
299	G	96.1	Very high	95.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.5	-49.5	179	0	0	0	0	0	112.5	V295 N296 S301 L302 I303 F350	V295-G299 PolarHBondContact O-N 3.29Å; N296-G299 PolarHBondContact O-N 3.44Å; G299-S301 PolarHBondContact O-N 3.1Å; G299-L302 PolarHBondContact O-N 3.12Å; G299-I303 VanDerWaalsContact O-CG1 3.31Å; G299-I303 WeakPolarHBondContact O-CG1 3.31Å; G299-I303 PolarHBondContact O-N 2.99Å; G299-F350 VanDerWaalsContact CA-CE2 3.48Å
300	Q	96	Very high	95.3	Very high	62 Å²	62	26.5 Å²	26.5	29%	0.29	13%	0.13	S	C	.	.	H	α-helix	trans	-63.1	-40.9	177.9	-69.6	-170	-53.4	0	0	112.2	N296 L302 I303 V304 D353	N296-Q300 PolarHBondContact ND2-OE1 3.07Å; N296-Q300 WeakPolarHBondContact O-CG 3.45Å; N296-Q300 PolarHBondContact O-N 3.39Å; Q300-L302 VanDerWaalsContact C-N 3.34Å; Q300-L302 PolarHBondContact O-N 3.22Å; Q300-I303 PolarHBondContact O-N 3.4Å; Q300-V304 VanDerWaalsContact O-CG2 3.32Å; Q300-V304 WeakPolarHBondContact O-CG2 3.4Å; Q300-V304 PolarHBondContact O-N 2.94Å; Q300-D353 PolarHBondContact NE2-OD2 3.31Å
301	S	94.9	Very high	95.2	Very high	16 Å²	16	30.8 Å²	30.8	11%	0.112	15%	0.151	C	C	.	.	H	α-helix	trans	-59.7	-43.5	175.7	-69.3	0	0	0	0	112	V251 G297 M298 G299 V304 S305	V251-S301 PolarHBondContact O-OG 3.33Å; G297-S301 WeakPolarHBondContact O-CB 3.3Å; G297-S301 PolarHBondContact O-N 3.22Å; G297-S301 PolarHBondContact O-OG 3.17Å; M298-S301 PolarHBondContact O-N 3.01Å; G299-S301 PolarHBondContact O-N 3.1Å; S301-V304 PolarHBondContact O-N 3.31Å; S301-S305 WeakPolarHBondContact O-CB 3.25Å; S301-S305 PolarHBondContact O-N 3.32Å; S301-S305 PolarHBondContact O-OG 2.91Å; S301-S305 VanDerWaalsContact O-OG 3.13Å
302	L	95.9	Very high	95	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-40.8	175.8	-69.2	173.2	0	0	0	112.1	M261 V264 M298 G299 Q300 S305 W306 A324 I325 K328	M261-L302 HydrophobicContact CB-CD2 4.31Å; M261-L302 HydrophobicContact CG-CD2 4.1Å; V264-L302 HydrophobicContact CB-CD2 4.06Å; V264-L302 HydrophobicContact CB-CG 4.33Å; V264-L302 HydrophobicContact CG1-CD1 3.86Å; V264-L302 HydrophobicContact CG1-CD2 4.07Å; V264-L302 HydrophobicContact CG1-CG 3.86Å; M298-L302 WeakPolarHBondContact O-CG 3.27Å; M298-L302 PolarHBondContact O-N 3.05Å; G299-L302 PolarHBondContact O-N 3.12Å; Q300-L302 VanDerWaalsContact C-N 3.34Å; Q300-L302 PolarHBondContact O-N 3.22Å; L302-S305 WeakPolarHBondContact O-CB 3.48Å; L302-S305 PolarHBondContact O-N 3.4Å; L302-W306 WeakPolarHBondContact O-CB 3.43Å; L302-W306 PolarHBondContact O-N 3.46Å; L302-A324 HydrophobicContact CD1-CB 4.2Å; L302-A324 HydrophobicContact CD2-CB 4.37Å; L302-I325 HydrophobicContact CB-CD1 4.16Å; L302-I325 HydrophobicContact CB-CG1 3.57Å; L302-I325 HydrophobicContact CD1-CG1 4.34Å; L302-K328 HydrophobicContact CD1-CD 3.74Å
303	I	95.5	Very high	94.8	Very high	8 Å²	8	39.4 Å²	39.4	4%	0.041	21%	0.211	C	C	.	.	H	α-helix	trans	-65.5	-41.4	178	-68.8	166.4	0	0	0	111.8	G299 Q300 S305 W306 S307 I325 F350 D353 I357	G299-I303 VanDerWaalsContact O-CG1 3.31Å; G299-I303 WeakPolarHBondContact O-CG1 3.31Å; G299-I303 PolarHBondContact O-N 2.99Å; Q300-I303 PolarHBondContact O-N 3.4Å; I303-S305 VanDerWaalsContact C-N 3.33Å; I303-W306 PolarHBondContact O-N 3.19Å; I303-S307 WeakPolarHBondContact O-CB 3.49Å; I303-S307 PolarHBondContact O-N 3.4Å; I303-S307 PolarHBondContact O-OG 3.08Å; I303-I325 HydrophobicContact CB-CD1 4.43Å; I303-I325 HydrophobicContact CG1-CD1 3.71Å; I303-I325 HydrophobicContact CG1-CG1 4.18Å; I303-I325 HydrophobicContact CG1-CG2 4.43Å; I303-F350 HydrophobicContact CD1-CD2 3.52Å; I303-F350 HydrophobicContact CD1-CE2 3.67Å; I303-F350 HydrophobicContact CG1-CE2 4.41Å; I303-D353 HydrophobicContact CD1-CB 3.57Å; I303-D353 HydrophobicContact CG2-CB 3.96Å; I303-I357 HydrophobicContact CB-CD1 4.02Å; I303-I357 HydrophobicContact CG1-CD1 3.68Å; I303-I357 HydrophobicContact CG2-CD1 3.69Å; I303-I357 HydrophobicContact CG2-CG1 3.93Å
304	V	94.9	Very high	94.6	Very high	72 Å²	72	39.4 Å²	39.4	44%	0.436	21%	0.213	S	C	.	.	H	α-helix	trans	-62.8	-43	174.5	170.2	0	0	0	0	110.3	Q300 S301 S307 K308	Q300-V304 VanDerWaalsContact O-CG2 3.32Å; Q300-V304 WeakPolarHBondContact O-CG2 3.4Å; Q300-V304 PolarHBondContact O-N 2.94Å; S301-V304 PolarHBondContact O-N 3.31Å; V304-S307 PolarHBondContact O-N 2.97Å; V304-K308 HydrophobicContact CG1-CD 4.27Å; V304-K308 WeakPolarHBondContact O-CG 3.45Å; V304-K308 PolarHBondContact O-N 2.82Å
305	S	94.9	Very high	94.4	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.035	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-48.4	174.9	-69.3	0	0	0	0	111.8	P257 S301 L302 I303 S307 K308 L309	P257-S305 PolarHBondContact O-OG 3.44Å; S301-S305 WeakPolarHBondContact O-CB 3.25Å; S301-S305 PolarHBondContact O-N 3.32Å; S301-S305 PolarHBondContact O-OG 2.91Å; S301-S305 VanDerWaalsContact O-OG 3.13Å; L302-S305 WeakPolarHBondContact O-CB 3.48Å; L302-S305 PolarHBondContact O-N 3.4Å; I303-S305 VanDerWaalsContact C-N 3.33Å; S305-S307 VanDerWaalsContact C-N 3.34Å; S305-S307 PolarHBondContact O-N 3.25Å; S305-K308 PolarHBondContact O-N 3.32Å; S305-L309 WeakPolarHBondContact O-CB 3.48Å; S305-L309 VanDerWaalsContact O-CG 3.26Å; S305-L309 WeakPolarHBondContact O-CG 3.48Å; S305-L309 PolarHBondContact O-N 3.41Å
306	W	95.4	Very high	94.2	Very high	11 Å²	11	51 Å²	51	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-54.2	-49.4	174.7	177.8	89.5	0	0	0	111.8	L302 I303 K308 L309 I310 A318 A321 I325 I357 Q360 L361	L302-W306 WeakPolarHBondContact O-CB 3.43Å; L302-W306 PolarHBondContact O-N 3.46Å; I303-W306 PolarHBondContact O-N 3.19Å; W306-K308 VanDerWaalsContact C-N 3.32Å; W306-K308 PolarHBondContact O-N 3.43Å; W306-L309 PolarHBondContact O-N 3.29Å; W306-I310 HydrophobicContact CD2-CG1 4.04Å; W306-I310 HydrophobicContact CE3-CG1 4.46Å; W306-I310 HydrophobicContact CH2-CG1 4.21Å; W306-I310 HydrophobicContact CZ2-CD1 4.19Å; W306-I310 HydrophobicContact CZ2-CG1 3.77Å; W306-I310 WeakPolarHBondContact O-CG1 3.36Å; W306-I310 PolarHBondContact O-N 3.22Å; W306-A318 PolarHBondContact NE1-O 2.89Å; W306-A321 HydrophobicContact CB-CB 4.09Å; W306-I325 HydrophobicContact CB-CD1 4.15Å; W306-I357 HydrophobicContact CB-CD1 4.4Å; W306-I357 HydrophobicContact CD2-CD1 3.8Å; W306-I357 HydrophobicContact CD2-CG1 4.29Å; W306-I357 HydrophobicContact CD2-CG2 4.34Å; W306-I357 HydrophobicContact CE3-CB 4.5Å; W306-I357 HydrophobicContact CE3-CD1 3.58Å; W306-I357 HydrophobicContact CE3-CG1 3.65Å; W306-I357 HydrophobicContact CE3-CG2 4.26Å; W306-I357 HydrophobicContact CG-CD1 4.14Å; W306-I357 HydrophobicContact CH2-CB 4.46Å; W306-I357 HydrophobicContact CH2-CG1 4.41Å; W306-I357 HydrophobicContact CH2-CG2 3.82Å; W306-I357 HydrophobicContact CZ2-CG2 3.88Å; W306-I357 HydrophobicContact CZ3-CB 4.24Å; W306-I357 HydrophobicContact CZ3-CD1 4.16Å; W306-I357 HydrophobicContact CZ3-CG1 3.72Å; W306-I357 HydrophobicContact CZ3-CG2 4.01Å; W306-Q360 HydrophobicContact CH2-CB 4.37Å; W306-L361 HydrophobicContact CZ2-CD2 4.28Å
307	S	93.6	Very high	94	Very high	28 Å²	28	51.8 Å²	51.8	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-38.6	-179	-62.6	0	0	0	0	112.5	I303 V304 S305 K311	I303-S307 WeakPolarHBondContact O-CB 3.49Å; I303-S307 PolarHBondContact O-N 3.4Å; I303-S307 PolarHBondContact O-OG 3.08Å; V304-S307 PolarHBondContact O-N 2.97Å; S305-S307 VanDerWaalsContact C-N 3.34Å; S305-S307 PolarHBondContact O-N 3.25Å; S307-K311 VanDerWaalsContact O-CG 3.28Å; S307-K311 WeakPolarHBondContact O-CG 3.27Å; S307-K311 PolarHBondContact O-N 3.38Å
308	K	93.9	Very high	93.8	Very high	96 Å²	96	51.9 Å²	51.9	42%	0.417	27%	0.272	S	S	.	.	H	α-helix	trans	-70.1	-42.4	175.8	-73.9	175.6	179.4	176.2	0	111.7	P257 V304 S305 W306 K311 N312	P257-K308 HydrophobicContact CG-CB 3.69Å; P257-K308 HydrophobicContact CG-CD 3.88Å; P257-K308 HydrophobicContact CG-CG 4.46Å; V304-K308 HydrophobicContact CG1-CD 4.27Å; V304-K308 WeakPolarHBondContact O-CG 3.45Å; V304-K308 PolarHBondContact O-N 2.82Å; S305-K308 PolarHBondContact O-N 3.32Å; W306-K308 VanDerWaalsContact C-N 3.32Å; W306-K308 PolarHBondContact O-N 3.43Å; K308-K311 PolarHBondContact O-N 3.24Å; K308-N312 WeakPolarHBondContact O-CB 3.41Å; K308-N312 VanDerWaalsContact O-CG 3.22Å; K308-N312 PolarHBondContact O-N 3.19Å; K308-N312 PolarHBondContact O-OD1 2.79Å
309	L	94.1	Very high	93.6	Very high	6 Å²	6	57.7 Å²	57.7	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-63.9	-43.1	179.7	-70.8	165.6	0	0	0	112	P257 V258 S305 W306 K311 N312 G313 D314 N317 A318 A321	P257-L309 HydrophobicContact CB-CD1 4.01Å; P257-L309 HydrophobicContact CB-CD2 3.89Å; P257-L309 HydrophobicContact CB-CG 3.65Å; P257-L309 HydrophobicContact CG-CG 4.45Å; V258-L309 HydrophobicContact CG2-CD2 3.91Å; S305-L309 WeakPolarHBondContact O-CB 3.48Å; S305-L309 VanDerWaalsContact O-CG 3.26Å; S305-L309 WeakPolarHBondContact O-CG 3.48Å; S305-L309 PolarHBondContact O-N 3.41Å; W306-L309 PolarHBondContact O-N 3.29Å; L309-K311 PolarHBondContact O-N 3.16Å; L309-N312 PolarHBondContact O-N 3.24Å; L309-G313 PolarHBondContact O-N 3.15Å; L309-G313 VanDerWaalsContact O-N 3.09Å; L309-D314 HydrophobicContact CD2-CB 4.11Å; L309-D314 PolarHBondContact O-N 3.45Å; L309-N317 HydrophobicContact CD1-CB 3.97Å; L309-N317 HydrophobicContact CD2-CB 4.04Å; L309-A318 HydrophobicContact CB-CB 3.92Å; L309-A321 HydrophobicContact CD1-CB 4.33Å
310	I	92.6	Very high	93.5	Very high	76 Å²	76	61.5 Å²	61.5	39%	0.39	32%	0.317	S	S	.	.	H	α-helix	trans	-59.8	-46.2	173.7	-68.5	-66.8	0	0	0	111.1	W306 N312 G313 A318	W306-I310 HydrophobicContact CD2-CG1 4.04Å; W306-I310 HydrophobicContact CE3-CG1 4.46Å; W306-I310 HydrophobicContact CH2-CG1 4.21Å; W306-I310 HydrophobicContact CZ2-CD1 4.19Å; W306-I310 HydrophobicContact CZ2-CG1 3.77Å; W306-I310 WeakPolarHBondContact O-CG1 3.36Å; W306-I310 PolarHBondContact O-N 3.22Å; I310-N312 VanDerWaalsContact C-N 3.28Å; I310-N312 PolarHBondContact O-N 3.11Å; I310-G313 PolarHBondContact O-N 2.99Å; I310-G313 VanDerWaalsContact O-N 3.12Å; I310-A318 HydrophobicContact CD1-CB 3.47Å; I310-A318 VanDerWaalsContact CD1-CB 3.47Å; I310-A318 HydrophobicContact CG1-CB 3.81Å
311	K	92.4	Very high	93.4	Very high	177 Å²	177	58.6 Å²	58.6	77%	0.77	30%	0.303	S	S	*	.	H	α-helix	trans	-63.2	-33.7	178	-74.6	174.8	-176.2	178	0	112.9	S307 K308 L309 G313	S307-K311 VanDerWaalsContact O-CG 3.28Å; S307-K311 WeakPolarHBondContact O-CG 3.27Å; S307-K311 PolarHBondContact O-N 3.38Å; K308-K311 PolarHBondContact O-N 3.24Å; L309-K311 PolarHBondContact O-N 3.16Å; K311-G313 VanDerWaalsContact C-N 3.29Å
312	N	92	Very high	93.3	Very high	128 Å²	128	59.3 Å²	59.3	68%	0.684	31%	0.306	S	S	*	.	H	α-helix	trans	-81.3	-6.4	177.7	-68	-6.5	0	0	0	113.2	K308 L309 I310	K308-N312 WeakPolarHBondContact O-CB 3.41Å; K308-N312 VanDerWaalsContact O-CG 3.22Å; K308-N312 PolarHBondContact O-N 3.19Å; K308-N312 PolarHBondContact O-OD1 2.79Å; L309-N312 PolarHBondContact O-N 3.24Å; I310-N312 VanDerWaalsContact C-N 3.28Å; I310-N312 PolarHBondContact O-N 3.11Å
313	G	90.1	Very high	93.2	Very high	55 Å²	55	65.7 Å²	65.7	57%	0.567	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	11.7	180	0	0	0	0	0	115	L309 I310 K311 I315	L309-G313 PolarHBondContact O-N 3.15Å; L309-G313 VanDerWaalsContact O-N 3.09Å; I310-G313 PolarHBondContact O-N 2.99Å; I310-G313 VanDerWaalsContact O-N 3.12Å; K311-G313 VanDerWaalsContact C-N 3.29Å; G313-I315 PolarHBondContact O-N 2.97Å; G313-I315 VanDerWaalsContact O-N 3.16Å
314	D	92.6	Very high	93.1	Very high	58 Å²	58	65.7 Å²	65.7	31%	0.31	34%	0.337	S	S	.	.			trans	-87.5	80.4	177.6	-169	-17.1	0	0	0	111	L309 K316 N317 A318	L309-D314 HydrophobicContact CD2-CB 4.11Å; L309-D314 PolarHBondContact O-N 3.45Å; D314-K316 VanDerWaalsContact C-N 3.32Å; D314-K316 PolarHBondContact O-N 2.92Å; D314-N317 PolarHBondContact OD1-N 2.65Å; D314-N317 PolarHBondContact OD1-ND2 3.12Å; D314-N317 PolarHBondContact OD2-ND2 3.04Å; D314-A318 VanDerWaalsContact O-CB 3.27Å; D314-A318 WeakPolarHBondContact O-CB 3.48Å; D314-A318 PolarHBondContact O-N 3.36Å; D314-A318 VanDerWaalsContact O-N 3.08Å
315	I	90.8	Very high	93.2	Very high	109 Å²	109	62.2 Å²	62.2	56%	0.559	32%	0.316	S	S	*	.	H	α-helix	trans	-65.8	-35.1	-173.2	-58	174.4	0	0	0	111.8	G313 A318 Q319	G313-I315 PolarHBondContact O-N 2.97Å; G313-I315 VanDerWaalsContact O-N 3.16Å; I315-A318 PolarHBondContact O-N 2.87Å; I315-Q319 WeakPolarHBondContact O-CG 3.44Å; I315-Q319 PolarHBondContact O-N 2.6Å
316	K	92.9	Very high	93.1	Very high	142 Å²	142	63.8 Å²	63.8	62%	0.617	32%	0.323	S	S	*	.	H	α-helix	trans	-67.5	-53.3	-176.1	-174	-168.2	172.2	-159.1	0	110.7	D314 A318 Q319 E320	D314-K316 VanDerWaalsContact C-N 3.32Å; D314-K316 PolarHBondContact O-N 2.92Å; K316-A318 PolarHBondContact O-N 3.48Å; K316-Q319 WeakPolarHBondContact O-CB 3.32Å; K316-Q319 PolarHBondContact O-N 3.33Å; K316-Q319 VanDerWaalsContact O-N 3.12Å; K316-E320 VanDerWaalsContact CE-OE1 3.29Å; K316-E320 WeakPolarHBondContact CE-OE1 3.47Å; K316-E320 IonicContact NZ-OE1 3.74Å; K316-E320 PolarHBondContact O-N 3.24Å; K316-E320 VanDerWaalsContact O-N 3.12Å
317	N	92.2	Very high	93	Very high	33 Å²	33	67.6 Å²	67.6	18%	0.176	35%	0.347	C	S	.	.	H	α-helix	trans	-67.3	-30	178.9	-70.7	-41.3	0	0	0	111.4	V258 L309 D314 E320 A321	V258-N317 HydrophobicContact CG2-CB 4.21Å; L309-N317 HydrophobicContact CD1-CB 3.97Å; L309-N317 HydrophobicContact CD2-CB 4.04Å; D314-N317 PolarHBondContact OD1-N 2.65Å; D314-N317 PolarHBondContact OD1-ND2 3.12Å; D314-N317 PolarHBondContact OD2-ND2 3.04Å; N317-E320 PolarHBondContact O-N 3.07Å; N317-A321 WeakPolarHBondContact O-CB 3.39Å; N317-A321 PolarHBondContact O-N 3.21Å
318	A	92.6	Very high	93	Very high	2 Å²	2	66.7 Å²	66.7	2%	0.017	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-37.6	171.5	0	0	0	0	0	112.6	W306 L309 I310 D314 I315 K316 A321 L322	W306-A318 PolarHBondContact NE1-O 2.89Å; L309-A318 HydrophobicContact CB-CB 3.92Å; I310-A318 HydrophobicContact CD1-CB 3.47Å; I310-A318 VanDerWaalsContact CD1-CB 3.47Å; I310-A318 HydrophobicContact CG1-CB 3.81Å; D314-A318 VanDerWaalsContact O-CB 3.27Å; D314-A318 WeakPolarHBondContact O-CB 3.48Å; D314-A318 PolarHBondContact O-N 3.36Å; D314-A318 VanDerWaalsContact O-N 3.08Å; I315-A318 PolarHBondContact O-N 2.87Å; K316-A318 PolarHBondContact O-N 3.48Å; A318-A321 PolarHBondContact O-N 3.15Å; A318-L322 PolarHBondContact O-N 3.22Å
319	Q	91.8	Very high	93	Very high	128 Å²	128	62.2 Å²	62.2	60%	0.598	32%	0.32	S	S	*	.	H	α-helix	trans	-66.3	-41.4	174.5	-75.4	175.1	-9.6	0	0	112	I315 K316 A321 L322 Q323	I315-Q319 WeakPolarHBondContact O-CG 3.44Å; I315-Q319 PolarHBondContact O-N 2.6Å; K316-Q319 WeakPolarHBondContact O-CB 3.32Å; K316-Q319 PolarHBondContact O-N 3.33Å; K316-Q319 VanDerWaalsContact O-N 3.12Å; Q319-A321 VanDerWaalsContact C-N 3.35Å; Q319-L322 PolarHBondContact O-N 3.35Å; Q319-Q323 PolarHBondContact O-N 2.78Å
320	E	93.8	Very high	93	Very high	80 Å²	80	65 Å²	65	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-43.7	174.3	-68.1	177.4	-166.1	0	0	111.1	M261 K316 N317 L322 Q323 A324	M261-E320 HydrophobicContact CE-CB 4.04Å; M261-E320 HydrophobicContact SD-CB 4.04Å; K316-E320 VanDerWaalsContact CE-OE1 3.29Å; K316-E320 WeakPolarHBondContact CE-OE1 3.47Å; K316-E320 IonicContact NZ-OE1 3.74Å; K316-E320 PolarHBondContact O-N 3.24Å; K316-E320 VanDerWaalsContact O-N 3.12Å; N317-E320 PolarHBondContact O-N 3.07Å; E320-L322 PolarHBondContact O-N 3.2Å; E320-Q323 PolarHBondContact O-N 3.46Å; E320-A324 WeakPolarHBondContact O-CB 3.33Å; E320-A324 PolarHBondContact O-N 3.21Å
321	A	94.2	Very high	93.1	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.9	-39.9	175.5	0	0	0	0	0	112.3	M261 W306 L309 N317 A318 Q319 A324 I325	M261-A321 VanDerWaalsContact SD-CA 3.52Å; M261-A321 HydrophobicContact SD-CB 3.75Å; M261-A321 PolarHBondContact SD-N 3.43Å; M261-A321 VanDerWaalsContact SD-N 3.4Å; W306-A321 HydrophobicContact CB-CB 4.09Å; L309-A321 HydrophobicContact CD1-CB 4.33Å; N317-A321 WeakPolarHBondContact O-CB 3.39Å; N317-A321 PolarHBondContact O-N 3.21Å; A318-A321 PolarHBondContact O-N 3.15Å; Q319-A321 VanDerWaalsContact C-N 3.35Å; A321-A324 WeakPolarHBondContact O-CB 3.42Å; A321-A324 PolarHBondContact O-N 3.38Å; A321-I325 WeakPolarHBondContact O-CD1 3.4Å; A321-I325 VanDerWaalsContact O-CG1 3.24Å; A321-I325 WeakPolarHBondContact O-CG1 3.46Å; A321-I325 PolarHBondContact O-N 3.05Å
322	L	93.6	Very high	93.2	Very high	31 Å²	31	53.6 Å²	53.6	16%	0.162	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-44.5	175.5	-176	61.2	0	0	0	111	A318 Q319 E320 A324 I325 E326 I357 L361	A318-L322 PolarHBondContact O-N 3.22Å; Q319-L322 PolarHBondContact O-N 3.35Å; E320-L322 PolarHBondContact O-N 3.2Å; L322-A324 VanDerWaalsContact C-N 3.34Å; L322-A324 PolarHBondContact O-N 3.4Å; L322-I325 WeakPolarHBondContact O-CB 3.16Å; L322-I325 PolarHBondContact O-N 3.14Å; L322-E326 HydrophobicContact CG-CG 4.49Å; L322-E326 VanDerWaalsContact O-CG 3.29Å; L322-E326 WeakPolarHBondContact O-CG 3.41Å; L322-E326 PolarHBondContact O-N 3.45Å; L322-I357 HydrophobicContact CD1-CG2 3.94Å; L322-L361 HydrophobicContact CD2-CD1 4.47Å
323	Q	93.2	Very high	93.4	Very high	135 Å²	135	48.7 Å²	48.7	63%	0.631	27%	0.266	S	S	*	.	H	α-helix	trans	-62	-42.5	176.5	-174	173.2	5.9	0	0	111.8	Q319 E320 I325 E326 T327	Q319-Q323 PolarHBondContact O-N 2.78Å; E320-Q323 PolarHBondContact O-N 3.46Å; Q323-I325 VanDerWaalsContact C-N 3.28Å; Q323-I325 PolarHBondContact O-N 3.32Å; Q323-E326 PolarHBondContact O-N 2.89Å; Q323-T327 WeakPolarHBondContact O-CG2 3.48Å; Q323-T327 PolarHBondContact O-N 3Å; Q323-T327 VanDerWaalsContact O-N 3.08Å
324	A	94.5	Very high	93.6	Very high	7 Å²	7	50.1 Å²	50.1	6%	0.058	26%	0.258	C	S	.	.	H	α-helix	trans	-57.8	-39.8	174.1	0	0	0	0	0	112.4	E265 L302 E320 A321 L322 T327 K328	E265-A324 HydrophobicContact CG-CB 4.3Å; E265-A324 VanDerWaalsContact OE1-CB 3.22Å; E265-A324 WeakPolarHBondContact OE1-CB 3.39Å; L302-A324 HydrophobicContact CD1-CB 4.2Å; L302-A324 HydrophobicContact CD2-CB 4.37Å; E320-A324 WeakPolarHBondContact O-CB 3.33Å; E320-A324 PolarHBondContact O-N 3.21Å; A321-A324 WeakPolarHBondContact O-CB 3.42Å; A321-A324 PolarHBondContact O-N 3.38Å; L322-A324 VanDerWaalsContact C-N 3.34Å; L322-A324 PolarHBondContact O-N 3.4Å; A324-T327 PolarHBondContact O-OG1 3.14Å; A324-K328 WeakPolarHBondContact O-CD 3.49Å; A324-K328 PolarHBondContact O-NZ 2.83Å
325	I	95.5	Very high	93.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-50.7	174.3	-66.6	158.8	0	0	0	110.7	L302 I303 W306 A321 L322 Q323 T327 K328 V329 F350 Y354 I357	L302-I325 HydrophobicContact CB-CD1 4.16Å; L302-I325 HydrophobicContact CB-CG1 3.57Å; L302-I325 HydrophobicContact CD1-CG1 4.34Å; I303-I325 HydrophobicContact CB-CD1 4.43Å; I303-I325 HydrophobicContact CG1-CD1 3.71Å; I303-I325 HydrophobicContact CG1-CG1 4.18Å; I303-I325 HydrophobicContact CG1-CG2 4.43Å; W306-I325 HydrophobicContact CB-CD1 4.15Å; A321-I325 WeakPolarHBondContact O-CD1 3.4Å; A321-I325 VanDerWaalsContact O-CG1 3.24Å; A321-I325 WeakPolarHBondContact O-CG1 3.46Å; A321-I325 PolarHBondContact O-N 3.05Å; L322-I325 WeakPolarHBondContact O-CB 3.16Å; L322-I325 PolarHBondContact O-N 3.14Å; Q323-I325 VanDerWaalsContact C-N 3.28Å; Q323-I325 PolarHBondContact O-N 3.32Å; I325-T327 VanDerWaalsContact C-N 3.27Å; I325-T327 PolarHBondContact O-N 3.47Å; I325-K328 PolarHBondContact O-N 3.4Å; I325-V329 PolarHBondContact O-N 3.42Å; I325-F350 HydrophobicContact CG2-CE2 3.96Å; I325-F350 HydrophobicContact CG2-CZ 4.22Å; I325-Y354 HydrophobicContact CG2-CD2 3.66Å; I325-Y354 HydrophobicContact CG2-CE2 4.1Å; I325-I357 HydrophobicContact CD1-CD1 3.8Å
326	E	93.5	Very high	93.9	Very high	38 Å²	38	42.2 Å²	42.2	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-36.9	-176.7	-67.8	-69.5	173	0	0	112.6	L322 Q323 K328 V329 Y354 Q368 N371	L322-E326 HydrophobicContact CG-CG 4.49Å; L322-E326 VanDerWaalsContact O-CG 3.29Å; L322-E326 WeakPolarHBondContact O-CG 3.41Å; L322-E326 PolarHBondContact O-N 3.45Å; Q323-E326 PolarHBondContact O-N 2.89Å; E326-K328 PolarHBondContact O-N 3.35Å; E326-V329 PolarHBondContact O-N 2.62Å; E326-Y354 WeakPolarHBondContact OE1-CE2 3.36Å; E326-Y354 PolarHBondContact OE1-OH 3.45Å; E326-Y354 VanDerWaalsContact OE1-OH 3.05Å; E326-Y354 PolarHBondContact OE2-OH 3.32Å; E326-Q368 VanDerWaalsContact OE1-CG 3.23Å; E326-Q368 WeakPolarHBondContact OE1-CG 3.47Å; E326-Q368 PolarHBondContact OE1-NE2 3.32Å; E326-N371 PolarHBondContact OE2-ND2 2.98Å; E326-N371 VanDerWaalsContact OE2-ND2 3.13Å
327	T	92.8	Very high	94	Very high	90 Å²	90	38.9 Å²	38.9	55%	0.552	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.4	176.7	59	0	0	0	0	114	Q323 A324 I325	Q323-T327 WeakPolarHBondContact O-CG2 3.48Å; Q323-T327 PolarHBondContact O-N 3Å; Q323-T327 VanDerWaalsContact O-N 3.08Å; A324-T327 PolarHBondContact O-OG1 3.14Å; I325-T327 VanDerWaalsContact C-N 3.27Å; I325-T327 PolarHBondContact O-N 3.47Å
328	K	94.1	Very high	94.1	Very high	10 Å²	10	39.4 Å²	39.4	4%	0.043	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-7.2	-178	-67.7	161.1	-171.2	59.3	0	113.2	E265 L302 A324 I325 E326 A330 L331 M332 F350	E265-K328 WeakPolarHBondContact OE1-CE 3.25Å; E265-K328 IonicContact OE1-NZ 3.89Å; E265-K328 PolarHBondContact OE1-NZ 3.06Å; E265-K328 IonicContact OE2-NZ 3.02Å; L302-K328 HydrophobicContact CD1-CD 3.74Å; A324-K328 WeakPolarHBondContact O-CD 3.49Å; A324-K328 PolarHBondContact O-NZ 2.83Å; I325-K328 PolarHBondContact O-N 3.4Å; E326-K328 PolarHBondContact O-N 3.35Å; K328-A330 VanDerWaalsContact C-N 3.26Å; K328-A330 PolarHBondContact O-N 3.1Å; K328-L331 PolarHBondContact O-N 3.3Å; K328-M332 PolarHBondContact O-N 2.88Å; K328-F350 HydrophobicContact CB-CE1 4.26Å; K328-F350 HydrophobicContact CB-CZ 4.28Å
329	V	94.4	Very high	94	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-34.5	-179.7	174.6	0	0	0	0	111.7	I325 E326 M332 L333 Y354 N371	I325-V329 PolarHBondContact O-N 3.42Å; E326-V329 PolarHBondContact O-N 2.62Å; V329-M332 HydrophobicContact CG1-CE 3.95Å; V329-M332 WeakPolarHBondContact O-CB 3.47Å; V329-M332 PolarHBondContact O-N 3.47Å; V329-L333 HydrophobicContact CG1-CD1 4.07Å; V329-L333 HydrophobicContact CG1-CG 4.37Å; V329-L333 WeakPolarHBondContact O-CB 3.22Å; V329-L333 VanDerWaalsContact O-CG 3.32Å; V329-L333 WeakPolarHBondContact O-CG 3.46Å; V329-L333 PolarHBondContact O-N 3.02Å; V329-Y354 HydrophobicContact CG1-CE1 4.35Å; V329-Y354 HydrophobicContact CG2-CD1 4.45Å; V329-Y354 HydrophobicContact CG2-CD2 4.3Å; V329-Y354 HydrophobicContact CG2-CE1 4.05Å; V329-Y354 HydrophobicContact CG2-CE2 3.87Å; V329-N371 HydrophobicContact CG1-CB 3.97Å
330	A	93.5	Very high	93.9	Very high	66 Å²	66	44 Å²	44	55%	0.545	23%	0.229	S	C	.	.	H	α-helix	trans	-63.2	-44.5	176.4	0	0	0	0	0	112.3	K328 L333 Q334	K328-A330 VanDerWaalsContact C-N 3.26Å; K328-A330 PolarHBondContact O-N 3.1Å; A330-L333 PolarHBondContact O-N 3.05Å; A330-Q334 WeakPolarHBondContact O-CG 3.47Å; A330-Q334 PolarHBondContact O-N 2.99Å
331	L	94.3	Very high	93.8	Very high	13 Å²	13	41.6 Å²	41.6	7%	0.068	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-43.3	176.5	-173.8	71.3	0	0	0	111.2	F277 I279 V295 K328 L333 Q334 L335	F277-L331 HydrophobicContact CB-CD1 4.38Å; F277-L331 HydrophobicContact CD1-CD2 4.43Å; F277-L331 HydrophobicContact CD2-CD1 4.29Å; F277-L331 HydrophobicContact CD2-CD2 3.98Å; F277-L331 HydrophobicContact CE1-CD2 4.22Å; F277-L331 HydrophobicContact CE2-CD2 3.77Å; F277-L331 HydrophobicContact CG-CD1 4.28Å; F277-L331 HydrophobicContact CG-CD2 4.31Å; F277-L331 HydrophobicContact CZ-CD2 3.89Å; I279-L331 HydrophobicContact CD1-CD1 3.42Å; I279-L331 VanDerWaalsContact CD1-CD1 3.42Å; I279-L331 HydrophobicContact CD1-CG 4.31Å; I279-L331 HydrophobicContact CG1-CD1 4.12Å; V295-L331 HydrophobicContact CB-CD2 4.5Å; V295-L331 HydrophobicContact CG1-CD2 3.79Å; V295-L331 HydrophobicContact CG1-CG 4.26Å; V295-L331 HydrophobicContact CG2-CD2 3.79Å; K328-L331 PolarHBondContact O-N 3.3Å; L331-L333 VanDerWaalsContact C-N 3.3Å; L331-L333 PolarHBondContact O-N 3.38Å; L331-Q334 PolarHBondContact O-N 3.26Å; L331-L335 WeakPolarHBondContact O-CG 3.37Å; L331-L335 PolarHBondContact O-N 2.85Å; L331-L335 VanDerWaalsContact O-N 3.1Å
332	M	95.9	Very high	93.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.9	-43.1	174.2	-177.7	-163.4	77.3	0	0	111.8	K328 V329 L335 L336 I347 F350 C351 I375	K328-M332 PolarHBondContact O-N 2.88Å; V329-M332 HydrophobicContact CG1-CE 3.95Å; V329-M332 WeakPolarHBondContact O-CB 3.47Å; V329-M332 PolarHBondContact O-N 3.47Å; M332-L335 PolarHBondContact O-N 3.26Å; M332-L336 WeakPolarHBondContact O-CB 3.38Å; M332-L336 PolarHBondContact O-N 3.05Å; M332-I347 HydrophobicContact CB-CG1 4.3Å; M332-I347 HydrophobicContact CG-CD1 4.15Å; M332-I347 HydrophobicContact CG-CG1 3.62Å; M332-F350 HydrophobicContact CB-CD1 3.81Å; M332-F350 HydrophobicContact CB-CE1 3.75Å; M332-F350 HydrophobicContact CG-CD1 3.52Å; M332-F350 HydrophobicContact CG-CE1 3.92Å; M332-F350 HydrophobicContact CG-CG 4.13Å; M332-F350 HydrophobicContact SD-CB 4.34Å; M332-F350 HydrophobicContact SD-CD1 3.61Å; M332-F350 HydrophobicContact SD-CD2 4.15Å; M332-F350 HydrophobicContact SD-CE1 3.84Å; M332-F350 HydrophobicContact SD-CE2 4.34Å; M332-F350 HydrophobicContact SD-CG 3.76Å; M332-F350 HydrophobicContact SD-CZ 4.19Å; M332-C351 HydrophobicContact CE-CB 4.5Å; M332-C351 VanDerWaalsContact CG-SG 3.55Å; M332-C351 HydrophobicContact SD-CB 4.26Å; M332-C351 PolarHBondContact SD-SG 3.07Å; M332-I375 HydrophobicContact CE-CD1 3.85Å; M332-I375 HydrophobicContact CE-CG1 4.12Å
333	L	95.1	Very high	93.7	Very high	24 Å²	24	44.9 Å²	44.9	13%	0.126	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-38	177.8	-78.5	170.6	0	0	0	112.9	V329 A330 L331 L336 I337 A374 I375	V329-L333 HydrophobicContact CG1-CD1 4.07Å; V329-L333 HydrophobicContact CG1-CG 4.37Å; V329-L333 WeakPolarHBondContact O-CB 3.22Å; V329-L333 VanDerWaalsContact O-CG 3.32Å; V329-L333 WeakPolarHBondContact O-CG 3.46Å; V329-L333 PolarHBondContact O-N 3.02Å; A330-L333 PolarHBondContact O-N 3.05Å; L331-L333 VanDerWaalsContact C-N 3.3Å; L331-L333 PolarHBondContact O-N 3.38Å; L333-L336 PolarHBondContact O-N 3.36Å; L333-I337 WeakPolarHBondContact O-CG1 2.96Å; L333-I337 PolarHBondContact O-N 3.38Å; L333-I337 VanDerWaalsContact O-N 3.17Å; L333-A374 HydrophobicContact CD1-CB 3.77Å; L333-A374 HydrophobicContact CD2-CB 4.07Å; L333-I375 HydrophobicContact CD2-CB 4.36Å; L333-I375 HydrophobicContact CD2-CG1 3.6Å
334	Q	94.1	Very high	93.8	Very high	86 Å²	86	38.4 Å²	38.4	40%	0.402	21%	0.207	S	C	.	.	H	α-helix	trans	-61.6	-46.8	175.1	-73.8	174.5	-37.9	0	0	111	I279 A330 L331 L336 I337 H338	I279-Q334 HydrophobicContact CD1-CB 3.78Å; A330-Q334 WeakPolarHBondContact O-CG 3.47Å; A330-Q334 PolarHBondContact O-N 2.99Å; L331-Q334 PolarHBondContact O-N 3.26Å; Q334-L336 PolarHBondContact O-N 2.79Å; Q334-I337 PolarHBondContact O-N 2.93Å; Q334-H338 PolarHBondContact O-N 2.66Å
335	L	95.2	Very high	93.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-35.7	176.7	-66.2	169.6	0	0	0	112.7	I279 V295 L331 M332 I337 H338 I343 I347	I279-L335 HydrophobicContact CD1-CD1 4.48Å; I279-L335 HydrophobicContact CD1-CD2 3.55Å; I279-L335 HydrophobicContact CD1-CG 3.64Å; I279-L335 HydrophobicContact CG1-CD2 4.18Å; I279-L335 HydrophobicContact CG2-CD2 4.3Å; V295-L335 HydrophobicContact CB-CD1 3.87Å; V295-L335 HydrophobicContact CG1-CD1 3.85Å; V295-L335 HydrophobicContact CG2-CD1 4.08Å; L331-L335 WeakPolarHBondContact O-CG 3.37Å; L331-L335 PolarHBondContact O-N 2.85Å; L331-L335 VanDerWaalsContact O-N 3.1Å; M332-L335 PolarHBondContact O-N 3.26Å; L335-I337 VanDerWaalsContact C-N 3.32Å; L335-I337 PolarHBondContact O-N 2.68Å; L335-H338 VanDerWaalsContact O-CB 3.28Å; L335-H338 WeakPolarHBondContact O-CB 3.25Å; L335-H338 PolarHBondContact O-N 3.05Å; L335-I343 HydrophobicContact CD2-CG2 4Å; L335-I347 HydrophobicContact CB-CB 4.28Å; L335-I347 HydrophobicContact CB-CG1 4.23Å; L335-I347 HydrophobicContact CB-CG2 4.19Å; L335-I347 HydrophobicContact CD1-CD1 4.14Å; L335-I347 HydrophobicContact CD1-CG1 4.43Å
336	L	95.4	Very high	93.8	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-30.5	179.1	-176.4	68.4	0	0	0	112.8	M332 L333 Q334 S344 I347 I348 I375 A378 L411	M332-L336 WeakPolarHBondContact O-CB 3.38Å; M332-L336 PolarHBondContact O-N 3.05Å; L333-L336 PolarHBondContact O-N 3.36Å; Q334-L336 PolarHBondContact O-N 2.79Å; L336-S344 PolarHBondContact O-OG 3.4Å; L336-S344 VanDerWaalsContact O-OG 3.07Å; L336-I347 HydrophobicContact CB-CG2 3.91Å; L336-I347 HydrophobicContact CD1-CG2 4.02Å; L336-I348 HydrophobicContact CD1-CG1 4.34Å; L336-I375 HydrophobicContact CD2-CG2 4.25Å; L336-A378 HydrophobicContact CD2-CB 3.79Å; L336-A378 HydrophobicContact CG-CB 4.2Å; L336-L411 HydrophobicContact CD1-CD1 4.5Å
337	I	94.8	Very high	94	Very high	72 Å²	72	40.4 Å²	40.4	37%	0.369	22%	0.22	S	C	.	.	H	α-helix	trans	-91.9	-7.7	-177.9	-62.6	167.3	0	0	0	111.8	L333 Q334 L335 A378	L333-I337 WeakPolarHBondContact O-CG1 2.96Å; L333-I337 PolarHBondContact O-N 3.38Å; L333-I337 VanDerWaalsContact O-N 3.17Å; Q334-I337 PolarHBondContact O-N 2.93Å; L335-I337 VanDerWaalsContact C-N 3.32Å; L335-I337 PolarHBondContact O-N 2.68Å; I337-A378 HydrophobicContact CD1-CB 3.92Å; I337-A378 HydrophobicContact CG1-CB 3.47Å; I337-A378 VanDerWaalsContact CG1-CB 3.47Å
338	H	93.9	Very high	94.1	Very high	44 Å²	44	36.8 Å²	36.8	20%	0.204	20%	0.197	C	C	.	.			trans	-50.6	143.6	-179.8	-168.7	-86.2	0	0	0	111.8	Q334 L335 D340 I343 K382	Q334-H338 PolarHBondContact O-N 2.66Å; L335-H338 VanDerWaalsContact O-CB 3.28Å; L335-H338 WeakPolarHBondContact O-CB 3.25Å; L335-H338 PolarHBondContact O-N 3.05Å; H338-D340 WeakPolarHBondContact ND1-CB 3.44Å; H338-D340 PolarHBondContact ND1-N 2.9Å; H338-D340 VanDerWaalsContact ND1-N 3.13Å; H338-D340 PolarHBondContact O-N 3.46Å; H338-I343 HydrophobicContact CB-CB 4.39Å; H338-I343 HydrophobicContact CB-CG2 3.88Å; H338-I343 WeakPolarHBondContact CE1-CD1 3.25Å; H338-I343 WeakPolarHBondContact ND1-CD1 3.45Å; H338-K382 WeakPolarHBondContact O-CE 3.47Å; H338-K382 PolarHBondContact O-NZ 2.81Å
339	E	90.1	Very high	94.2	Very high	175 Å²	175	37.4 Å²	37.4	82%	0.818	21%	0.206	S	C	*	.	S	Bend	trans	-63.2	-44.4	-173.3	-64.1	-170.5	159.1	0	0	112	D341 K382	E339-D341 PolarHBondContact O-N 2.71Å; E339-K382 PolarHBondContact O-NZ 3.01Å
340	D	91	Very high	94.3	Very high	51 Å²	51	37.4 Å²	37.4	27%	0.273	21%	0.206	S	C	.	.	S	Bend	trans	-63.6	127.5	173.5	-169.4	-72.6	0	0	0	112.8	V285 H338 D342 I343 S344	V285-D340 HydrophobicContact CG1-CB 4.23Å; V285-D340 WeakPolarHBondContact CG1-OD2 2.87Å; H338-D340 WeakPolarHBondContact ND1-CB 3.44Å; H338-D340 PolarHBondContact ND1-N 2.9Å; H338-D340 VanDerWaalsContact ND1-N 3.13Å; H338-D340 PolarHBondContact O-N 3.46Å; D340-D342 WeakPolarHBondContact OD1-CA 3.36Å; D340-D342 VanDerWaalsContact OD1-CB 3.32Å; D340-D342 WeakPolarHBondContact OD1-CB 3.41Å; D340-D342 PolarHBondContact OD1-N 3.34Å; D340-I343 HydrophobicContact CB-CB 4.45Å; D340-I343 HydrophobicContact CB-CD1 4.01Å; D340-I343 HydrophobicContact CB-CG1 4.3Å; D340-I343 PolarHBondContact OD1-N 2.92Å; D340-S344 PolarHBondContact O-N 3.33Å
341	D	91.6	Very high	94.4	Very high	29 Å²	29	34.2 Å²	34.2	16%	0.155	18%	0.18	C	C	.	.	H	α-helix	trans	-75.2	-25.9	-177.1	-84.4	-6.6	0	0	0	113.6	E339 S344 S345 K382 F401 Y404	E339-D341 PolarHBondContact O-N 2.71Å; D341-S344 PolarHBondContact O-N 3.19Å; D341-S345 WeakPolarHBondContact O-CB 3.36Å; D341-S345 PolarHBondContact O-N 3.02Å; D341-K382 IonicContact OD1-NZ 3.87Å; D341-K382 PolarHBondContact OD1-NZ 3.42Å; D341-F401 WeakPolarHBondContact OD2-CD2 3.44Å; D341-Y404 HydrophobicContact CB-CD1 4.17Å; D341-Y404 HydrophobicContact CB-CE1 4.13Å; D341-Y404 VanDerWaalsContact OD1-CE1 3.3Å; D341-Y404 WeakPolarHBondContact OD1-CE1 3.39Å; D341-Y404 WeakPolarHBondContact OD2-CD1 3.47Å; D341-Y404 WeakPolarHBondContact OD2-CE1 3.23Å
342	D	91.3	Very high	94.5	Very high	100 Å²	100	36.9 Å²	36.9	54%	0.535	19%	0.189	S	C	.	.	H	α-helix	trans	-69.8	-42.2	177.2	-71	-31.2	0	0	0	110.8	D340 S344 S345 N346	D340-D342 WeakPolarHBondContact OD1-CA 3.36Å; D340-D342 VanDerWaalsContact OD1-CB 3.32Å; D340-D342 WeakPolarHBondContact OD1-CB 3.41Å; D340-D342 PolarHBondContact OD1-N 3.34Å; D342-S344 VanDerWaalsContact C-N 3.33Å; D342-S344 PolarHBondContact O-N 3.03Å; D342-S345 PolarHBondContact O-N 3.43Å; D342-N346 VanDerWaalsContact O-CG 3.28Å; D342-N346 PolarHBondContact O-N 2.89Å; D342-N346 PolarHBondContact O-ND2 2.91Å
343	I	94.6	Very high	94.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.2	-46	172.8	-67	171.6	0	0	0	110.3	V285 L288 A289 L335 H338 D340 S345	V285-I343 HydrophobicContact CG1-CD1 3.86Å; L288-I343 HydrophobicContact CB-CD1 3.5Å; L288-I343 HydrophobicContact CB-CG1 4.24Å; L288-I343 HydrophobicContact CD1-CD1 4.17Å; A289-I343 HydrophobicContact CB-CG1 4.31Å; L335-I343 HydrophobicContact CD2-CG2 4Å; H338-I343 HydrophobicContact CB-CB 4.39Å; H338-I343 HydrophobicContact CB-CG2 3.88Å; H338-I343 WeakPolarHBondContact CE1-CD1 3.25Å; H338-I343 WeakPolarHBondContact ND1-CD1 3.45Å; D340-I343 HydrophobicContact CB-CB 4.45Å; D340-I343 HydrophobicContact CB-CD1 4.01Å; D340-I343 HydrophobicContact CB-CG1 4.3Å; D340-I343 PolarHBondContact OD1-N 2.92Å; I343-S345 VanDerWaalsContact C-N 3.35Å; I343-S345 PolarHBondContact O-N 3.42Å
344	S	94.9	Very high	94.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.9	-37.3	177.2	176.2	0	0	0	0	112.4	L336 D340 D341 D342 I347 I348 Y404	L336-S344 PolarHBondContact O-OG 3.4Å; L336-S344 VanDerWaalsContact O-OG 3.07Å; D340-S344 PolarHBondContact O-N 3.33Å; D341-S344 PolarHBondContact O-N 3.19Å; D342-S344 VanDerWaalsContact C-N 3.33Å; D342-S344 PolarHBondContact O-N 3.03Å; S344-I347 VanDerWaalsContact O-CG2 3.25Å; S344-I347 WeakPolarHBondContact O-CG2 3.36Å; S344-I347 PolarHBondContact O-N 3.11Å; S344-I348 WeakPolarHBondContact O-CG1 3.17Å; S344-Y404 VanDerWaalsContact CB-OH 3.29Å; S344-Y404 WeakPolarHBondContact CB-OH 3.46Å; S344-Y404 PolarHBondContact OG-OH 3.24Å
345	S	95.1	Very high	94.7	Very high	31 Å²	31	33.7 Å²	33.7	22%	0.217	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-43.4	-179.1	-179.5	0	0	0	0	110.9	D341 D342 I343 I347 I348 Q407	D341-S345 WeakPolarHBondContact O-CB 3.36Å; D341-S345 PolarHBondContact O-N 3.02Å; D342-S345 PolarHBondContact O-N 3.43Å; I343-S345 VanDerWaalsContact C-N 3.35Å; I343-S345 PolarHBondContact O-N 3.42Å; S345-I347 PolarHBondContact O-N 3.03Å; S345-I347 VanDerWaalsContact O-N 3.14Å; S345-I348 WeakPolarHBondContact O-CB 3.18Å; S345-I348 PolarHBondContact O-N 3.05Å; S345-I348 VanDerWaalsContact O-N 3.15Å; S345-Q407 PolarHBondContact OG-OE1 2.98Å
346	N	95.3	Very high	94.6	Very high	56 Å²	56	36.6 Å²	36.6	30%	0.299	19%	0.188	S	C	.	.	H	α-helix	trans	-58.9	-28.6	179.4	-74.9	-30.7	0	0	0	114	A289 S292 N296 D342	A289-N346 PolarHBondContact O-ND2 3.28Å; S292-N346 VanDerWaalsContact OG-CB 3.26Å; S292-N346 WeakPolarHBondContact OG-CB 3.16Å; S292-N346 PolarHBondContact OG-ND2 3.21Å; N296-N346 WeakPolarHBondContact CB-O 3.49Å; N296-N346 PolarHBondContact OD1-O 2.96Å; D342-N346 VanDerWaalsContact O-CG 3.28Å; D342-N346 PolarHBondContact O-N 2.89Å; D342-N346 PolarHBondContact O-ND2 2.91Å
347	I	96	Very high	94.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-92.4	-9.7	-177.7	-157.9	62.6	0	0	0	114	V295 N296 M332 L335 L336 S344 S345 G349 F350 C351	V295-I347 HydrophobicContact CB-CD1 4.4Å; V295-I347 HydrophobicContact CG1-CD1 4Å; N296-I347 HydrophobicContact CB-CD1 3.87Å; M332-I347 HydrophobicContact CB-CG1 4.3Å; M332-I347 HydrophobicContact CG-CD1 4.15Å; M332-I347 HydrophobicContact CG-CG1 3.62Å; L335-I347 HydrophobicContact CB-CB 4.28Å; L335-I347 HydrophobicContact CB-CG1 4.23Å; L335-I347 HydrophobicContact CB-CG2 4.19Å; L335-I347 HydrophobicContact CD1-CD1 4.14Å; L335-I347 HydrophobicContact CD1-CG1 4.43Å; L336-I347 HydrophobicContact CB-CG2 3.91Å; L336-I347 HydrophobicContact CD1-CG2 4.02Å; S344-I347 VanDerWaalsContact O-CG2 3.25Å; S344-I347 WeakPolarHBondContact O-CG2 3.36Å; S344-I347 PolarHBondContact O-N 3.11Å; S345-I347 PolarHBondContact O-N 3.03Å; S345-I347 VanDerWaalsContact O-N 3.14Å; I347-G349 PolarHBondContact O-N 3.22Å; I347-F350 HydrophobicContact CD1-CB 4.14Å; I347-F350 HydrophobicContact CD1-CD1 3.98Å; I347-F350 PolarHBondContact O-N 3.43Å; I347-C351 PolarHBondContact O-N 3.38Å
348	I	95.8	Very high	94.4	Very high	14 Å²	14	33.2 Å²	33.2	7%	0.072	17%	0.171	C	C	.	.	H	α-helix	trans	-57.8	-36.3	-177.7	-72.7	-179.2	0	0	0	111.8	L336 S344 S345 F350 C351 Y352 Y404 Q407 L408 L411	L336-I348 HydrophobicContact CD1-CG1 4.34Å; S344-I348 WeakPolarHBondContact O-CG1 3.17Å; S345-I348 WeakPolarHBondContact O-CB 3.18Å; S345-I348 PolarHBondContact O-N 3.05Å; S345-I348 VanDerWaalsContact O-N 3.15Å; I348-F350 PolarHBondContact O-N 3.15Å; I348-C351 WeakPolarHBondContact O-CB 3.12Å; I348-C351 PolarHBondContact O-N 2.81Å; I348-Y352 WeakPolarHBondContact O-CB 3.44Å; I348-Y352 PolarHBondContact O-N 2.93Å; I348-Y404 HydrophobicContact CD1-CD2 4.08Å; I348-Y404 HydrophobicContact CD1-CE2 3.73Å; I348-Q407 HydrophobicContact CD1-CB 3.7Å; I348-Q407 HydrophobicContact CG2-CB 4.36Å; I348-L408 HydrophobicContact CD1-CD2 4.02Å; I348-L408 HydrophobicContact CD1-CG 4.5Å; I348-L411 HydrophobicContact CB-CD1 4.36Å; I348-L411 HydrophobicContact CD1-CD1 4.49Å; I348-L411 HydrophobicContact CG1-CD1 3.99Å; I348-L411 HydrophobicContact CG2-CD1 3.93Å; I348-L411 HydrophobicContact CG2-CD2 4.16Å; I348-L411 HydrophobicContact CG2-CG 3.94Å
349	G	95.5	Very high	94.3	Very high	22 Å²	22	35.8 Å²	35.8	23%	0.227	18%	0.182	C	C	.	.	H	α-helix	trans	-56.2	-49.9	178.4	0	0	0	0	0	112.3	I347 Y352 D353	I347-G349 PolarHBondContact O-N 3.22Å; G349-Y352 PolarHBondContact O-N 3.1Å; G349-D353 WeakPolarHBondContact O-CB 3.44Å; G349-D353 PolarHBondContact O-N 3.22Å
350	F	96.9	Very high	94.2	Very high	1 Å²	1	32 Å²	32	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-45.9	177	-178	-160.7	0	0	0	111.6	N296 G299 I303 I325 K328 M332 I347 I348 Y352 D353 Y354	N296-F350 WeakPolarHBondContact OD1-CB 3.22Å; N296-F350 PolarHBondContact OD1-N 3.33Å; G299-F350 VanDerWaalsContact CA-CE2 3.48Å; I303-F350 HydrophobicContact CD1-CD2 3.52Å; I303-F350 HydrophobicContact CD1-CE2 3.67Å; I303-F350 HydrophobicContact CG1-CE2 4.41Å; I325-F350 HydrophobicContact CG2-CE2 3.96Å; I325-F350 HydrophobicContact CG2-CZ 4.22Å; K328-F350 HydrophobicContact CB-CE1 4.26Å; K328-F350 HydrophobicContact CB-CZ 4.28Å; M332-F350 HydrophobicContact CB-CD1 3.81Å; M332-F350 HydrophobicContact CB-CE1 3.75Å; M332-F350 HydrophobicContact CG-CD1 3.52Å; M332-F350 HydrophobicContact CG-CE1 3.92Å; M332-F350 HydrophobicContact CG-CG 4.13Å; M332-F350 HydrophobicContact SD-CB 4.34Å; M332-F350 HydrophobicContact SD-CD1 3.61Å; M332-F350 HydrophobicContact SD-CD2 4.15Å; M332-F350 HydrophobicContact SD-CE1 3.84Å; M332-F350 HydrophobicContact SD-CE2 4.34Å; M332-F350 HydrophobicContact SD-CG 3.76Å; M332-F350 HydrophobicContact SD-CZ 4.19Å; I347-F350 HydrophobicContact CD1-CB 4.14Å; I347-F350 HydrophobicContact CD1-CD1 3.98Å; I347-F350 PolarHBondContact O-N 3.43Å; I348-F350 PolarHBondContact O-N 3.15Å; F350-Y352 VanDerWaalsContact C-N 3.33Å; F350-Y352 PolarHBondContact O-N 3.17Å; F350-D353 PolarHBondContact O-N 3.16Å; F350-Y354 VanDerWaalsContact O-CB 3.31Å; F350-Y354 WeakPolarHBondContact O-CB 3.47Å; F350-Y354 PolarHBondContact O-N 3.18Å
351	C	96.5	Very high	94	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56	-47.5	175.9	-68.5	0	0	0	0	112	M332 I347 I348 Y354 L355 L411	M332-C351 HydrophobicContact CE-CB 4.5Å; M332-C351 VanDerWaalsContact CG-SG 3.55Å; M332-C351 HydrophobicContact SD-CB 4.26Å; M332-C351 PolarHBondContact SD-SG 3.07Å; I347-C351 PolarHBondContact O-N 3.38Å; I348-C351 WeakPolarHBondContact O-CB 3.12Å; I348-C351 PolarHBondContact O-N 2.81Å; C351-Y354 PolarHBondContact O-N 3.35Å; C351-L355 VanDerWaalsContact O-CG 3.31Å; C351-L355 WeakPolarHBondContact O-CG 3.21Å; C351-L355 PolarHBondContact O-N 3.44Å; C351-L411 HydrophobicContact CB-CD1 4.21Å; C351-L411 HydrophobicContact CB-CD2 3.79Å
352	Y	96.3	Very high	93.5	Very high	68 Å²	68	37.5 Å²	37.5	27%	0.267	20%	0.199	S	C	.	.	H	α-helix	trans	-64.1	-45.3	-177.4	-176.5	-90.4	0	0	0	112	I348 G349 F350 L355 H356 L410 L411 R414	I348-Y352 WeakPolarHBondContact O-CB 3.44Å; I348-Y352 PolarHBondContact O-N 2.93Å; G349-Y352 PolarHBondContact O-N 3.1Å; F350-Y352 VanDerWaalsContact C-N 3.33Å; F350-Y352 PolarHBondContact O-N 3.17Å; Y352-L355 PolarHBondContact O-N 3.08Å; Y352-H356 PolarHBondContact O-N 2.91Å; Y352-L410 HydrophobicContact CE2-CB 4.26Å; Y352-L411 HydrophobicContact CD2-CD2 4.2Å; Y352-L411 HydrophobicContact CG-CD2 4.45Å; Y352-R414 HydrophobicContact CD2-CB 4.47Å; Y352-R414 HydrophobicContact CD2-CG 3.44Å; Y352-R414 VanDerWaalsContact CD2-CG 3.44Å; Y352-R414 HydrophobicContact CE2-CB 4.48Å; Y352-R414 HydrophobicContact CE2-CG 3.15Å; Y352-R414 HydrophobicContact CG-CG 4.27Å; Y352-R414 VanDerWaalsContact CZ-NH2 3.31Å; Y352-R414 PolarHBondContact OH-NE 2.92Å; Y352-R414 PolarHBondContact OH-NH2 3.49Å
353	D	95.9	Very high	93.2	Very high	43 Å²	43	38.3 Å²	38.3	23%	0.23	21%	0.207	C	C	.	.	H	α-helix	trans	-70.2	-34.9	179.8	-70.3	-28.1	0	0	0	111.5	Q300 I303 G349 F350 H356 I357	Q300-D353 PolarHBondContact NE2-OD2 3.31Å; I303-D353 HydrophobicContact CD1-CB 3.57Å; I303-D353 HydrophobicContact CG2-CB 3.96Å; G349-D353 WeakPolarHBondContact O-CB 3.44Å; G349-D353 PolarHBondContact O-N 3.22Å; F350-D353 PolarHBondContact O-N 3.16Å; D353-H356 VanDerWaalsContact O-CB 3.31Å; D353-H356 WeakPolarHBondContact O-CB 3.5Å; D353-H356 PolarHBondContact O-N 3.05Å; D353-I357 PolarHBondContact O-N 3.41Å
354	Y	96.4	Very high	93	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-47.3	173.7	173.8	-112.3	0	0	0	111.4	I325 E326 V329 F350 C351 H356 I357 L358 N371 I375	I325-Y354 HydrophobicContact CG2-CD2 3.66Å; I325-Y354 HydrophobicContact CG2-CE2 4.1Å; E326-Y354 WeakPolarHBondContact OE1-CE2 3.36Å; E326-Y354 PolarHBondContact OE1-OH 3.45Å; E326-Y354 VanDerWaalsContact OE1-OH 3.05Å; E326-Y354 PolarHBondContact OE2-OH 3.32Å; V329-Y354 HydrophobicContact CG1-CE1 4.35Å; V329-Y354 HydrophobicContact CG2-CD1 4.45Å; V329-Y354 HydrophobicContact CG2-CD2 4.3Å; V329-Y354 HydrophobicContact CG2-CE1 4.05Å; V329-Y354 HydrophobicContact CG2-CE2 3.87Å; F350-Y354 VanDerWaalsContact O-CB 3.31Å; F350-Y354 WeakPolarHBondContact O-CB 3.47Å; F350-Y354 PolarHBondContact O-N 3.18Å; C351-Y354 PolarHBondContact O-N 3.35Å; Y354-H356 PolarHBondContact O-N 2.91Å; Y354-I357 WeakPolarHBondContact O-CB 3.39Å; Y354-I357 PolarHBondContact O-N 3.39Å; Y354-L358 HydrophobicContact CD1-CD1 4.23Å; Y354-L358 HydrophobicContact CE1-CD1 3.59Å; Y354-L358 HydrophobicContact CE1-CG 4.13Å; Y354-L358 HydrophobicContact CE2-CD1 4.47Å; Y354-L358 HydrophobicContact CE2-CD2 4.01Å; Y354-L358 HydrophobicContact CE2-CG 4.22Å; Y354-L358 PolarHBondContact O-N 3.04Å; Y354-N371 HydrophobicContact CE1-CB 4.3Å; Y354-N371 PolarHBondContact OH-ND2 3.38Å; Y354-N371 VanDerWaalsContact OH-ND2 3.11Å; Y354-I375 HydrophobicContact CD1-CD1 3.98Å; Y354-I375 HydrophobicContact CE1-CD1 4.17Å
355	L	95.2	Very high	92.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-33.4	173.2	-68.6	174.6	0	0	0	111.8	C351 Y352 L358 K359 V372 I375 L411 R414 L415 V418	C351-L355 VanDerWaalsContact O-CG 3.31Å; C351-L355 WeakPolarHBondContact O-CG 3.21Å; C351-L355 PolarHBondContact O-N 3.44Å; Y352-L355 PolarHBondContact O-N 3.08Å; L355-L358 PolarHBondContact O-N 3.23Å; L355-K359 PolarHBondContact O-N 3.39Å; L355-V372 HydrophobicContact CD2-CG2 4.13Å; L355-I375 HydrophobicContact CD1-CG2 4.38Å; L355-I375 HydrophobicContact CD2-CD1 4.06Å; L355-I375 HydrophobicContact CG-CD1 4.39Å; L355-L411 HydrophobicContact CD1-CD2 4.34Å; L355-R414 HydrophobicContact CB-CB 4.25Å; L355-R414 HydrophobicContact CD1-CB 4.05Å; L355-L415 HydrophobicContact CD1-CD2 3.76Å; L355-L415 HydrophobicContact CD1-CG 3.75Å; L355-L415 HydrophobicContact CD2-CD2 3.59Å; L355-L415 HydrophobicContact CD2-CG 4.45Å; L355-L415 HydrophobicContact CG-CD2 4.34Å; L355-V418 HydrophobicContact CB-CG2 4.3Å; L355-V418 VanDerWaalsContact O-CG2 3.22Å; L355-V418 WeakPolarHBondContact O-CG2 3.38Å
356	H	94.1	Very high	92.5	Very high	61 Å²	61	47 Å²	47	28%	0.282	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-40.5	174.3	-173.4	65	0	0	0	112.6	Y352 D353 Y354 K359 Q360	Y352-H356 PolarHBondContact O-N 2.91Å; D353-H356 VanDerWaalsContact O-CB 3.31Å; D353-H356 WeakPolarHBondContact O-CB 3.5Å; D353-H356 PolarHBondContact O-N 3.05Å; Y354-H356 PolarHBondContact O-N 2.91Å; H356-K359 WeakPolarHBondContact O-CB 3.22Å; H356-K359 PolarHBondContact O-N 3.26Å; H356-Q360 PolarHBondContact CD2-NE2 3.01Å; H356-Q360 PolarHBondContact NE2-NE2 2.99Å; H356-Q360 WeakPolarHBondContact O-CG 3.34Å; H356-Q360 PolarHBondContact O-N 2.95Å
357	I	93.5	Very high	92.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-51.2	171	-68.5	-172.3	0	0	0	110.2	I303 W306 L322 I325 D353 Y354 K359 Q360 L361	I303-I357 HydrophobicContact CB-CD1 4.02Å; I303-I357 HydrophobicContact CG1-CD1 3.68Å; I303-I357 HydrophobicContact CG2-CD1 3.69Å; I303-I357 HydrophobicContact CG2-CG1 3.93Å; W306-I357 HydrophobicContact CB-CD1 4.4Å; W306-I357 HydrophobicContact CD2-CD1 3.8Å; W306-I357 HydrophobicContact CD2-CG1 4.29Å; W306-I357 HydrophobicContact CD2-CG2 4.34Å; W306-I357 HydrophobicContact CE3-CB 4.5Å; W306-I357 HydrophobicContact CE3-CD1 3.58Å; W306-I357 HydrophobicContact CE3-CG1 3.65Å; W306-I357 HydrophobicContact CE3-CG2 4.26Å; W306-I357 HydrophobicContact CG-CD1 4.14Å; W306-I357 HydrophobicContact CH2-CB 4.46Å; W306-I357 HydrophobicContact CH2-CG1 4.41Å; W306-I357 HydrophobicContact CH2-CG2 3.82Å; W306-I357 HydrophobicContact CZ2-CG2 3.88Å; W306-I357 HydrophobicContact CZ3-CB 4.24Å; W306-I357 HydrophobicContact CZ3-CD1 4.16Å; W306-I357 HydrophobicContact CZ3-CG1 3.72Å; W306-I357 HydrophobicContact CZ3-CG2 4.01Å; L322-I357 HydrophobicContact CD1-CG2 3.94Å; I325-I357 HydrophobicContact CD1-CD1 3.8Å; D353-I357 PolarHBondContact O-N 3.41Å; Y354-I357 WeakPolarHBondContact O-CB 3.39Å; Y354-I357 PolarHBondContact O-N 3.39Å; I357-K359 PolarHBondContact O-N 3.3Å; I357-Q360 WeakPolarHBondContact O-CA 3.48Å; I357-Q360 WeakPolarHBondContact O-CB 3.48Å; I357-Q360 PolarHBondContact O-N 3.45Å; I357-L361 PolarHBondContact O-N 3.33Å
358	L	93.1	Very high	92.1	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-58	-36.4	-176.5	-65.2	-169.5	0	0	0	111.9	Y354 L355 Q360 L361 L364 Q368 V372 V418	Y354-L358 HydrophobicContact CD1-CD1 4.23Å; Y354-L358 HydrophobicContact CE1-CD1 3.59Å; Y354-L358 HydrophobicContact CE1-CG 4.13Å; Y354-L358 HydrophobicContact CE2-CD1 4.47Å; Y354-L358 HydrophobicContact CE2-CD2 4.01Å; Y354-L358 HydrophobicContact CE2-CG 4.22Å; Y354-L358 PolarHBondContact O-N 3.04Å; L355-L358 PolarHBondContact O-N 3.23Å; L358-Q360 PolarHBondContact O-N 2.89Å; L358-L361 HydrophobicContact CD2-CD1 3.95Å; L358-L361 PolarHBondContact O-N 2.93Å; L358-L364 HydrophobicContact CB-CD2 3.89Å; L358-L364 HydrophobicContact CD2-CD2 4.06Å; L358-L364 HydrophobicContact CG-CD2 4.42Å; L358-Q368 HydrophobicContact CD2-CB 4.22Å; L358-Q368 HydrophobicContact CD2-CG 3.86Å; L358-V372 HydrophobicContact CD1-CG2 3.44Å; L358-V372 VanDerWaalsContact CD1-CG2 3.44Å; L358-V418 HydrophobicContact CB-CG1 4.06Å
359	K	90.7	Very high	91.9	Very high	98 Å²	98	54.9 Å²	54.9	43%	0.426	29%	0.289	S	S	.	.	H	α-helix	trans	-59.9	-32.7	173.3	-174.2	-177.1	175.8	-177.5	0	113.3	L355 H356 I357 L361 Q417 V418	L355-K359 PolarHBondContact O-N 3.39Å; H356-K359 WeakPolarHBondContact O-CB 3.22Å; H356-K359 PolarHBondContact O-N 3.26Å; I357-K359 PolarHBondContact O-N 3.3Å; K359-L361 VanDerWaalsContact C-N 3.33Å; K359-Q417 HydrophobicContact CD-CB 4.11Å; K359-V418 HydrophobicContact CB-CG2 3.97Å
360	Q	89.3	Confident	91.7	Very high	97 Å²	97	56.1 Å²	56.1	45%	0.453	30%	0.296	S	S	.	.	H	α-helix	trans	-79.8	-16.5	-179.5	-63	-179.9	14.5	0	0	112.7	W306 H356 I357 L358	W306-Q360 HydrophobicContact CH2-CB 4.37Å; H356-Q360 PolarHBondContact CD2-NE2 3.01Å; H356-Q360 PolarHBondContact NE2-NE2 2.99Å; H356-Q360 WeakPolarHBondContact O-CG 3.34Å; H356-Q360 PolarHBondContact O-N 2.95Å; I357-Q360 WeakPolarHBondContact O-CA 3.48Å; I357-Q360 WeakPolarHBondContact O-CB 3.48Å; I357-Q360 PolarHBondContact O-N 3.45Å; L358-Q360 PolarHBondContact O-N 2.89Å
361	L	86.6	Confident	91.6	Very high	48 Å²	48	56.6 Å²	56.6	25%	0.251	30%	0.299	S	S	.	.			trans	-77.8	138	177.2	-58.3	-179.5	0	0	0	110.5	W306 L322 I357 L358 K359 L364	W306-L361 HydrophobicContact CZ2-CD2 4.28Å; L322-L361 HydrophobicContact CD2-CD1 4.47Å; I357-L361 PolarHBondContact O-N 3.33Å; L358-L361 HydrophobicContact CD2-CD1 3.95Å; L358-L361 PolarHBondContact O-N 2.93Å; K359-L361 VanDerWaalsContact C-N 3.33Å; L361-L364 HydrophobicContact CB-CD2 4.21Å; L361-L364 HydrophobicContact CD1-CD2 4.31Å
362	T	80.5	Confident	91.4	Very high	147 Å²	147	56.7 Å²	56.7	90%	0.902	30%	0.3	S	S	*	.	S	Bend	trans	-74	-32.2	-179.7	51	0	0	0	0	112.9
363	V	85.9	Confident	91.2	Very high	117 Å²	117	56.7 Å²	56.7	71%	0.709	30%	0.302	S	S	*	.	S	Bend	trans	-140.2	128.1	178.6	-177.3	0	0	0	0	108.6
364	L	88.8	Confident	91.1	Very high	30 Å²	30	56.3 Å²	56.3	16%	0.157	31%	0.305	C	S	.	.			trans	-87.5	138.3	175.4	-59.4	177.6	0	0	0	110.9	L358 L361 Q368 K369 V418	L358-L364 HydrophobicContact CB-CD2 3.89Å; L358-L364 HydrophobicContact CD2-CD2 4.06Å; L358-L364 HydrophobicContact CG-CD2 4.42Å; L361-L364 HydrophobicContact CB-CD2 4.21Å; L361-L364 HydrophobicContact CD1-CD2 4.31Å; L364-Q368 HydrophobicContact CB-CB 4.27Å; L364-Q368 HydrophobicContact CD2-CB 4.49Å; L364-K369 HydrophobicContact CB-CG 4.04Å; L364-K369 WeakPolarHBondContact O-CE 3.47Å; L364-V418 HydrophobicContact CD1-CG1 3.87Å
365	S	90.3	Very high	91.1	Very high	57 Å²	57	56.3 Å²	56.3	40%	0.399	31%	0.305	S	S	.	.			trans	-69.2	162.7	170.1	76.2	0	0	0	0	111.4	Q367 Q368 K369	S365-Q367 VanDerWaalsContact C-N 3.27Å; S365-Q367 PolarHBondContact O-N 3.21Å; S365-Q368 PolarHBondContact O-N 3.26Å; S365-Q368 VanDerWaalsContact OG-CG 3.3Å; S365-Q368 WeakPolarHBondContact OG-CG 3.36Å; S365-Q368 PolarHBondContact OG-N 3.45Å; S365-Q368 VanDerWaalsContact OG-N 3.15Å; S365-Q368 PolarHBondContact OG-OE1 2.72Å; S365-K369 WeakPolarHBondContact O-CG 3.42Å; S365-K369 PolarHBondContact O-N 3Å
366	D	90	Very high	91	Very high	126 Å²	126	56.3 Å²	56.3	67%	0.674	31%	0.305	S	S	*	.	H	α-helix	trans	-65.6	-32.6	178.8	-64	-31.3	0	0	0	112.2	K369 A370	D366-K369 PolarHBondContact O-N 3.5Å; D366-K369 IonicContact OD1-NZ 3.24Å; D366-K369 PolarHBondContact OD1-NZ 2.85Å; D366-A370 WeakPolarHBondContact O-CB 3.44Å; D366-A370 PolarHBondContact O-N 3.32Å
367	Q	90.4	Very high	91	Very high	123 Å²	123	56.9 Å²	56.9	58%	0.575	31%	0.309	S	S	*	.	H	α-helix	trans	-64.3	-44.1	171.6	-175	61.1	49.4	0	0	111.5	S365 K369 A370 N371	S365-Q367 VanDerWaalsContact C-N 3.27Å; S365-Q367 PolarHBondContact O-N 3.21Å; Q367-K369 VanDerWaalsContact C-N 3.33Å; Q367-K369 PolarHBondContact O-N 2.92Å; Q367-A370 WeakPolarHBondContact O-CB 3.44Å; Q367-A370 PolarHBondContact O-N 3.15Å; Q367-N371 PolarHBondContact NE2-OD1 3.43Å; Q367-N371 PolarHBondContact O-N 3.41Å; Q367-N371 PolarHBondContact O-OD1 2.95Å
368	Q	92.5	Very high	91	Very high	14 Å²	14	57 Å²	57	7%	0.065	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-39	177.6	-75.3	169.2	-23.7	0	0	111.8	E326 L358 L364 S365 N371 V372	E326-Q368 VanDerWaalsContact OE1-CG 3.23Å; E326-Q368 WeakPolarHBondContact OE1-CG 3.47Å; E326-Q368 PolarHBondContact OE1-NE2 3.32Å; L358-Q368 HydrophobicContact CD2-CB 4.22Å; L358-Q368 HydrophobicContact CD2-CG 3.86Å; L364-Q368 HydrophobicContact CB-CB 4.27Å; L364-Q368 HydrophobicContact CD2-CB 4.49Å; S365-Q368 PolarHBondContact O-N 3.26Å; S365-Q368 VanDerWaalsContact OG-CG 3.3Å; S365-Q368 WeakPolarHBondContact OG-CG 3.36Å; S365-Q368 PolarHBondContact OG-N 3.45Å; S365-Q368 VanDerWaalsContact OG-N 3.15Å; S365-Q368 PolarHBondContact OG-OE1 2.72Å; Q368-N371 PolarHBondContact O-N 3.43Å; Q368-V372 VanDerWaalsContact O-CG2 3.29Å; Q368-V372 WeakPolarHBondContact O-CG2 3.47Å; Q368-V372 PolarHBondContact O-N 2.98Å
369	K	90.7	Very high	91.1	Very high	99 Å²	99	57 Å²	57	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-43	173.3	-68.1	172.4	-166.9	159.3	0	111.6	L364 S365 D366 Q367 N371 V372 E373	L364-K369 HydrophobicContact CB-CG 4.04Å; L364-K369 WeakPolarHBondContact O-CE 3.47Å; S365-K369 WeakPolarHBondContact O-CG 3.42Å; S365-K369 PolarHBondContact O-N 3Å; D366-K369 PolarHBondContact O-N 3.5Å; D366-K369 IonicContact OD1-NZ 3.24Å; D366-K369 PolarHBondContact OD1-NZ 2.85Å; Q367-K369 VanDerWaalsContact C-N 3.33Å; Q367-K369 PolarHBondContact O-N 2.92Å; K369-N371 VanDerWaalsContact C-N 3.33Å; K369-N371 PolarHBondContact O-N 3.2Å; K369-V372 PolarHBondContact O-N 3.07Å; K369-E373 PolarHBondContact O-N 3.44Å
370	A	92.3	Very high	91.3	Very high	47 Å²	47	52.8 Å²	52.8	39%	0.388	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-40.5	175.1	0	0	0	0	0	111.7	D366 Q367 E373 A374	D366-A370 WeakPolarHBondContact O-CB 3.44Å; D366-A370 PolarHBondContact O-N 3.32Å; Q367-A370 WeakPolarHBondContact O-CB 3.44Å; Q367-A370 PolarHBondContact O-N 3.15Å; A370-E373 PolarHBondContact O-N 3.01Å; A370-A374 WeakPolarHBondContact O-CB 3.35Å; A370-A374 PolarHBondContact O-N 3.13Å
371	N	93.7	Very high	91.4	Very high	12 Å²	12	54.2 Å²	54.2	6%	0.064	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-45.1	174.7	-65.7	-11.6	0	0	0	111.2	E326 V329 Y354 Q367 Q368 K369 E373 A374 I375	E326-N371 PolarHBondContact OE2-ND2 2.98Å; E326-N371 VanDerWaalsContact OE2-ND2 3.13Å; V329-N371 HydrophobicContact CG1-CB 3.97Å; Y354-N371 HydrophobicContact CE1-CB 4.3Å; Y354-N371 PolarHBondContact OH-ND2 3.38Å; Y354-N371 VanDerWaalsContact OH-ND2 3.11Å; Q367-N371 PolarHBondContact NE2-OD1 3.43Å; Q367-N371 PolarHBondContact O-N 3.41Å; Q367-N371 PolarHBondContact O-OD1 2.95Å; Q368-N371 PolarHBondContact O-N 3.43Å; K369-N371 VanDerWaalsContact C-N 3.33Å; K369-N371 PolarHBondContact O-N 3.2Å; N371-E373 VanDerWaalsContact C-N 3.33Å; N371-E373 PolarHBondContact O-N 2.91Å; N371-A374 PolarHBondContact O-N 2.69Å; N371-I375 VanDerWaalsContact O-CG1 3.27Å; N371-I375 WeakPolarHBondContact O-CG1 3.24Å; N371-I375 PolarHBondContact O-N 2.94Å
372	V	93.3	Very high	91.8	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-42.7	175.5	170.9	0	0	0	0	111.3	L355 L358 Q368 K369 M376 L415 V418 L422	L355-V372 HydrophobicContact CD2-CG2 4.13Å; L358-V372 HydrophobicContact CD1-CG2 3.44Å; L358-V372 VanDerWaalsContact CD1-CG2 3.44Å; Q368-V372 VanDerWaalsContact O-CG2 3.29Å; Q368-V372 WeakPolarHBondContact O-CG2 3.47Å; Q368-V372 PolarHBondContact O-N 2.98Å; K369-V372 PolarHBondContact O-N 3.07Å; V372-M376 HydrophobicContact CG1-CE 4.33Å; V372-M376 VanDerWaalsContact O-CB 3.26Å; V372-M376 WeakPolarHBondContact O-CB 3.24Å; V372-M376 PolarHBondContact O-N 3.37Å; V372-L415 HydrophobicContact CG1-CD2 3.77Å; V372-V418 HydrophobicContact CG2-CG1 4.1Å; V372-L422 HydrophobicContact CG1-CD2 4.11Å
373	E	92.3	Very high	92.5	Very high	69 Å²	69	46 Å²	46	32%	0.322	25%	0.247	S	C	.	.	H	α-helix	trans	-63.5	-43.4	175.4	-168.5	173.7	-177.4	0	0	111.6	K369 A370 N371 M376 L377 L422 R429	K369-E373 PolarHBondContact O-N 3.44Å; A370-E373 PolarHBondContact O-N 3.01Å; N371-E373 VanDerWaalsContact C-N 3.33Å; N371-E373 PolarHBondContact O-N 2.91Å; E373-M376 WeakPolarHBondContact O-CB 3.24Å; E373-M376 PolarHBondContact O-N 2.91Å; E373-L377 HydrophobicContact CG-CD1 4.28Å; E373-L377 WeakPolarHBondContact O-CG 3.49Å; E373-L377 PolarHBondContact O-N 3.11Å; E373-L422 HydrophobicContact CB-CD2 4.07Å; E373-R429 IonicContact OE1-NH2 3.54Å
374	A	94.3	Very high	92.9	Very high	35 Å²	35	42.4 Å²	42.4	29%	0.289	23%	0.226	S	C	.	.	H	α-helix	trans	-63.2	-46.1	178.4	0	0	0	0	0	112.4	L333 A370 N371 M376 L377 A378	L333-A374 HydrophobicContact CD1-CB 3.77Å; L333-A374 HydrophobicContact CD2-CB 4.07Å; A370-A374 WeakPolarHBondContact O-CB 3.35Å; A370-A374 PolarHBondContact O-N 3.13Å; N371-A374 PolarHBondContact O-N 2.69Å; A374-M376 VanDerWaalsContact C-N 3.27Å; A374-M376 PolarHBondContact O-N 3.05Å; A374-L377 PolarHBondContact O-N 2.81Å; A374-A378 WeakPolarHBondContact O-CB 3.26Å; A374-A378 PolarHBondContact O-N 3.26Å
375	I	95.6	Very high	93.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.5	-43.2	175.2	-63.8	167.3	0	0	0	109.7	M332 L333 L336 Y354 L355 N371 A378 V379 L415	M332-I375 HydrophobicContact CE-CD1 3.85Å; M332-I375 HydrophobicContact CE-CG1 4.12Å; L333-I375 HydrophobicContact CD2-CB 4.36Å; L333-I375 HydrophobicContact CD2-CG1 3.6Å; L336-I375 HydrophobicContact CD2-CG2 4.25Å; Y354-I375 HydrophobicContact CD1-CD1 3.98Å; Y354-I375 HydrophobicContact CE1-CD1 4.17Å; L355-I375 HydrophobicContact CD1-CG2 4.38Å; L355-I375 HydrophobicContact CD2-CD1 4.06Å; L355-I375 HydrophobicContact CG-CD1 4.39Å; N371-I375 VanDerWaalsContact O-CG1 3.27Å; N371-I375 WeakPolarHBondContact O-CG1 3.24Å; N371-I375 PolarHBondContact O-N 2.94Å; I375-A378 WeakPolarHBondContact O-CB 3.29Å; I375-A378 PolarHBondContact O-N 3.19Å; I375-V379 HydrophobicContact CG2-CG2 4.29Å; I375-V379 VanDerWaalsContact O-CG2 3.29Å; I375-V379 WeakPolarHBondContact O-CG2 3.38Å; I375-V379 PolarHBondContact O-N 3.46Å; I375-L415 HydrophobicContact CB-CD2 4.47Å; I375-L415 HydrophobicContact CG2-CD1 4.34Å; I375-L415 HydrophobicContact CG2-CD2 4.3Å
376	M	93.6	Very high	92.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-45.6	179.5	-176.6	-174.2	-50.4	0	0	112.5	V372 E373 A374 A378 V379 M380 L415 L422 L423 S426	V372-M376 HydrophobicContact CG1-CE 4.33Å; V372-M376 VanDerWaalsContact O-CB 3.26Å; V372-M376 WeakPolarHBondContact O-CB 3.24Å; V372-M376 PolarHBondContact O-N 3.37Å; E373-M376 WeakPolarHBondContact O-CB 3.24Å; E373-M376 PolarHBondContact O-N 2.91Å; A374-M376 VanDerWaalsContact C-N 3.27Å; A374-M376 PolarHBondContact O-N 3.05Å; M376-A378 VanDerWaalsContact C-N 3.35Å; M376-V379 PolarHBondContact O-N 2.92Å; M376-M380 HydrophobicContact CG-CE 3.68Å; M376-M380 HydrophobicContact CG-SD 4.4Å; M376-M380 WeakPolarHBondContact O-CB 3.46Å; M376-M380 VanDerWaalsContact O-CG 3.24Å; M376-M380 WeakPolarHBondContact O-CG 3.29Å; M376-M380 PolarHBondContact O-N 3.16Å; M376-M380 HydrophobicContact SD-CE 4.03Å; M376-L415 HydrophobicContact CB-CD1 3.85Å; M376-L415 HydrophobicContact CB-CD2 4.39Å; M376-L415 HydrophobicContact CG-CD1 4.21Å; M376-L422 HydrophobicContact CE-CB 4.24Å; M376-L422 HydrophobicContact CE-CD2 3.87Å; M376-L422 HydrophobicContact CE-CG 3.76Å; M376-L422 HydrophobicContact SD-CG 4.38Å; M376-L423 HydrophobicContact CE-CB 4.02Å; M376-L423 HydrophobicContact CE-CD1 4.27Å; M376-L423 HydrophobicContact CG-CD1 4.04Å; M376-L423 HydrophobicContact SD-CB 4.27Å; M376-L423 HydrophobicContact SD-CD1 3.82Å; M376-S426 VanDerWaalsContact SD-CB 3.52Å
377	L	93	Very high	92.6	Very high	72 Å²	72	44 Å²	44	38%	0.377	22%	0.224	S	C	.	.	H	α-helix	trans	-65.9	-38.1	176.8	-67.4	174.7	0	0	0	111.9	E373 A374 M380 K381	E373-L377 HydrophobicContact CG-CD1 4.28Å; E373-L377 WeakPolarHBondContact O-CG 3.49Å; E373-L377 PolarHBondContact O-N 3.11Å; A374-L377 PolarHBondContact O-N 2.81Å; L377-M380 PolarHBondContact O-N 2.97Å; L377-K381 PolarHBondContact O-N 2.93Å
378	A	94.8	Very high	92.4	Very high	4 Å²	4	46.9 Å²	46.9	3%	0.033	24%	0.238	C	C	.	.	H	α-helix	trans	-60.4	-50	174.2	0	0	0	0	0	111.5	L336 I337 A374 I375 M376 M380 K381 K382	L336-A378 HydrophobicContact CD2-CB 3.79Å; L336-A378 HydrophobicContact CG-CB 4.2Å; I337-A378 HydrophobicContact CD1-CB 3.92Å; I337-A378 HydrophobicContact CG1-CB 3.47Å; I337-A378 VanDerWaalsContact CG1-CB 3.47Å; A374-A378 WeakPolarHBondContact O-CB 3.26Å; A374-A378 PolarHBondContact O-N 3.26Å; I375-A378 WeakPolarHBondContact O-CB 3.29Å; I375-A378 PolarHBondContact O-N 3.19Å; M376-A378 VanDerWaalsContact C-N 3.35Å; A378-M380 VanDerWaalsContact C-N 3.35Å; A378-M380 PolarHBondContact O-N 3.27Å; A378-K381 PolarHBondContact O-N 3.42Å; A378-K382 WeakPolarHBondContact O-CB 3.46Å; A378-K382 PolarHBondContact O-N 2.79Å
379	V	95.2	Very high	92.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.2	-43.9	176.9	171.1	0	0	0	0	111.1	I375 M376 K381 K382 L383 L408 L411 L412	I375-V379 HydrophobicContact CG2-CG2 4.29Å; I375-V379 VanDerWaalsContact O-CG2 3.29Å; I375-V379 WeakPolarHBondContact O-CG2 3.38Å; I375-V379 PolarHBondContact O-N 3.46Å; M376-V379 PolarHBondContact O-N 2.92Å; V379-K381 VanDerWaalsContact C-N 3.3Å; V379-K381 PolarHBondContact O-N 3.46Å; V379-K382 PolarHBondContact O-N 3.24Å; V379-L383 HydrophobicContact CG1-CD1 4.19Å; V379-L383 VanDerWaalsContact O-CG 3.25Å; V379-L383 WeakPolarHBondContact O-CG 3.27Å; V379-L383 PolarHBondContact O-N 3Å; V379-L408 HydrophobicContact CG1-CB 4.26Å; V379-L408 HydrophobicContact CG2-CD2 4.39Å; V379-L411 HydrophobicContact CG2-CB 4.01Å; V379-L411 HydrophobicContact CG2-CD1 3.9Å; V379-L412 HydrophobicContact CG1-CB 4.44Å; V379-L412 HydrophobicContact CG1-CD1 4.3Å
380	M	93.3	Very high	92	Very high	11 Å²	11	45.7 Å²	45.7	5%	0.054	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-38.5	177.2	-72.8	179.8	-178.6	0	0	112.6	M376 L377 A378 L423 V427 V430 L452	M376-M380 HydrophobicContact CG-CE 3.68Å; M376-M380 HydrophobicContact CG-SD 4.4Å; M376-M380 WeakPolarHBondContact O-CB 3.46Å; M376-M380 VanDerWaalsContact O-CG 3.24Å; M376-M380 WeakPolarHBondContact O-CG 3.29Å; M376-M380 PolarHBondContact O-N 3.16Å; M376-M380 HydrophobicContact SD-CE 4.03Å; L377-M380 PolarHBondContact O-N 2.97Å; A378-M380 VanDerWaalsContact C-N 3.35Å; A378-M380 PolarHBondContact O-N 3.27Å; M380-L423 HydrophobicContact CE-CD1 3.92Å; M380-V427 HydrophobicContact CE-CB 4.39Å; M380-V427 HydrophobicContact CE-CG2 3.38Å; M380-V430 HydrophobicContact SD-CG2 4.16Å; M380-L452 HydrophobicContact CB-CD1 4.35Å; M380-L452 HydrophobicContact CE-CD2 4.47Å; M380-L452 HydrophobicContact CG-CD1 3.95Å; M380-L452 HydrophobicContact CG-CD2 3.86Å; M380-L452 HydrophobicContact SD-CD1 4.22Å
381	K	92.5	Very high	91.7	Very high	127 Å²	127	45.5 Å²	45.5	55%	0.552	23%	0.225	S	C	*	.	H	α-helix	trans	-68.1	-51.2	175	-174.5	-172.7	175.2	-162.6	0	110.8	L377 A378 V379 L383 T384	L377-K381 PolarHBondContact O-N 2.93Å; A378-K381 PolarHBondContact O-N 3.42Å; V379-K381 VanDerWaalsContact C-N 3.3Å; V379-K381 PolarHBondContact O-N 3.46Å; K381-L383 PolarHBondContact O-N 3.45Å; K381-L383 VanDerWaalsContact O-N 3.12Å; K381-T384 WeakPolarHBondContact O-CB 3.31Å; K381-T384 WeakPolarHBondContact O-CG2 3.24Å; K381-T384 PolarHBondContact O-N 2.91Å; K381-T384 PolarHBondContact O-OG1 2.99Å
382	K	94.7	Very high	91.2	Very high	20 Å²	20	53.2 Å²	53.2	9%	0.087	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-14.9	-178.2	-80.6	-61.5	-154.5	164.8	0	114.8	H338 E339 D341 A378 V379 T384 Y404 L408	H338-K382 WeakPolarHBondContact O-CE 3.47Å; H338-K382 PolarHBondContact O-NZ 2.81Å; E339-K382 PolarHBondContact O-NZ 3.01Å; D341-K382 IonicContact OD1-NZ 3.87Å; D341-K382 PolarHBondContact OD1-NZ 3.42Å; A378-K382 WeakPolarHBondContact O-CB 3.46Å; A378-K382 PolarHBondContact O-N 2.79Å; V379-K382 PolarHBondContact O-N 3.24Å; K382-T384 VanDerWaalsContact C-N 3.25Å; K382-T384 PolarHBondContact O-N 3.43Å; K382-Y404 HydrophobicContact CB-CE1 4.43Å; K382-Y404 WeakPolarHBondContact CB-OH 3.29Å; K382-Y404 WeakPolarHBondContact CD-OH 3.31Å; K382-Y404 WeakPolarHBondContact CG-OH 3.36Å; K382-L408 HydrophobicContact CB-CD1 3.71Å; K382-L408 HydrophobicContact CB-CD2 4.24Å; K382-L408 WeakPolarHBondContact O-CD1 3.42Å
383	L	94.8	Very high	90.7	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.2	170.2	-77.1	164.9	0	0	0	113.2	V379 K381 R405 L408 V448 L452 M455	V379-L383 HydrophobicContact CG1-CD1 4.19Å; V379-L383 VanDerWaalsContact O-CG 3.25Å; V379-L383 WeakPolarHBondContact O-CG 3.27Å; V379-L383 PolarHBondContact O-N 3Å; K381-L383 PolarHBondContact O-N 3.45Å; K381-L383 VanDerWaalsContact O-N 3.12Å; L383-R405 HydrophobicContact CD2-CB 4.45Å; L383-R405 HydrophobicContact CD2-CG 4.17Å; L383-R405 PolarHBondContact O-NE 2.94Å; L383-R405 PolarHBondContact O-NH2 3.4Å; L383-L408 HydrophobicContact CD2-CB 3.97Å; L383-L408 HydrophobicContact CD2-CD1 4.1Å; L383-L408 HydrophobicContact CG-CB 4.36Å; L383-L408 HydrophobicContact CG-CD1 4.14Å; L383-V448 HydrophobicContact CB-CG1 4.33Å; L383-V448 HydrophobicContact CB-CG2 4.33Å; L383-V448 WeakPolarHBondContact O-CG2 3.49Å; L383-L452 HydrophobicContact CD1-CD2 3.87Å; L383-M455 HydrophobicContact CD1-CE 3.67Å
384	T	93.9	Very high	90.4	Very high	42 Å²	42	60.7 Å²	60.7	26%	0.258	30%	0.299	S	S	.	.	S	Bend	trans	-68.9	140.9	178.8	57.2	0	0	0	0	111.8	K381 K382 F401 V448	K381-T384 WeakPolarHBondContact O-CB 3.31Å; K381-T384 WeakPolarHBondContact O-CG2 3.24Å; K381-T384 PolarHBondContact O-N 2.91Å; K381-T384 PolarHBondContact O-OG1 2.99Å; K382-T384 VanDerWaalsContact C-N 3.25Å; K382-T384 PolarHBondContact O-N 3.43Å; T384-F401 WeakPolarHBondContact O-CZ 3.39Å; T384-V448 VanDerWaalsContact CA-CG2 3.49Å; T384-V448 HydrophobicContact CG2-CB 4.31Å; T384-V448 HydrophobicContact CG2-CG2 3.75Å
385	Y	93	Very high	90.2	Very high	20 Å²	20	60.9 Å²	60.9	8%	0.078	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-62.3	142.8	168.3	-77.9	-72.4	0	0	0	110.6	Y389 F391 F401 R405 F443 E447	Y385-Y389 AromaticContact CD1-CD1 3.81Å; Y385-Y389 HydrophobicContact CD1-CD1 3.81Å; Y385-Y389 AromaticContact CD1-CD2 3.65Å; Y385-Y389 HydrophobicContact CD1-CD2 3.65Å; Y385-Y389 HydrophobicContact CD1-CE1 4.14Å; Y385-Y389 HydrophobicContact CD1-CE2 4Å; Y385-Y389 AromaticContact CD1-CG 3.55Å; Y385-Y389 HydrophobicContact CD1-CG 3.55Å; Y385-Y389 AromaticContact CE1-CD1 3.74Å; Y385-Y389 HydrophobicContact CE1-CD1 3.74Å; Y385-Y389 AromaticContact CE1-CD2 3.84Å; Y385-Y389 HydrophobicContact CE1-CD2 3.84Å; Y385-Y389 AromaticContact CE1-CE1 3.58Å; Y385-Y389 HydrophobicContact CE1-CE1 3.58Å; Y385-Y389 AromaticContact CE1-CE2 3.69Å; Y385-Y389 HydrophobicContact CE1-CE2 3.69Å; Y385-Y389 AromaticContact CE1-CG 3.87Å; Y385-Y389 HydrophobicContact CE1-CG 3.87Å; Y385-Y389 AromaticContact CE1-CZ 3.56Å; Y385-F391 HydrophobicContact CD1-CE1 4.26Å; Y385-F391 AromaticContact CD1-CZ 3.77Å; Y385-F391 HydrophobicContact CD1-CZ 3.77Å; Y385-F391 HydrophobicContact CD2-CE1 4.37Å; Y385-F391 AromaticContact CD2-CZ 3.84Å; Y385-F391 HydrophobicContact CD2-CZ 3.84Å; Y385-F391 AromaticContact CE1-CE1 3.76Å; Y385-F391 HydrophobicContact CE1-CE1 3.76Å; Y385-F391 AromaticContact CE1-CZ 3.76Å; Y385-F391 HydrophobicContact CE1-CZ 3.76Å; Y385-F391 AromaticContact CE2-CE1 3.88Å; Y385-F391 HydrophobicContact CE2-CE1 3.88Å; Y385-F391 AromaticContact CE2-CZ 3.83Å; Y385-F391 HydrophobicContact CE2-CZ 3.83Å; Y385-F391 AromaticContact CG-CZ 3.8Å; Y385-F391 HydrophobicContact CG-CZ 3.8Å; Y385-F391 AromaticContact CZ-CE1 3.51Å; Y385-F391 AromaticContact CZ-CZ 3.76Å; Y385-F401 HydrophobicContact CD1-CD1 4.11Å; Y385-F401 AromaticContact CD1-CE1 3.44Å; Y385-F401 HydrophobicContact CD1-CE1 3.44Å; Y385-F401 VanDerWaalsContact CD1-CE1 3.44Å; Y385-F401 HydrophobicContact CD1-CZ 4.3Å; Y385-F401 HydrophobicContact CE1-CD1 4.18Å; Y385-F401 AromaticContact CE1-CE1 3.75Å; Y385-F401 HydrophobicContact CE1-CE1 3.75Å; Y385-F401 HydrophobicContact CG-CE1 4.24Å; Y385-R405 PolarHBondContact OH-NH1 3.26Å; Y385-F443 HydrophobicContact CD2-CE2 4.37Å; Y385-E447 HydrophobicContact CE2-CG 4.17Å
386	D	87.1	Confident	89.9	Confident	83 Å²	83	68.3 Å²	68.3	44%	0.444	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-72.2	157.7	167.4	-62.5	-38.2	0	0	0	111.5	E388 Y389	D386-E388 PolarHBondContact O-N 3.47Å; D386-Y389 PolarHBondContact O-N 2.87Å
387	E	84	Confident	89.6	Confident	142 Å²	142	73.7 Å²	73.7	66%	0.664	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-22.8	179.4	-59.2	-161.2	159.9	0	0	112.4	R442 M444	E387-R442 IonicContact OE1-CZ 2.7Å; E387-R442 IonicContact OE1-NH1 3.64Å; E387-R442 PolarHBondContact OE1-NH1 2.92Å; E387-R442 IonicContact OE1-NH2 3.86Å; E387-M444 HydrophobicContact CG-CE 3.98Å; E387-M444 HydrophobicContact CG-SD 4.48Å
388	E	85.2	Confident	89.6	Confident	185 Å²	185	71.2 Å²	71.2	86%	0.864	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.4	-175.7	-58.3	-173.8	170.3	0	0	113.9	D386 N390	D386-E388 PolarHBondContact O-N 3.47Å; E388-N390 PolarHBondContact O-N 3.05Å
389	Y	87.6	Confident	89.4	Confident	26 Å²	26	74 Å²	74	10%	0.102	38%	0.377	C	S	.	.			trans	-61.7	123.9	-175.5	-171.7	-83.1	0	0	0	112.7	Y385 D386 F391 E398 F401	Y385-Y389 AromaticContact CD1-CD1 3.81Å; Y385-Y389 HydrophobicContact CD1-CD1 3.81Å; Y385-Y389 AromaticContact CD1-CD2 3.65Å; Y385-Y389 HydrophobicContact CD1-CD2 3.65Å; Y385-Y389 HydrophobicContact CD1-CE1 4.14Å; Y385-Y389 HydrophobicContact CD1-CE2 4Å; Y385-Y389 AromaticContact CD1-CG 3.55Å; Y385-Y389 HydrophobicContact CD1-CG 3.55Å; Y385-Y389 AromaticContact CE1-CD1 3.74Å; Y385-Y389 HydrophobicContact CE1-CD1 3.74Å; Y385-Y389 AromaticContact CE1-CD2 3.84Å; Y385-Y389 HydrophobicContact CE1-CD2 3.84Å; Y385-Y389 AromaticContact CE1-CE1 3.58Å; Y385-Y389 HydrophobicContact CE1-CE1 3.58Å; Y385-Y389 AromaticContact CE1-CE2 3.69Å; Y385-Y389 HydrophobicContact CE1-CE2 3.69Å; Y385-Y389 AromaticContact CE1-CG 3.87Å; Y385-Y389 HydrophobicContact CE1-CG 3.87Å; Y385-Y389 AromaticContact CE1-CZ 3.56Å; D386-Y389 PolarHBondContact O-N 2.87Å; Y389-F391 AromaticContact CD1-CD1 3.8Å; Y389-F391 HydrophobicContact CD1-CD1 3.8Å; Y389-F391 AromaticContact CD1-CD2 3.81Å; Y389-F391 HydrophobicContact CD1-CD2 3.81Å; Y389-F391 AromaticContact CD1-CE1 3.53Å; Y389-F391 HydrophobicContact CD1-CE1 3.53Å; Y389-F391 AromaticContact CD1-CE2 3.54Å; Y389-F391 HydrophobicContact CD1-CE2 3.54Å; Y389-F391 AromaticContact CD1-CG 3.93Å; Y389-F391 HydrophobicContact CD1-CG 3.93Å; Y389-F391 AromaticContact CD1-CZ 3.39Å; Y389-F391 HydrophobicContact CD1-CZ 3.39Å; Y389-F391 AromaticContact CE1-CD1 3.66Å; Y389-F391 HydrophobicContact CE1-CD1 3.66Å; Y389-F391 HydrophobicContact CE1-CD2 4.47Å; Y389-F391 AromaticContact CE1-CE1 3.52Å; Y389-F391 HydrophobicContact CE1-CE1 3.52Å; Y389-F391 HydrophobicContact CE1-CE2 4.36Å; Y389-F391 HydrophobicContact CE1-CG 4.14Å; Y389-F391 AromaticContact CE1-CZ 3.9Å; Y389-F391 HydrophobicContact CE1-CZ 3.9Å; Y389-F391 HydrophobicContact CG-CE2 4.32Å; Y389-F391 HydrophobicContact CG-CZ 4.22Å; Y389-F391 WeakPolarHBondContact O-CD2 3.18Å; Y389-F391 PolarHBondContact O-N 2.97Å; Y389-E398 HydrophobicContact CD1-CG 4.23Å; Y389-E398 HydrophobicContact CD2-CB 4.47Å; Y389-E398 HydrophobicContact CD2-CG 3.86Å; Y389-E398 HydrophobicContact CE1-CG 3.88Å; Y389-E398 HydrophobicContact CE2-CB 3.66Å; Y389-E398 HydrophobicContact CE2-CG 3.47Å; Y389-E398 VanDerWaalsContact CE2-CG 3.47Å; Y389-E398 HydrophobicContact CG-CG 4.23Å; Y389-E398 VanDerWaalsContact CZ-CG 3.48Å; Y389-F401 AromaticContact CD2-CD1 3.79Å; Y389-F401 HydrophobicContact CD2-CD1 3.79Å; Y389-F401 HydrophobicContact CD2-CE1 4.34Å; Y389-F401 HydrophobicContact CD2-CG 4.39Å; Y389-F401 HydrophobicContact CE2-CB 4.29Å; Y389-F401 AromaticContact CE2-CD1 3.58Å; Y389-F401 HydrophobicContact CE2-CD1 3.58Å; Y389-F401 HydrophobicContact CE2-CE1 4.36Å; Y389-F401 HydrophobicContact CE2-CG 4.3Å
390	N	87.8	Confident	89.2	Confident	62 Å²	62	78.4 Å²	78.4	33%	0.332	40%	0.399	S	S	.	.			trans	-90.2	101.2	-177	-168	-17.8	0	0	0	113	E388 E392 N393 E398	E388-N390 PolarHBondContact O-N 3.05Å; N390-E392 VanDerWaalsContact C-N 3.32Å; N390-E392 PolarHBondContact O-N 3.14Å; N390-E392 PolarHBondContact OD1-N 2.96Å; N390-N393 PolarHBondContact OD1-N 2.72Å; N390-E398 WeakPolarHBondContact CB-OE1 3.41Å; N390-E398 PolarHBondContact N-OE1 2.77Å
391	F	86.3	Confident	89.2	Confident	43 Å²	43	78.5 Å²	78.5	19%	0.189	40%	0.399	C	S	.	.	S	Bend	trans	-76.4	-13.1	177	-67	-81.1	0	0	0	115	Y385 Y389 F443 H495 S497	Y385-F391 HydrophobicContact CD1-CE1 4.26Å; Y385-F391 AromaticContact CD1-CZ 3.77Å; Y385-F391 HydrophobicContact CD1-CZ 3.77Å; Y385-F391 HydrophobicContact CD2-CE1 4.37Å; Y385-F391 AromaticContact CD2-CZ 3.84Å; Y385-F391 HydrophobicContact CD2-CZ 3.84Å; Y385-F391 AromaticContact CE1-CE1 3.76Å; Y385-F391 HydrophobicContact CE1-CE1 3.76Å; Y385-F391 AromaticContact CE1-CZ 3.76Å; Y385-F391 HydrophobicContact CE1-CZ 3.76Å; Y385-F391 AromaticContact CE2-CE1 3.88Å; Y385-F391 HydrophobicContact CE2-CE1 3.88Å; Y385-F391 AromaticContact CE2-CZ 3.83Å; Y385-F391 HydrophobicContact CE2-CZ 3.83Å; Y385-F391 AromaticContact CG-CZ 3.8Å; Y385-F391 HydrophobicContact CG-CZ 3.8Å; Y385-F391 AromaticContact CZ-CE1 3.51Å; Y385-F391 AromaticContact CZ-CZ 3.76Å; Y389-F391 AromaticContact CD1-CD1 3.8Å; Y389-F391 HydrophobicContact CD1-CD1 3.8Å; Y389-F391 AromaticContact CD1-CD2 3.81Å; Y389-F391 HydrophobicContact CD1-CD2 3.81Å; Y389-F391 AromaticContact CD1-CE1 3.53Å; Y389-F391 HydrophobicContact CD1-CE1 3.53Å; Y389-F391 AromaticContact CD1-CE2 3.54Å; Y389-F391 HydrophobicContact CD1-CE2 3.54Å; Y389-F391 AromaticContact CD1-CG 3.93Å; Y389-F391 HydrophobicContact CD1-CG 3.93Å; Y389-F391 AromaticContact CD1-CZ 3.39Å; Y389-F391 HydrophobicContact CD1-CZ 3.39Å; Y389-F391 AromaticContact CE1-CD1 3.66Å; Y389-F391 HydrophobicContact CE1-CD1 3.66Å; Y389-F391 HydrophobicContact CE1-CD2 4.47Å; Y389-F391 AromaticContact CE1-CE1 3.52Å; Y389-F391 HydrophobicContact CE1-CE1 3.52Å; Y389-F391 HydrophobicContact CE1-CE2 4.36Å; Y389-F391 HydrophobicContact CE1-CG 4.14Å; Y389-F391 AromaticContact CE1-CZ 3.9Å; Y389-F391 HydrophobicContact CE1-CZ 3.9Å; Y389-F391 HydrophobicContact CG-CE2 4.32Å; Y389-F391 HydrophobicContact CG-CZ 4.22Å; Y389-F391 WeakPolarHBondContact O-CD2 3.18Å; Y389-F391 PolarHBondContact O-N 2.97Å; F391-F443 AromaticContact CE2-CE2 3.74Å; F391-F443 HydrophobicContact CE2-CE2 3.74Å; F391-F443 AromaticContact CE2-CZ 3.7Å; F391-F443 HydrophobicContact CE2-CZ 3.7Å; F391-F443 AromaticContact CZ-CE2 3.71Å; F391-F443 HydrophobicContact CZ-CE2 3.71Å; F391-F443 HydrophobicContact CZ-CZ 4.12Å; F391-H495 AromaticContact CD2-CE1 3.83Å; F391-H495 AromaticContact CD2-NE2 3.89Å; F391-H495 AromaticContact CE2-CE1 3.78Å; F391-H495 AromaticContact CE2-NE2 3.99Å; F391-H495 AromaticContact CZ-CE1 3.94Å; F391-S497 VanDerWaalsContact CD1-OG 3.25Å; F391-S497 WeakPolarHBondContact CD1-OG 3.48Å; F391-S497 WeakPolarHBondContact CE1-OG 3.34Å
392	E	82.4	Confident	89.2	Confident	173 Å²	173	75.2 Å²	75.2	81%	0.808	39%	0.39	S	S	*	.	S	Bend	trans	-92.5	-44.1	-176.4	-62.3	-169.7	164.5	0	0	111.7	N390	N390-E392 VanDerWaalsContact C-N 3.32Å; N390-E392 PolarHBondContact O-N 3.14Å; N390-E392 PolarHBondContact OD1-N 2.96Å
393	N	84.4	Confident	89.1	Confident	121 Å²	121	78.6 Å²	78.6	65%	0.647	41%	0.406	S	S	*	.	S	Bend	trans	-128.6	80.6	-179.8	-61.9	-44.9	0	0	0	109.6	N390 G395	N390-N393 PolarHBondContact OD1-N 2.72Å; N393-G395 PolarHBondContact O-N 3.29Å
394	E	85.9	Confident	89.2	Confident	107 Å²	107	79 Å²	79	50%	0.5	41%	0.407	S	S	.	.			trans	-62.7	117.7	176.1	-65.5	171.8	-167	0	0	109.6	E398 K539	E394-E398 HydrophobicContact CB-CB 4.07Å; E394-E398 HydrophobicContact CB-CG 4.39Å; E394-E398 HydrophobicContact CG-CB 4.29Å; E394-E398 HydrophobicContact CG-CG 4.36Å; E394-K539 IonicContact OE1-NZ 3.94Å; E394-K539 PolarHBondContact OE1-NZ 3.48Å
395	G	88.9	Confident	89.2	Confident	39 Å²	39	77.7 Å²	77.7	40%	0.402	40%	0.398	S	S	.	.			trans	-108.6	-151.7	178.6	0	0	0	0	0	112.9	N393 E398 A399	N393-G395 PolarHBondContact O-N 3.29Å; G395-E398 WeakPolarHBondContact CA-OE2 3.31Å; G395-E398 PolarHBondContact N-OE2 3.18Å; G395-A399 WeakPolarHBondContact O-CB 3.15Å; G395-A399 PolarHBondContact O-N 2.93Å
396	E	89.8	Confident	89.3	Confident	156 Å²	156	82 Å²	82	73%	0.729	42%	0.417	S	S	*	.	H	α-helix	trans	-67.8	-45	179	-172.3	167.3	-167.9	0	0	111.5	E398 A399 M400	E396-E398 PolarHBondContact O-N 3.44Å; E396-A399 WeakPolarHBondContact O-CB 3.45Å; E396-A399 PolarHBondContact O-N 3.49Å; E396-A399 VanDerWaalsContact O-N 3.09Å; E396-M400 HydrophobicContact CG-CE 4.43Å; E396-M400 WeakPolarHBondContact O-CG 3.38Å; E396-M400 PolarHBondContact O-N 2.94Å
397	D	87.3	Confident	89.7	Confident	112 Å²	112	80.9 Å²	80.9	60%	0.599	41%	0.409	S	S	*	.	H	α-helix	trans	-60.6	-45.5	179.7	-58	-26.4	0	0	0	111.8	A399 M400 F401	D397-A399 VanDerWaalsContact C-N 3.28Å; D397-A399 PolarHBondContact O-N 3.31Å; D397-M400 HydrophobicContact CB-CE 4.47Å; D397-M400 PolarHBondContact O-N 3.41Å; D397-M400 VanDerWaalsContact OD1-CE 3.24Å; D397-M400 WeakPolarHBondContact OD1-CE 3.33Å; D397-F401 PolarHBondContact O-N 3.2Å
398	E	92.1	Very high	90.2	Very high	21 Å²	21	74.1 Å²	74.1	10%	0.098	38%	0.377	C	S	.	.	H	α-helix	trans	-62.8	-35.8	175.5	-72.9	73.9	-155	0	0	112.5	Y389 N390 E394 G395 E396 V402	Y389-E398 HydrophobicContact CD1-CG 4.23Å; Y389-E398 HydrophobicContact CD2-CB 4.47Å; Y389-E398 HydrophobicContact CD2-CG 3.86Å; Y389-E398 HydrophobicContact CE1-CG 3.88Å; Y389-E398 HydrophobicContact CE2-CB 3.66Å; Y389-E398 HydrophobicContact CE2-CG 3.47Å; Y389-E398 VanDerWaalsContact CE2-CG 3.47Å; Y389-E398 HydrophobicContact CG-CG 4.23Å; Y389-E398 VanDerWaalsContact CZ-CG 3.48Å; N390-E398 WeakPolarHBondContact CB-OE1 3.41Å; N390-E398 PolarHBondContact N-OE1 2.77Å; E394-E398 HydrophobicContact CB-CB 4.07Å; E394-E398 HydrophobicContact CB-CG 4.39Å; E394-E398 HydrophobicContact CG-CB 4.29Å; E394-E398 HydrophobicContact CG-CG 4.36Å; G395-E398 WeakPolarHBondContact CA-OE2 3.31Å; G395-E398 PolarHBondContact N-OE2 3.18Å; E396-E398 PolarHBondContact O-N 3.44Å; E398-V402 VanDerWaalsContact O-CG2 3.23Å; E398-V402 WeakPolarHBondContact O-CG2 3.36Å; E398-V402 PolarHBondContact O-N 3.38Å
399	A	90.9	Very high	90.6	Very high	61 Å²	61	68.2 Å²	68.2	50%	0.504	35%	0.349	S	S	.	.	H	α-helix	trans	-69.6	-40.9	176.5	0	0	0	0	0	111.6	G395 E396 D397 V402 E403	G395-A399 WeakPolarHBondContact O-CB 3.15Å; G395-A399 PolarHBondContact O-N 2.93Å; E396-A399 WeakPolarHBondContact O-CB 3.45Å; E396-A399 PolarHBondContact O-N 3.49Å; E396-A399 VanDerWaalsContact O-N 3.09Å; D397-A399 VanDerWaalsContact C-N 3.28Å; D397-A399 PolarHBondContact O-N 3.31Å; A399-V402 PolarHBondContact O-N 3.35Å; A399-E403 PolarHBondContact O-N 3.39Å
400	M	91.8	Very high	90.9	Very high	93 Å²	93	71.3 Å²	71.3	46%	0.458	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-46.6	174.2	-70.2	-166.9	-65.2	0	0	111	E396 D397 V402 E403 Y404	E396-M400 HydrophobicContact CG-CE 4.43Å; E396-M400 WeakPolarHBondContact O-CG 3.38Å; E396-M400 PolarHBondContact O-N 2.94Å; D397-M400 HydrophobicContact CB-CE 4.47Å; D397-M400 PolarHBondContact O-N 3.41Å; D397-M400 VanDerWaalsContact OD1-CE 3.24Å; D397-M400 WeakPolarHBondContact OD1-CE 3.33Å; M400-V402 VanDerWaalsContact C-N 3.33Å; M400-V402 PolarHBondContact O-N 3.27Å; M400-E403 WeakPolarHBondContact O-CB 3.4Å; M400-E403 PolarHBondContact O-N 3.03Å; M400-E403 VanDerWaalsContact O-N 3.1Å; M400-Y404 PolarHBondContact O-N 3.48Å
401	F	93.4	Very high	91.2	Very high	13 Å²	13	68.4 Å²	68.4	6%	0.057	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-38.8	176.2	-179.2	-108.7	0	0	0	112.8	D341 T384 Y385 Y389 D397 E403 Y404 R405	D341-F401 WeakPolarHBondContact OD2-CD2 3.44Å; T384-F401 WeakPolarHBondContact O-CZ 3.39Å; Y385-F401 HydrophobicContact CD1-CD1 4.11Å; Y385-F401 AromaticContact CD1-CE1 3.44Å; Y385-F401 HydrophobicContact CD1-CE1 3.44Å; Y385-F401 VanDerWaalsContact CD1-CE1 3.44Å; Y385-F401 HydrophobicContact CD1-CZ 4.3Å; Y385-F401 HydrophobicContact CE1-CD1 4.18Å; Y385-F401 AromaticContact CE1-CE1 3.75Å; Y385-F401 HydrophobicContact CE1-CE1 3.75Å; Y385-F401 HydrophobicContact CG-CE1 4.24Å; Y389-F401 AromaticContact CD2-CD1 3.79Å; Y389-F401 HydrophobicContact CD2-CD1 3.79Å; Y389-F401 HydrophobicContact CD2-CE1 4.34Å; Y389-F401 HydrophobicContact CD2-CG 4.39Å; Y389-F401 HydrophobicContact CE2-CB 4.29Å; Y389-F401 AromaticContact CE2-CD1 3.58Å; Y389-F401 HydrophobicContact CE2-CD1 3.58Å; Y389-F401 HydrophobicContact CE2-CE1 4.36Å; Y389-F401 HydrophobicContact CE2-CG 4.3Å; D397-F401 PolarHBondContact O-N 3.2Å; F401-E403 VanDerWaalsContact C-N 3.32Å; F401-E403 PolarHBondContact O-N 2.88Å; F401-Y404 HydrophobicContact CD2-CD1 4.19Å; F401-Y404 HydrophobicContact CE2-CD1 4.28Å; F401-Y404 PolarHBondContact O-N 3.1Å; F401-R405 HydrophobicContact CD1-CG 4.45Å; F401-R405 HydrophobicContact CE1-CG 4.01Å; F401-R405 HydrophobicContact CE2-CG 4.35Å; F401-R405 HydrophobicContact CZ-CG 3.94Å; F401-R405 VanDerWaalsContact CZ-NE 3.28Å; F401-R405 PolarHBondContact O-N 2.87Å
402	V	92.1	Very high	91.5	Very high	59 Å²	59	66.3 Å²	66.3	36%	0.358	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-37.9	175	168.8	0	0	0	0	111.3	E398 A399 M400 K406	E398-V402 VanDerWaalsContact O-CG2 3.23Å; E398-V402 WeakPolarHBondContact O-CG2 3.36Å; E398-V402 PolarHBondContact O-N 3.38Å; A399-V402 PolarHBondContact O-N 3.35Å; M400-V402 VanDerWaalsContact C-N 3.33Å; M400-V402 PolarHBondContact O-N 3.27Å; V402-K406 WeakPolarHBondContact O-CG 3.15Å; V402-K406 PolarHBondContact O-N 2.89Å
403	E	93.3	Very high	92	Very high	91 Å²	91	59.7 Å²	59.7	43%	0.425	31%	0.312	S	S	.	.	H	α-helix	trans	-67.8	-43.7	174.2	-168	57.6	-144.8	0	0	111.6	A399 M400 F401 R405 K406 Q407	A399-E403 PolarHBondContact O-N 3.39Å; M400-E403 WeakPolarHBondContact O-CB 3.4Å; M400-E403 PolarHBondContact O-N 3.03Å; M400-E403 VanDerWaalsContact O-N 3.1Å; F401-E403 VanDerWaalsContact C-N 3.32Å; F401-E403 PolarHBondContact O-N 2.88Å; E403-R405 VanDerWaalsContact C-N 3.33Å; E403-R405 PolarHBondContact O-N 3.45Å; E403-K406 WeakPolarHBondContact O-CA 3.45Å; E403-K406 VanDerWaalsContact O-CB 3.32Å; E403-K406 WeakPolarHBondContact O-CB 3.49Å; E403-K406 PolarHBondContact O-N 3.28Å; E403-K406 WeakPolarHBondContact OE2-CD 3.3Å; E403-K406 IonicContact OE2-NZ 3.62Å; E403-K406 PolarHBondContact OE2-NZ 3.01Å; E403-Q407 PolarHBondContact O-N 2.84Å; E403-Q407 VanDerWaalsContact O-N 3.12Å
404	Y	95.2	Very high	92.3	Very high	10 Å²	10	56.1 Å²	56.1	4%	0.039	29%	0.29	C	S	.	.	H	α-helix	trans	-56.5	-45	173.6	174.5	-118.4	0	0	0	111.8	D341 S344 I348 K382 M400 F401 K406 Q407 L408	D341-Y404 HydrophobicContact CB-CD1 4.17Å; D341-Y404 HydrophobicContact CB-CE1 4.13Å; D341-Y404 VanDerWaalsContact OD1-CE1 3.3Å; D341-Y404 WeakPolarHBondContact OD1-CE1 3.39Å; D341-Y404 WeakPolarHBondContact OD2-CD1 3.47Å; D341-Y404 WeakPolarHBondContact OD2-CE1 3.23Å; S344-Y404 VanDerWaalsContact CB-OH 3.29Å; S344-Y404 WeakPolarHBondContact CB-OH 3.46Å; S344-Y404 PolarHBondContact OG-OH 3.24Å; I348-Y404 HydrophobicContact CD1-CD2 4.08Å; I348-Y404 HydrophobicContact CD1-CE2 3.73Å; K382-Y404 HydrophobicContact CB-CE1 4.43Å; K382-Y404 WeakPolarHBondContact CB-OH 3.29Å; K382-Y404 WeakPolarHBondContact CD-OH 3.31Å; K382-Y404 WeakPolarHBondContact CG-OH 3.36Å; M400-Y404 PolarHBondContact O-N 3.48Å; F401-Y404 HydrophobicContact CD2-CD1 4.19Å; F401-Y404 HydrophobicContact CE2-CD1 4.28Å; F401-Y404 PolarHBondContact O-N 3.1Å; Y404-K406 VanDerWaalsContact C-N 3.27Å; Y404-K406 PolarHBondContact O-N 3Å; Y404-Q407 WeakPolarHBondContact O-CA 3.35Å; Y404-Q407 WeakPolarHBondContact O-CB 3.48Å; Y404-Q407 PolarHBondContact O-N 3.21Å; Y404-L408 HydrophobicContact CD1-CD1 4.08Å; Y404-L408 HydrophobicContact CE1-CD1 3.56Å; Y404-L408 HydrophobicContact CE1-CG 4.15Å; Y404-L408 HydrophobicContact CE2-CD1 4.46Å; Y404-L408 HydrophobicContact CE2-CD2 4.19Å; Y404-L408 HydrophobicContact CE2-CG 4.17Å; Y404-L408 PolarHBondContact O-N 3.38Å
405	R	94.8	Very high	92.6	Very high	15 Å²	15	51 Å²	51	6%	0.057	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-32.5	173.4	-81	-179.5	152.1	-179.5	-6.5	113.6	L383 Y385 F401 E403 Q407 L408 K409 E447 R451	L383-R405 HydrophobicContact CD2-CB 4.45Å; L383-R405 HydrophobicContact CD2-CG 4.17Å; L383-R405 PolarHBondContact O-NE 2.94Å; L383-R405 PolarHBondContact O-NH2 3.4Å; Y385-R405 PolarHBondContact OH-NH1 3.26Å; F401-R405 HydrophobicContact CD1-CG 4.45Å; F401-R405 HydrophobicContact CE1-CG 4.01Å; F401-R405 HydrophobicContact CE2-CG 4.35Å; F401-R405 HydrophobicContact CZ-CG 3.94Å; F401-R405 VanDerWaalsContact CZ-NE 3.28Å; F401-R405 PolarHBondContact O-N 2.87Å; E403-R405 VanDerWaalsContact C-N 3.33Å; E403-R405 PolarHBondContact O-N 3.45Å; R405-Q407 VanDerWaalsContact C-N 3.35Å; R405-L408 PolarHBondContact O-N 3.32Å; R405-K409 WeakPolarHBondContact O-CB 3.31Å; R405-K409 PolarHBondContact O-N 3.25Å; R405-E447 IonicContact NH2-OE2 2.64Å; R405-E447 PolarHBondContact NH2-OE2 3.12Å; R405-E447 VanDerWaalsContact NH2-OE2 3.15Å; R405-R451 VanDerWaalsContact CZ-NH1 3.33Å
406	K	94.7	Very high	92.6	Very high	111 Å²	111	49.2 Å²	49.2	48%	0.483	25%	0.247	S	C	.	.	H	α-helix	trans	-66.2	-39.9	172.6	-67	175.9	-158.1	156	0	110.9	V402 E403 Y404 K409 L410	V402-K406 WeakPolarHBondContact O-CG 3.15Å; V402-K406 PolarHBondContact O-N 2.89Å; E403-K406 WeakPolarHBondContact O-CA 3.45Å; E403-K406 VanDerWaalsContact O-CB 3.32Å; E403-K406 WeakPolarHBondContact O-CB 3.49Å; E403-K406 PolarHBondContact O-N 3.28Å; E403-K406 WeakPolarHBondContact OE2-CD 3.3Å; E403-K406 IonicContact OE2-NZ 3.62Å; E403-K406 PolarHBondContact OE2-NZ 3.01Å; Y404-K406 VanDerWaalsContact C-N 3.27Å; Y404-K406 PolarHBondContact O-N 3Å; K406-K409 WeakPolarHBondContact O-CB 3.45Å; K406-K409 PolarHBondContact O-N 3.34Å; K406-L410 WeakPolarHBondContact O-CG 3.48Å; K406-L410 PolarHBondContact O-N 3.2Å; K406-L410 VanDerWaalsContact O-N 3.08Å
407	Q	95.1	Very high	92.6	Very high	59 Å²	59	45.8 Å²	45.8	28%	0.276	23%	0.231	S	C	.	.	H	α-helix	trans	-64.6	-43.2	175.6	-59.2	-176.5	4.5	0	0	111.8	S345 I348 E403 Y404 R405 K409 L410 L411	S345-Q407 PolarHBondContact OG-OE1 2.98Å; I348-Q407 HydrophobicContact CD1-CB 3.7Å; I348-Q407 HydrophobicContact CG2-CB 4.36Å; E403-Q407 PolarHBondContact O-N 2.84Å; E403-Q407 VanDerWaalsContact O-N 3.12Å; Y404-Q407 WeakPolarHBondContact O-CA 3.35Å; Y404-Q407 WeakPolarHBondContact O-CB 3.48Å; Y404-Q407 PolarHBondContact O-N 3.21Å; R405-Q407 VanDerWaalsContact C-N 3.35Å; Q407-K409 VanDerWaalsContact C-N 3.32Å; Q407-K409 PolarHBondContact O-N 3.39Å; Q407-L410 WeakPolarHBondContact O-CB 3.23Å; Q407-L410 PolarHBondContact O-N 3.43Å; Q407-L410 VanDerWaalsContact O-N 3.1Å; Q407-L411 PolarHBondContact O-N 3.24Å
408	L	95.6	Very high	92.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-39.2	173.2	-68.7	179.3	0	0	0	112.6	I348 V379 K382 L383 Y404 R405 L410 L411 L412	I348-L408 HydrophobicContact CD1-CD2 4.02Å; I348-L408 HydrophobicContact CD1-CG 4.5Å; V379-L408 HydrophobicContact CG1-CB 4.26Å; V379-L408 HydrophobicContact CG2-CD2 4.39Å; K382-L408 HydrophobicContact CB-CD1 3.71Å; K382-L408 HydrophobicContact CB-CD2 4.24Å; K382-L408 WeakPolarHBondContact O-CD1 3.42Å; L383-L408 HydrophobicContact CD2-CB 3.97Å; L383-L408 HydrophobicContact CD2-CD1 4.1Å; L383-L408 HydrophobicContact CG-CB 4.36Å; L383-L408 HydrophobicContact CG-CD1 4.14Å; Y404-L408 HydrophobicContact CD1-CD1 4.08Å; Y404-L408 HydrophobicContact CE1-CD1 3.56Å; Y404-L408 HydrophobicContact CE1-CG 4.15Å; Y404-L408 HydrophobicContact CE2-CD1 4.46Å; Y404-L408 HydrophobicContact CE2-CD2 4.19Å; Y404-L408 HydrophobicContact CE2-CG 4.17Å; Y404-L408 PolarHBondContact O-N 3.38Å; R405-L408 PolarHBondContact O-N 3.32Å; L408-L410 VanDerWaalsContact C-N 3.31Å; L408-L410 PolarHBondContact O-N 2.73Å; L408-L411 HydrophobicContact CD2-CD1 4.44Å; L408-L411 WeakPolarHBondContact O-CB 3.47Å; L408-L411 PolarHBondContact O-N 3.16Å; L408-L412 PolarHBondContact O-N 2.94Å
409	K	93.4	Very high	92.5	Very high	60 Å²	60	42 Å²	42	26%	0.261	22%	0.215	S	C	.	.	H	α-helix	trans	-60	-41.3	173.2	-177.9	-169.3	174.1	-161.1	0	111.4	R405 K406 Q407 L411 L412 D413 M455 E458	R405-K409 WeakPolarHBondContact O-CB 3.31Å; R405-K409 PolarHBondContact O-N 3.25Å; K406-K409 WeakPolarHBondContact O-CB 3.45Å; K406-K409 PolarHBondContact O-N 3.34Å; Q407-K409 VanDerWaalsContact C-N 3.32Å; Q407-K409 PolarHBondContact O-N 3.39Å; K409-L411 VanDerWaalsContact C-N 3.27Å; K409-L411 PolarHBondContact O-N 3.48Å; K409-L412 WeakPolarHBondContact O-CB 3.48Å; K409-L412 PolarHBondContact O-N 3.13Å; K409-L412 VanDerWaalsContact O-N 3.08Å; K409-D413 PolarHBondContact O-N 3.15Å; K409-M455 HydrophobicContact CB-SD 4.23Å; K409-M455 HydrophobicContact CD-SD 4.42Å; K409-M455 HydrophobicContact CG-SD 3.9Å; K409-E458 WeakPolarHBondContact CE-OE2 3.32Å; K409-E458 IonicContact NZ-OE2 3.64Å; K409-E458 PolarHBondContact NZ-OE2 3.05Å
410	L	93.7	Very high	92.3	Very high	92 Å²	92	40.2 Å²	40.2	48%	0.482	20%	0.198	S	C	.	.	H	α-helix	trans	-60.5	-37.9	176.1	-66.5	172.6	0	0	0	111.9	Y352 K406 Q407 L408 D413 R414	Y352-L410 HydrophobicContact CE2-CB 4.26Å; K406-L410 WeakPolarHBondContact O-CG 3.48Å; K406-L410 PolarHBondContact O-N 3.2Å; K406-L410 VanDerWaalsContact O-N 3.08Å; Q407-L410 WeakPolarHBondContact O-CB 3.23Å; Q407-L410 PolarHBondContact O-N 3.43Å; Q407-L410 VanDerWaalsContact O-N 3.1Å; L408-L410 VanDerWaalsContact C-N 3.31Å; L408-L410 PolarHBondContact O-N 2.73Å; L410-D413 PolarHBondContact O-N 2.72Å; L410-R414 WeakPolarHBondContact O-CG 3.48Å; L410-R414 PolarHBondContact O-N 2.7Å
411	L	94.2	Very high	91.9	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-43.9	171.8	-69.5	178.8	0	0	0	111.7	L336 I348 C351 Y352 L355 V379 Q407 L408 K409 D413 R414 L415	L336-L411 HydrophobicContact CD1-CD1 4.5Å; I348-L411 HydrophobicContact CB-CD1 4.36Å; I348-L411 HydrophobicContact CD1-CD1 4.49Å; I348-L411 HydrophobicContact CG1-CD1 3.99Å; I348-L411 HydrophobicContact CG2-CD1 3.93Å; I348-L411 HydrophobicContact CG2-CD2 4.16Å; I348-L411 HydrophobicContact CG2-CG 3.94Å; C351-L411 HydrophobicContact CB-CD1 4.21Å; C351-L411 HydrophobicContact CB-CD2 3.79Å; Y352-L411 HydrophobicContact CD2-CD2 4.2Å; Y352-L411 HydrophobicContact CG-CD2 4.45Å; L355-L411 HydrophobicContact CD1-CD2 4.34Å; V379-L411 HydrophobicContact CG2-CB 4.01Å; V379-L411 HydrophobicContact CG2-CD1 3.9Å; Q407-L411 PolarHBondContact O-N 3.24Å; L408-L411 HydrophobicContact CD2-CD1 4.44Å; L408-L411 WeakPolarHBondContact O-CB 3.47Å; L408-L411 PolarHBondContact O-N 3.16Å; K409-L411 VanDerWaalsContact C-N 3.27Å; K409-L411 PolarHBondContact O-N 3.48Å; L411-D413 VanDerWaalsContact C-N 3.34Å; L411-D413 PolarHBondContact O-N 3.12Å; L411-R414 WeakPolarHBondContact O-CB 3.32Å; L411-R414 PolarHBondContact O-N 2.98Å; L411-R414 VanDerWaalsContact O-N 3.16Å; L411-L415 WeakPolarHBondContact O-CG 3.38Å; L411-L415 PolarHBondContact O-N 3.25Å
412	L	92.9	Very high	91.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-42.9	176.8	-161.9	73.7	0	0	0	112.2	V379 L408 K409 R414 L415 A416 L423 L452 M455	V379-L412 HydrophobicContact CG1-CB 4.44Å; V379-L412 HydrophobicContact CG1-CD1 4.3Å; L408-L412 PolarHBondContact O-N 2.94Å; K409-L412 WeakPolarHBondContact O-CB 3.48Å; K409-L412 PolarHBondContact O-N 3.13Å; K409-L412 VanDerWaalsContact O-N 3.08Å; L412-R414 VanDerWaalsContact C-N 3.29Å; L412-R414 PolarHBondContact O-N 3.37Å; L412-L415 HydrophobicContact CD1-CD1 4.41Å; L412-L415 WeakPolarHBondContact O-CB 3.47Å; L412-L415 PolarHBondContact O-N 3.31Å; L412-A416 PolarHBondContact O-N 3.06Å; L412-L423 HydrophobicContact CD1-CD1 3.59Å; L412-L423 HydrophobicContact CG-CD1 4.27Å; L412-L452 HydrophobicContact CD2-CD2 4.21Å; L412-M455 HydrophobicContact CD2-CB 4.02Å; L412-M455 HydrophobicContact CD2-CE 3.46Å; L412-M455 VanDerWaalsContact CD2-CE 3.46Å; L412-M455 HydrophobicContact CD2-SD 4.04Å
413	D	91.8	Very high	91.4	Very high	34 Å²	34	41.6 Å²	41.6	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-34.9	176.3	-71.2	-22.7	0	0	0	111.5	K409 L410 L411 Q417 A459	K409-D413 PolarHBondContact O-N 3.15Å; L410-D413 PolarHBondContact O-N 2.72Å; L411-D413 VanDerWaalsContact C-N 3.34Å; L411-D413 PolarHBondContact O-N 3.12Å; D413-Q417 WeakPolarHBondContact O-CG 3.49Å; D413-Q417 PolarHBondContact O-N 2.84Å; D413-Q417 PolarHBondContact O-NE2 2.91Å; D413-A459 WeakPolarHBondContact OD1-CB 3.4Å
414	R	91.9	Very high	91.2	Very high	46 Å²	46	38.7 Å²	38.7	17%	0.174	19%	0.188	C	C	.	.	H	α-helix	trans	-69.1	-43.9	171.4	-75.1	-57.6	-143.6	-146.9	1.4	112.4	Y352 L355 L410 L411 L412 A416 Q417 V418	Y352-R414 HydrophobicContact CD2-CB 4.47Å; Y352-R414 HydrophobicContact CD2-CG 3.44Å; Y352-R414 VanDerWaalsContact CD2-CG 3.44Å; Y352-R414 HydrophobicContact CE2-CB 4.48Å; Y352-R414 HydrophobicContact CE2-CG 3.15Å; Y352-R414 HydrophobicContact CG-CG 4.27Å; Y352-R414 VanDerWaalsContact CZ-NH2 3.31Å; Y352-R414 PolarHBondContact OH-NE 2.92Å; Y352-R414 PolarHBondContact OH-NH2 3.49Å; L355-R414 HydrophobicContact CB-CB 4.25Å; L355-R414 HydrophobicContact CD1-CB 4.05Å; L410-R414 WeakPolarHBondContact O-CG 3.48Å; L410-R414 PolarHBondContact O-N 2.7Å; L411-R414 WeakPolarHBondContact O-CB 3.32Å; L411-R414 PolarHBondContact O-N 2.98Å; L411-R414 VanDerWaalsContact O-N 3.16Å; L412-R414 VanDerWaalsContact C-N 3.29Å; L412-R414 PolarHBondContact O-N 3.37Å; R414-A416 PolarHBondContact O-N 2.85Å; R414-Q417 WeakPolarHBondContact O-CA 3.47Å; R414-Q417 WeakPolarHBondContact O-CB 3.41Å; R414-Q417 PolarHBondContact O-N 3.41Å; R414-V418 WeakPolarHBondContact O-CG2 3.36Å; R414-V418 PolarHBondContact O-N 3.42Å; R414-V418 VanDerWaalsContact O-N 3.09Å
415	L	92.3	Very high	90.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-56.9	-41.5	175.4	-73.1	165.8	0	0	0	110.9	L355 V372 I375 M376 L411 L412 Q417 V418 S419	L355-L415 HydrophobicContact CD1-CD2 3.76Å; L355-L415 HydrophobicContact CD1-CG 3.75Å; L355-L415 HydrophobicContact CD2-CD2 3.59Å; L355-L415 HydrophobicContact CD2-CG 4.45Å; L355-L415 HydrophobicContact CG-CD2 4.34Å; V372-L415 HydrophobicContact CG1-CD2 3.77Å; I375-L415 HydrophobicContact CB-CD2 4.47Å; I375-L415 HydrophobicContact CG2-CD1 4.34Å; I375-L415 HydrophobicContact CG2-CD2 4.3Å; M376-L415 HydrophobicContact CB-CD1 3.85Å; M376-L415 HydrophobicContact CB-CD2 4.39Å; M376-L415 HydrophobicContact CG-CD1 4.21Å; L411-L415 WeakPolarHBondContact O-CG 3.38Å; L411-L415 PolarHBondContact O-N 3.25Å; L412-L415 HydrophobicContact CD1-CD1 4.41Å; L412-L415 WeakPolarHBondContact O-CB 3.47Å; L412-L415 PolarHBondContact O-N 3.31Å; L415-Q417 PolarHBondContact O-N 3.05Å; L415-V418 PolarHBondContact O-N 2.68Å; L415-V418 VanDerWaalsContact O-N 3.14Å; L415-S419 PolarHBondContact O-N 2.83Å
416	A	88.7	Confident	90.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.9	-31.5	175.5	0	0	0	0	0	113.1	L412 R414 P420 L423 A459	L412-A416 PolarHBondContact O-N 3.06Å; R414-A416 PolarHBondContact O-N 2.85Å; A416-P420 WeakPolarHBondContact O-CA 3.49Å; A416-P420 WeakPolarHBondContact O-CB 3.46Å; A416-P420 VanDerWaalsContact O-CD 3.26Å; A416-P420 WeakPolarHBondContact O-CD 3.29Å; A416-P420 WeakPolarHBondContact O-CG 3.35Å; A416-L423 HydrophobicContact CB-CD2 3.43Å; A416-L423 VanDerWaalsContact CB-CD2 3.43Å; A416-A459 HydrophobicContact CB-CB 3.7Å; A416-A459 WeakPolarHBondContact CB-O 3.23Å
417	Q	88.6	Confident	90.6	Very high	84 Å²	84	35.1 Å²	35.1	39%	0.393	18%	0.184	S	C	.	.	H	α-helix	trans	-78.9	-27.9	176.6	-66.6	170.4	33	0	0	113	K359 D413 R414 L415	K359-Q417 HydrophobicContact CD-CB 4.11Å; D413-Q417 WeakPolarHBondContact O-CG 3.49Å; D413-Q417 PolarHBondContact O-N 2.84Å; D413-Q417 PolarHBondContact O-NE2 2.91Å; R414-Q417 WeakPolarHBondContact O-CA 3.47Å; R414-Q417 WeakPolarHBondContact O-CB 3.41Å; R414-Q417 PolarHBondContact O-N 3.41Å; L415-Q417 PolarHBondContact O-N 3.05Å
418	V	90.1	Very high	90.4	Very high	23 Å²	23	37.1 Å²	37.1	14%	0.139	19%	0.189	C	C	.	.	H	α-helix	trans	-83.5	-49.1	179.6	177.6	0	0	0	0	110.9	L355 L358 K359 L364 V372 R414 L415	L355-V418 HydrophobicContact CB-CG2 4.3Å; L355-V418 VanDerWaalsContact O-CG2 3.22Å; L355-V418 WeakPolarHBondContact O-CG2 3.38Å; L358-V418 HydrophobicContact CB-CG1 4.06Å; K359-V418 HydrophobicContact CB-CG2 3.97Å; L364-V418 HydrophobicContact CD1-CG1 3.87Å; V372-V418 HydrophobicContact CG2-CG1 4.1Å; R414-V418 WeakPolarHBondContact O-CG2 3.36Å; R414-V418 PolarHBondContact O-N 3.42Å; R414-V418 VanDerWaalsContact O-N 3.09Å; L415-V418 PolarHBondContact O-N 2.68Å; L415-V418 VanDerWaalsContact O-N 3.14Å
419	S	87.7	Confident	90.2	Very high	32 Å²	32	43.5 Å²	43.5	22%	0.224	21%	0.213	C	C	.	.			trans	-143.6	80.6	-179.3	-163.2	0	0	0	0	111.7	L415 E421 L422 L423	L415-S419 PolarHBondContact O-N 2.83Å; S419-E421 VanDerWaalsContact C-N 3.3Å; S419-E421 PolarHBondContact O-N 3.02Å; S419-L422 PolarHBondContact O-N 3.34Å; S419-L422 VanDerWaalsContact OG-CB 3.28Å; S419-L422 WeakPolarHBondContact OG-CB 3.19Å; S419-L423 PolarHBondContact O-N 3.26Å; S419-L423 VanDerWaalsContact O-N 3.14Å
420	P	86.1	Confident	90.2	Very high	23 Å²	23	42.6 Å²	42.6	15%	0.149	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-37.7	-179.4	-7.1	10	0	0	0	113.2	A416 L423 L424 L460 H464	A416-P420 WeakPolarHBondContact O-CA 3.49Å; A416-P420 WeakPolarHBondContact O-CB 3.46Å; A416-P420 VanDerWaalsContact O-CD 3.26Å; A416-P420 WeakPolarHBondContact O-CD 3.29Å; A416-P420 WeakPolarHBondContact O-CG 3.35Å; P420-L423 PolarHBondContact O-N 2.89Å; P420-L424 WeakPolarHBondContact O-CB 3.22Å; P420-L424 PolarHBondContact O-N 3.05Å; P420-L460 HydrophobicContact CB-CD2 3.79Å; P420-H464 HydrophobicContact CB-CB 4.47Å
421	E	84.9	Confident	90.2	Very high	151 Å²	151	38.3 Å²	38.3	71%	0.706	19%	0.19	S	C	*	.	H	α-helix	trans	-67.7	-44.1	-177.9	-65.3	-179	178.5	0	0	112.2	S419 L424 A425	S419-E421 VanDerWaalsContact C-N 3.3Å; S419-E421 PolarHBondContact O-N 3.02Å; E421-L424 PolarHBondContact O-N 3.49Å; E421-A425 WeakPolarHBondContact O-CB 3.48Å; E421-A425 PolarHBondContact O-N 3.47Å
422	L	86.4	Confident	90.2	Very high	42 Å²	42	39.9 Å²	39.9	22%	0.22	20%	0.201	C	C	.	.	H	α-helix	trans	-63.6	-43.6	176.4	-179.2	63.4	0	0	0	110.7	V372 E373 M376 S419 L424 A425 S426	V372-L422 HydrophobicContact CG1-CD2 4.11Å; E373-L422 HydrophobicContact CB-CD2 4.07Å; M376-L422 HydrophobicContact CE-CB 4.24Å; M376-L422 HydrophobicContact CE-CD2 3.87Å; M376-L422 HydrophobicContact CE-CG 3.76Å; M376-L422 HydrophobicContact SD-CG 4.38Å; S419-L422 PolarHBondContact O-N 3.34Å; S419-L422 VanDerWaalsContact OG-CB 3.28Å; S419-L422 WeakPolarHBondContact OG-CB 3.19Å; L422-L424 PolarHBondContact O-N 2.93Å; L422-A425 PolarHBondContact O-N 3.47Å; L422-S426 WeakPolarHBondContact O-CB 3.48Å; L422-S426 PolarHBondContact O-N 3.34Å; L422-S426 PolarHBondContact O-OG 2.85Å; L422-S426 VanDerWaalsContact O-OG 3.13Å
423	L	88.6	Confident	90.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.5	-48.7	177	179.6	64.5	0	0	0	111.7	M376 M380 L412 A416 S419 P420 A425 S426 V427 L456	M376-L423 HydrophobicContact CE-CB 4.02Å; M376-L423 HydrophobicContact CE-CD1 4.27Å; M376-L423 HydrophobicContact CG-CD1 4.04Å; M376-L423 HydrophobicContact SD-CB 4.27Å; M376-L423 HydrophobicContact SD-CD1 3.82Å; M380-L423 HydrophobicContact CE-CD1 3.92Å; L412-L423 HydrophobicContact CD1-CD1 3.59Å; L412-L423 HydrophobicContact CG-CD1 4.27Å; A416-L423 HydrophobicContact CB-CD2 3.43Å; A416-L423 VanDerWaalsContact CB-CD2 3.43Å; S419-L423 PolarHBondContact O-N 3.26Å; S419-L423 VanDerWaalsContact O-N 3.14Å; P420-L423 PolarHBondContact O-N 2.89Å; L423-A425 VanDerWaalsContact C-N 3.33Å; L423-A425 PolarHBondContact O-N 2.96Å; L423-S426 PolarHBondContact O-N 3.29Å; L423-V427 HydrophobicContact CD1-CG2 4Å; L423-V427 HydrophobicContact CG-CG2 4.42Å; L423-V427 WeakPolarHBondContact O-CB 3.48Å; L423-V427 WeakPolarHBondContact O-CG2 3.45Å; L423-V427 PolarHBondContact O-N 2.83Å; L423-L456 HydrophobicContact CD2-CD2 4.02Å; L423-L456 HydrophobicContact CG-CD2 4.02Å
424	L	88.9	Confident	90.4	Very high	30 Å²	30	42.4 Å²	42.4	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-41.9	178.7	-179.3	59.8	0	0	0	111.9	P420 E421 L422 R428 L456 L460 A477 M481	P420-L424 WeakPolarHBondContact O-CB 3.22Å; P420-L424 PolarHBondContact O-N 3.05Å; E421-L424 PolarHBondContact O-N 3.49Å; L422-L424 PolarHBondContact O-N 2.93Å; L424-R428 WeakPolarHBondContact O-CB 3.5Å; L424-R428 PolarHBondContact O-N 3.31Å; L424-L456 HydrophobicContact CD1-CD1 4Å; L424-L460 HydrophobicContact CB-CD1 4.43Å; L424-L460 HydrophobicContact CD1-CD1 4.03Å; L424-A477 HydrophobicContact CD1-CB 4.07Å; L424-A477 HydrophobicContact CD2-CB 4.02Å; L424-A477 HydrophobicContact CG-CB 4.02Å; L424-M481 HydrophobicContact CD1-CE 3.82Å
425	A	89.2	Confident	90.5	Very high	58 Å²	58	40.5 Å²	40.5	48%	0.479	21%	0.214	S	C	.	.	H	α-helix	trans	-65.4	-44.7	177.6	0	0	0	0	0	112.2	E421 L422 L423 R428 R429	E421-A425 WeakPolarHBondContact O-CB 3.48Å; E421-A425 PolarHBondContact O-N 3.47Å; L422-A425 PolarHBondContact O-N 3.47Å; L423-A425 VanDerWaalsContact C-N 3.33Å; L423-A425 PolarHBondContact O-N 2.96Å; A425-R428 PolarHBondContact O-N 3.19Å; A425-R429 WeakPolarHBondContact O-CB 3.14Å; A425-R429 PolarHBondContact O-N 3.02Å
426	S	90.3	Very high	90.5	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-47.3	178.7	-68.9	0	0	0	0	112.1	M376 L422 L423 R428 R429 V430	M376-S426 VanDerWaalsContact SD-CB 3.52Å; L422-S426 WeakPolarHBondContact O-CB 3.48Å; L422-S426 PolarHBondContact O-N 3.34Å; L422-S426 PolarHBondContact O-OG 2.85Å; L422-S426 VanDerWaalsContact O-OG 3.13Å; L423-S426 PolarHBondContact O-N 3.29Å; S426-R428 VanDerWaalsContact C-N 3.34Å; S426-R428 PolarHBondContact O-N 3.19Å; S426-R429 WeakPolarHBondContact O-CB 3.35Å; S426-R429 PolarHBondContact O-N 3.32Å; S426-V430 WeakPolarHBondContact O-CG2 3.38Å; S426-V430 PolarHBondContact O-N 3.05Å
427	V	91.6	Very high	90.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-44.2	175.4	173.4	0	0	0	0	110.4	M380 L423 R429 V430 F431 L452 L456 M481	M380-V427 HydrophobicContact CE-CB 4.39Å; M380-V427 HydrophobicContact CE-CG2 3.38Å; L423-V427 HydrophobicContact CD1-CG2 4Å; L423-V427 HydrophobicContact CG-CG2 4.42Å; L423-V427 WeakPolarHBondContact O-CB 3.48Å; L423-V427 WeakPolarHBondContact O-CG2 3.45Å; L423-V427 PolarHBondContact O-N 2.83Å; V427-R429 VanDerWaalsContact C-N 3.29Å; V427-R429 PolarHBondContact O-N 2.96Å; V427-V430 PolarHBondContact O-N 3.07Å; V427-F431 WeakPolarHBondContact O-CB 3.36Å; V427-F431 PolarHBondContact O-N 3.26Å; V427-L452 HydrophobicContact CG1-CB 3.82Å; V427-L452 HydrophobicContact CG2-CB 4.24Å; V427-L456 HydrophobicContact CB-CD1 3.93Å; V427-L456 HydrophobicContact CB-CG 4.44Å; V427-L456 HydrophobicContact CG1-CD1 3.56Å; V427-L456 HydrophobicContact CG1-CG 4.13Å; V427-L456 HydrophobicContact CG2-CD1 4.33Å; V427-L456 HydrophobicContact CG2-CD2 4.08Å; V427-L456 HydrophobicContact CG2-CG 4.31Å; V427-M481 HydrophobicContact CG1-SD 4.37Å
428	R	91.7	Very high	91	Very high	101 Å²	101	48.8 Å²	48.8	38%	0.381	25%	0.254	S	S	.	.	H	α-helix	trans	-58	-42.3	176.8	-176.1	-172.3	-176.7	156.8	11.4	111.9	L424 A425 S426 S432 D480 M481	L424-R428 WeakPolarHBondContact O-CB 3.5Å; L424-R428 PolarHBondContact O-N 3.31Å; A425-R428 PolarHBondContact O-N 3.19Å; S426-R428 VanDerWaalsContact C-N 3.34Å; S426-R428 PolarHBondContact O-N 3.19Å; R428-S432 WeakPolarHBondContact O-CB 3.41Å; R428-S432 PolarHBondContact O-N 3.43Å; R428-S432 PolarHBondContact O-OG 2.97Å; R428-D480 IonicContact CZ-OD2 3.93Å; R428-D480 IonicContact NH1-OD2 2.91Å; R428-D480 IonicContact NH2-OD2 2.62Å; R428-D480 PolarHBondContact NH2-OD2 3Å; R428-M481 VanDerWaalsContact CA-SD 3.58Å; R428-M481 HydrophobicContact CB-SD 3.97Å; R428-M481 HydrophobicContact CG-CG 4.29Å; R428-M481 HydrophobicContact CG-SD 4.28Å
429	R	92	Very high	91.1	Very high	134 Å²	134	53.6 Å²	53.6	51%	0.506	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-51.9	178.5	-179.8	176.9	64.5	-165.9	-3.6	111.1	E373 A425 S426 V427 S433	E373-R429 IonicContact OE1-NH2 3.54Å; A425-R429 WeakPolarHBondContact O-CB 3.14Å; A425-R429 PolarHBondContact O-N 3.02Å; S426-R429 WeakPolarHBondContact O-CB 3.35Å; S426-R429 PolarHBondContact O-N 3.32Å; V427-R429 VanDerWaalsContact C-N 3.29Å; V427-R429 PolarHBondContact O-N 2.96Å; R429-S433 WeakPolarHBondContact O-CB 3.23Å; R429-S433 PolarHBondContact O-N 3.21Å; R429-S433 VanDerWaalsContact O-N 3.08Å
430	V	92.6	Very high	91.3	Very high	42 Å²	42	57.8 Å²	57.8	26%	0.255	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-52.7	178.4	174.9	0	0	0	0	110	M380 S426 V427 S432 S433 T434 L452	M380-V430 HydrophobicContact SD-CG2 4.16Å; S426-V430 WeakPolarHBondContact O-CG2 3.38Å; S426-V430 PolarHBondContact O-N 3.05Å; V427-V430 PolarHBondContact O-N 3.07Å; V430-S432 PolarHBondContact O-N 2.69Å; V430-S433 PolarHBondContact O-N 3.28Å; V430-T434 WeakPolarHBondContact O-CB 3.3Å; V430-T434 PolarHBondContact O-N 3.26Å; V430-T434 PolarHBondContact O-OG1 2.89Å; V430-L452 HydrophobicContact CG1-CD1 4.14Å
431	F	94.6	Very high	91.7	Very high	1 Å²	1	57.8 Å²	57.8	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-56.5	-50.1	-179.9	-179.2	-92.9	0	0	0	112.5	V427 S433 T434 L435 A449 L453 M481 T484 L485	V427-F431 WeakPolarHBondContact O-CB 3.36Å; V427-F431 PolarHBondContact O-N 3.26Å; F431-S433 PolarHBondContact O-N 2.95Å; F431-T434 PolarHBondContact O-N 2.84Å; F431-L435 HydrophobicContact CD2-CD2 3.75Å; F431-L435 HydrophobicContact CD2-CG 4.35Å; F431-L435 HydrophobicContact CE1-CD2 4.49Å; F431-L435 HydrophobicContact CE1-CG 4.09Å; F431-L435 HydrophobicContact CE2-CD2 3.62Å; F431-L435 HydrophobicContact CE2-CG 3.88Å; F431-L435 HydrophobicContact CG-CD2 4.26Å; F431-L435 HydrophobicContact CZ-CD2 4.02Å; F431-L435 HydrophobicContact CZ-CG 3.73Å; F431-L435 WeakPolarHBondContact O-CB 3.29Å; F431-L435 WeakPolarHBondContact O-CD2 3.18Å; F431-L435 PolarHBondContact O-N 2.81Å; F431-A449 HydrophobicContact CD2-CB 4.37Å; F431-A449 WeakPolarHBondContact CD2-O 3.48Å; F431-L453 HydrophobicContact CD2-CB 4.14Å; F431-L453 HydrophobicContact CD2-CD2 4.22Å; F431-L453 HydrophobicContact CE1-CD2 4.49Å; F431-L453 HydrophobicContact CE2-CB 4.22Å; F431-L453 HydrophobicContact CE2-CD2 3.6Å; F431-L453 HydrophobicContact CZ-CD2 3.76Å; F431-M481 HydrophobicContact CB-SD 4.12Å; F431-M481 HydrophobicContact CD1-CB 3.94Å; F431-M481 HydrophobicContact CD1-CG 3.69Å; F431-M481 HydrophobicContact CD1-SD 4.1Å; F431-M481 HydrophobicContact CE1-CB 3.85Å; F431-M481 HydrophobicContact CE1-CG 4.11Å; F431-M481 WeakPolarHBondContact CE1-O 3.37Å; F431-M481 HydrophobicContact CG-CG 4.36Å; F431-M481 HydrophobicContact CG-SD 4.17Å; F431-T484 HydrophobicContact CE1-CG2 4.16Å; F431-L485 HydrophobicContact CE2-CD1 4.18Å; F431-L485 HydrophobicContact CZ-CB 4Å; F431-L485 HydrophobicContact CZ-CD1 4.11Å
432	S	93.5	Very high	92.1	Very high	34 Å²	34	57.3 Å²	57.3	24%	0.238	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-39.5	-176.8	-54.3	0	0	0	0	111.9	R428 V430 Q436	R428-S432 WeakPolarHBondContact O-CB 3.41Å; R428-S432 PolarHBondContact O-N 3.43Å; R428-S432 PolarHBondContact O-OG 2.97Å; V430-S432 PolarHBondContact O-N 2.69Å; S432-Q436 WeakPolarHBondContact O-CB 3.33Å; S432-Q436 WeakPolarHBondContact O-CG 3.48Å; S432-Q436 PolarHBondContact O-N 3.34Å
433	S	94.1	Very high	92.5	Very high	73 Å²	73	57 Å²	57	51%	0.51	29%	0.288	S	S	.	.	H	α-helix	trans	-65.2	-44.7	178	-174	0	0	0	0	111.7	R429 V430 F431 N437	R429-S433 WeakPolarHBondContact O-CB 3.23Å; R429-S433 PolarHBondContact O-N 3.21Å; R429-S433 VanDerWaalsContact O-N 3.08Å; V430-S433 PolarHBondContact O-N 3.28Å; F431-S433 PolarHBondContact O-N 2.95Å; S433-N437 PolarHBondContact O-ND2 3.46Å
434	T	94.6	Very high	92.8	Very high	13 Å²	13	58.4 Å²	58.4	8%	0.08	30%	0.295	C	S	.	.	H	α-helix	trans	-68.7	-46	-179.8	-56.8	0	0	0	0	111.7	V430 F431 Q436 N437 W438 T441 V446 A449	V430-T434 WeakPolarHBondContact O-CB 3.3Å; V430-T434 PolarHBondContact O-N 3.26Å; V430-T434 PolarHBondContact O-OG1 2.89Å; F431-T434 PolarHBondContact O-N 2.84Å; T434-Q436 VanDerWaalsContact C-N 3.26Å; T434-Q436 PolarHBondContact O-N 3.22Å; T434-N437 CarbonylContact O-C 3.57Å; T434-N437 PolarHBondContact O-N 2.97Å; T434-N437 VanDerWaalsContact O-N 3.16Å; T434-W438 WeakPolarHBondContact O-CA 3.4Å; T434-W438 PolarHBondContact O-N 3.42Å; T434-T441 HydrophobicContact CG2-CG2 4.13Å; T434-V446 HydrophobicContact CG2-CB 4.44Å; T434-V446 HydrophobicContact CG2-CG2 4.08Å; T434-A449 HydrophobicContact CG2-CB 3.78Å
435	L	94.3	Very high	93.1	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.037	31%	0.308	C	S	.	.	H	α-helix	trans	-72.7	-15.3	-178	-84.6	-68.5	0	0	0	113.4	F431 W438 A449 T484 V490	F431-L435 HydrophobicContact CD2-CD2 3.75Å; F431-L435 HydrophobicContact CD2-CG 4.35Å; F431-L435 HydrophobicContact CE1-CD2 4.49Å; F431-L435 HydrophobicContact CE1-CG 4.09Å; F431-L435 HydrophobicContact CE2-CD2 3.62Å; F431-L435 HydrophobicContact CE2-CG 3.88Å; F431-L435 HydrophobicContact CG-CD2 4.26Å; F431-L435 HydrophobicContact CZ-CD2 4.02Å; F431-L435 HydrophobicContact CZ-CG 3.73Å; F431-L435 WeakPolarHBondContact O-CB 3.29Å; F431-L435 WeakPolarHBondContact O-CD2 3.18Å; F431-L435 PolarHBondContact O-N 2.81Å; L435-W438 VanDerWaalsContact O-CD1 3.28Å; L435-A449 HydrophobicContact CD2-CB 3.96Å; L435-T484 HydrophobicContact CB-CG2 4.33Å; L435-V490 HydrophobicContact CD1-CB 3.87Å; L435-V490 HydrophobicContact CD1-CG1 4.02Å; L435-V490 HydrophobicContact CD1-CG2 3.96Å
436	Q	92.6	Very high	93.4	Very high	144 Å²	144	58.7 Å²	58.7	67%	0.673	29%	0.286	S	S	*	.	H	α-helix	trans	-73.4	-30.2	170.4	-80.1	172.5	8.5	0	0	112.7	S432 T434	S432-Q436 WeakPolarHBondContact O-CB 3.33Å; S432-Q436 WeakPolarHBondContact O-CG 3.48Å; S432-Q436 PolarHBondContact O-N 3.34Å; T434-Q436 VanDerWaalsContact C-N 3.26Å; T434-Q436 PolarHBondContact O-N 3.22Å
437	N	92.9	Very high	93.7	Very high	85 Å²	85	58.6 Å²	58.6	46%	0.455	29%	0.285	S	S	.	.	S	Bend	trans	-118.8	21.7	-174.9	-59.7	-61.5	0	0	0	112.7	S433 T434 Q439 T440 T441	S433-N437 PolarHBondContact O-ND2 3.46Å; T434-N437 CarbonylContact O-C 3.57Å; T434-N437 PolarHBondContact O-N 2.97Å; T434-N437 VanDerWaalsContact O-N 3.16Å; N437-Q439 PolarHBondContact O-N 2.9Å; N437-T440 PolarHBondContact O-N 3.13Å; N437-T440 PolarHBondContact O-OG1 3.35Å; N437-T441 PolarHBondContact O-N 3.32Å; N437-T441 VanDerWaalsContact O-N 3.1Å; N437-T441 PolarHBondContact O-OG1 3.49Å; N437-T441 VanDerWaalsContact O-OG1 3.05Å
438	W	93.7	Very high	93.9	Very high	28 Å²	28	58.9 Å²	58.9	11%	0.106	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-28.8	-168.5	71.7	-101.2	0	0	0	113.4	T434 L435 T440 V446 S488 V490 S492 Y493	T434-W438 WeakPolarHBondContact O-CA 3.4Å; T434-W438 PolarHBondContact O-N 3.42Å; L435-W438 VanDerWaalsContact O-CD1 3.28Å; W438-T440 VanDerWaalsContact C-N 3.27Å; W438-T440 PolarHBondContact O-N 2.89Å; W438-V446 HydrophobicContact CB-CG2 4.34Å; W438-S488 PolarHBondContact NE1-O 2.96Å; W438-V490 HydrophobicContact CB-CG2 4.48Å; W438-V490 HydrophobicContact CD2-CB 4.47Å; W438-V490 HydrophobicContact CD2-CG2 4.36Å; W438-V490 HydrophobicContact CG-CG2 4.39Å; W438-S492 WeakPolarHBondContact CH2-OG 3.44Å; W438-Y493 AromaticContact CE3-CD2 3.58Å; W438-Y493 HydrophobicContact CE3-CD2 3.58Å; W438-Y493 HydrophobicContact CE3-CE2 4.15Å; W438-Y493 AromaticContact CZ3-CD2 3.78Å; W438-Y493 HydrophobicContact CZ3-CD2 3.78Å; W438-Y493 WeakPolarHBondContact O-CE2 3.41Å
439	Q	92.6	Very high	94.1	Very high	124 Å²	124	54.1 Å²	54.1	58%	0.579	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-27.7	179.7	-59.3	91.3	-15.1	0	0	113.1	N437	N437-Q439 PolarHBondContact O-N 2.9Å
440	T	92.7	Very high	94.3	Very high	121 Å²	121	47.7 Å²	47.7	74%	0.742	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104	-16.4	-179.4	52.1	0	0	0	0	113	N437 W438	N437-T440 PolarHBondContact O-N 3.13Å; N437-T440 PolarHBondContact O-OG1 3.35Å; W438-T440 VanDerWaalsContact C-N 3.27Å; W438-T440 PolarHBondContact O-N 2.89Å
441	T	93.6	Very high	94.4	Very high	22 Å²	22	48.2 Å²	48.2	14%	0.135	24%	0.242	C	C	.	.	S	Bend	trans	-79.1	143.4	-179.5	-58	0	0	0	0	111.3	T434 N437 E445 V446 Y493	T434-T441 HydrophobicContact CG2-CG2 4.13Å; N437-T441 PolarHBondContact O-N 3.32Å; N437-T441 VanDerWaalsContact O-N 3.1Å; N437-T441 PolarHBondContact O-OG1 3.49Å; N437-T441 VanDerWaalsContact O-OG1 3.05Å; T441-E445 HydrophobicContact CG2-CB 3.55Å; T441-E445 HydrophobicContact CG2-CG 4.29Å; T441-E445 VanDerWaalsContact CG2-OE2 3.27Å; T441-E445 WeakPolarHBondContact CG2-OE2 3.36Å; T441-V446 HydrophobicContact CG2-CG2 3.98Å; T441-Y493 PolarHBondContact O-OH 3.46Å; T441-Y493 VanDerWaalsContact O-OH 3.07Å
442	R	93.9	Very high	94.4	Very high	141 Å²	141	48.2 Å²	48.2	53%	0.532	24%	0.242	S	C	.	.			trans	-62.3	148.7	177.3	-67.4	178.3	173.6	-167.9	-7.7	110.8	E387 M444 E445 V446	E387-R442 IonicContact OE1-CZ 2.7Å; E387-R442 IonicContact OE1-NH1 3.64Å; E387-R442 PolarHBondContact OE1-NH1 2.92Å; E387-R442 IonicContact OE1-NH2 3.86Å; R442-M444 PolarHBondContact O-N 3.29Å; R442-E445 PolarHBondContact O-N 2.96Å; R442-V446 PolarHBondContact O-N 3.03Å
443	F	94.3	Very high	94.4	Very high	37 Å²	37	46.6 Å²	46.6	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-59.3	-33.4	-175.3	81.1	-89.8	0	0	0	112.7	Y385 F391 E445 V446 E447 Y493 H495 V498	Y385-F443 HydrophobicContact CD2-CE2 4.37Å; F391-F443 AromaticContact CE2-CE2 3.74Å; F391-F443 HydrophobicContact CE2-CE2 3.74Å; F391-F443 AromaticContact CE2-CZ 3.7Å; F391-F443 HydrophobicContact CE2-CZ 3.7Å; F391-F443 AromaticContact CZ-CE2 3.71Å; F391-F443 HydrophobicContact CZ-CE2 3.71Å; F391-F443 HydrophobicContact CZ-CZ 4.12Å; F443-E445 PolarHBondContact O-N 3.43Å; F443-V446 PolarHBondContact O-N 3.01Å; F443-E447 WeakPolarHBondContact O-CB 3.49Å; F443-E447 PolarHBondContact O-N 3.17Å; F443-Y493 WeakPolarHBondContact CA-OH 3.49Å; F443-Y493 HydrophobicContact CB-CE1 3.51Å; F443-Y493 PolarHBondContact N-OH 2.62Å; F443-Y493 VanDerWaalsContact N-OH 3.12Å; F443-H495 HydrophobicContact CB-CB 3.85Å; F443-H495 AromaticContact CD1-CD2 3.91Å; F443-H495 HydrophobicContact CD2-CB 4.48Å; F443-H495 AromaticContact CD2-CD2 3.88Å; F443-H495 AromaticContact CD2-CE1 3.61Å; F443-H495 AromaticContact CD2-CG 3.71Å; F443-H495 AromaticContact CD2-ND1 3.53Å; F443-H495 AromaticContact CD2-NE2 3.84Å; F443-H495 AromaticContact CE2-CE1 3.54Å; F443-H495 AromaticContact CE2-ND1 3.96Å; F443-H495 AromaticContact CE2-NE2 3.72Å; F443-H495 HydrophobicContact CG-CB 4.21Å; F443-H495 AromaticContact CG-CD2 3.73Å; F443-H495 AromaticContact CG-CG 3.72Å; F443-H495 AromaticContact CZ-NE2 3.85Å; F443-V498 HydrophobicContact CB-CG2 4.02Å
444	M	94.9	Very high	94.3	Very high	28 Å²	28	45.5 Å²	45.5	14%	0.138	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-45.8	-179	-51.8	154.9	-150.7	0	0	111.1	E387 R442 V448	E387-M444 HydrophobicContact CG-CE 3.98Å; E387-M444 HydrophobicContact CG-SD 4.48Å; R442-M444 PolarHBondContact O-N 3.29Å; M444-V448 WeakPolarHBondContact O-CG2 3.41Å; M444-V448 PolarHBondContact O-N 3.15Å
445	E	94.5	Very high	94.2	Very high	95 Å²	95	45.3 Å²	45.3	44%	0.444	21%	0.214	S	C	.	.	H	α-helix	trans	-71.2	-40.1	179.1	-69.2	174.8	-133.7	0	0	111.7	T441 R442 F443 A449	T441-E445 HydrophobicContact CG2-CB 3.55Å; T441-E445 HydrophobicContact CG2-CG 4.29Å; T441-E445 VanDerWaalsContact CG2-OE2 3.27Å; T441-E445 WeakPolarHBondContact CG2-OE2 3.36Å; R442-E445 PolarHBondContact O-N 2.96Å; F443-E445 PolarHBondContact O-N 3.43Å; E445-A449 WeakPolarHBondContact O-CB 3.28Å; E445-A449 PolarHBondContact O-N 2.95Å
446	V	96.4	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-43.8	175.9	-179.6	0	0	0	0	110.6	T434 W438 T441 R442 F443 A449 I450 V490 Y493 V498	T434-V446 HydrophobicContact CG2-CB 4.44Å; T434-V446 HydrophobicContact CG2-CG2 4.08Å; W438-V446 HydrophobicContact CB-CG2 4.34Å; T441-V446 HydrophobicContact CG2-CG2 3.98Å; R442-V446 PolarHBondContact O-N 3.03Å; F443-V446 PolarHBondContact O-N 3.01Å; V446-A449 PolarHBondContact O-N 3.28Å; V446-I450 HydrophobicContact CG1-CD1 4.2Å; V446-I450 WeakPolarHBondContact O-CG1 3.36Å; V446-I450 PolarHBondContact O-N 3.28Å; V446-I450 VanDerWaalsContact O-N 3.15Å; V446-V490 HydrophobicContact CG1-CG2 3.73Å; V446-Y493 HydrophobicContact CG2-CE2 4.24Å; V446-V498 HydrophobicContact CB-CG2 4.36Å; V446-V498 HydrophobicContact CG1-CG1 3.78Å; V446-V498 HydrophobicContact CG1-CG2 4.34Å
447	E	96.2	Very high	93.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-49.8	177.9	-172.8	-90.2	175.5	0	0	111.3	Y385 R405 F443 A449 I450 R451 V498	Y385-E447 HydrophobicContact CE2-CG 4.17Å; R405-E447 IonicContact NH2-OE2 2.64Å; R405-E447 PolarHBondContact NH2-OE2 3.12Å; R405-E447 VanDerWaalsContact NH2-OE2 3.15Å; F443-E447 WeakPolarHBondContact O-CB 3.49Å; F443-E447 PolarHBondContact O-N 3.17Å; E447-A449 VanDerWaalsContact C-N 3.32Å; E447-A449 PolarHBondContact O-N 2.91Å; E447-I450 PolarHBondContact O-N 3.33Å; E447-R451 WeakPolarHBondContact O-CB 3.47Å; E447-R451 PolarHBondContact O-N 3.41Å; E447-R451 IonicContact OE1-CZ 3.74Å; E447-R451 IonicContact OE1-NE 2.72Å; E447-R451 PolarHBondContact OE1-NE 3.13Å; E447-R451 IonicContact OE1-NH1 3.42Å; E447-R451 PolarHBondContact OE1-NH1 2.85Å; E447-R451 VanDerWaalsContact OE1-NH1 3.14Å; E447-R451 IonicContact OE1-NH2 2.66Å; E447-R451 PolarHBondContact OE1-NH2 3.42Å; E447-V498 HydrophobicContact CB-CG2 3.98Å
448	V	95.9	Very high	92.6	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-40.1	177.4	168.2	0	0	0	0	111.9	L383 T384 M444 I450 R451 L452	L383-V448 HydrophobicContact CB-CG1 4.33Å; L383-V448 HydrophobicContact CB-CG2 4.33Å; L383-V448 WeakPolarHBondContact O-CG2 3.49Å; T384-V448 VanDerWaalsContact CA-CG2 3.49Å; T384-V448 HydrophobicContact CG2-CB 4.31Å; T384-V448 HydrophobicContact CG2-CG2 3.75Å; M444-V448 WeakPolarHBondContact O-CG2 3.41Å; M444-V448 PolarHBondContact O-N 3.15Å; V448-I450 VanDerWaalsContact C-N 3.34Å; V448-I450 PolarHBondContact O-N 3.46Å; V448-R451 PolarHBondContact O-N 2.69Å; V448-L452 HydrophobicContact CG1-CD1 3.85Å; V448-L452 HydrophobicContact CG1-CG 4.04Å; V448-L452 WeakPolarHBondContact O-CB 3.29Å; V448-L452 VanDerWaalsContact O-CG 3.24Å; V448-L452 WeakPolarHBondContact O-CG 3.34Å; V448-L452 PolarHBondContact O-N 3.11Å
449	A	96.1	Very high	92	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-47.6	176.3	0	0	0	0	0	111.5	F431 T434 L435 E445 V446 E447 L453	F431-A449 HydrophobicContact CD2-CB 4.37Å; F431-A449 WeakPolarHBondContact CD2-O 3.48Å; T434-A449 HydrophobicContact CG2-CB 3.78Å; L435-A449 HydrophobicContact CD2-CB 3.96Å; E445-A449 WeakPolarHBondContact O-CB 3.28Å; E445-A449 PolarHBondContact O-N 2.95Å; V446-A449 PolarHBondContact O-N 3.28Å; E447-A449 VanDerWaalsContact C-N 3.32Å; E447-A449 PolarHBondContact O-N 2.91Å; A449-L453 PolarHBondContact O-N 2.71Å
450	I	96.3	Very high	91.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.7	-39.5	177.8	-58.3	171.2	0	0	0	110.5	V446 E447 V448 L453 Y454 L485 V490 V498 E501 T505	V446-I450 HydrophobicContact CG1-CD1 4.2Å; V446-I450 WeakPolarHBondContact O-CG1 3.36Å; V446-I450 PolarHBondContact O-N 3.28Å; V446-I450 VanDerWaalsContact O-N 3.15Å; E447-I450 PolarHBondContact O-N 3.33Å; V448-I450 VanDerWaalsContact C-N 3.34Å; V448-I450 PolarHBondContact O-N 3.46Å; I450-L453 CarbonylContact O-C 3.6Å; I450-L453 WeakPolarHBondContact O-CA 3.29Å; I450-L453 WeakPolarHBondContact O-CB 3.32Å; I450-L453 PolarHBondContact O-N 3.17Å; I450-Y454 PolarHBondContact O-N 2.92Å; I450-L485 HydrophobicContact CD1-CD1 4.24Å; I450-L485 HydrophobicContact CG1-CD1 3.99Å; I450-L485 HydrophobicContact CG2-CD1 4.15Å; I450-V490 HydrophobicContact CD1-CG1 4.22Å; I450-V490 HydrophobicContact CD1-CG2 4.06Å; I450-V498 HydrophobicContact CD1-CG1 3.97Å; I450-E501 HydrophobicContact CB-CG 4Å; I450-E501 HydrophobicContact CG2-CB 4.29Å; I450-E501 HydrophobicContact CG2-CG 3.76Å; I450-T505 HydrophobicContact CG2-CG2 4.38Å; I450-T505 WeakPolarHBondContact CG2-OG1 3.4Å
451	R	95.5	Very high	90.1	Very high	52 Å²	52	31.2 Å²	31.2	20%	0.196	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-38.6	178.1	-179.7	164	-73.5	168.2	11.1	113.3	R405 E447 V448 L453 Y454 M455 E501	R405-R451 VanDerWaalsContact CZ-NH1 3.33Å; E447-R451 WeakPolarHBondContact O-CB 3.47Å; E447-R451 PolarHBondContact O-N 3.41Å; E447-R451 IonicContact OE1-CZ 3.74Å; E447-R451 IonicContact OE1-NE 2.72Å; E447-R451 PolarHBondContact OE1-NE 3.13Å; E447-R451 IonicContact OE1-NH1 3.42Å; E447-R451 PolarHBondContact OE1-NH1 2.85Å; E447-R451 VanDerWaalsContact OE1-NH1 3.14Å; E447-R451 IonicContact OE1-NH2 2.66Å; E447-R451 PolarHBondContact OE1-NH2 3.42Å; V448-R451 PolarHBondContact O-N 2.69Å; R451-L453 VanDerWaalsContact C-N 3.26Å; R451-L453 PolarHBondContact O-N 3.38Å; R451-Y454 WeakPolarHBondContact O-CB 3.38Å; R451-Y454 PolarHBondContact O-N 3.43Å; R451-Y454 VanDerWaalsContact O-N 3.13Å; R451-M455 HydrophobicContact CG-CE 4.02Å; R451-M455 HydrophobicContact CG-CG 4.32Å; R451-M455 HydrophobicContact CG-SD 4.29Å; R451-M455 WeakPolarHBondContact O-CG 3.34Å; R451-M455 PolarHBondContact O-N 2.97Å; R451-E501 WeakPolarHBondContact CA-OE1 3.35Å; R451-E501 HydrophobicContact CB-CG 4.02Å; R451-E501 IonicContact CZ-OE2 2.68Å; R451-E501 VanDerWaalsContact CZ-OE2 3.28Å; R451-E501 IonicContact NE-OE1 3.96Å; R451-E501 IonicContact NE-OE2 3.41Å; R451-E501 PolarHBondContact NE-OE2 3.39Å; R451-E501 IonicContact NH2-OE2 3.34Å; R451-E501 PolarHBondContact NH2-OE2 3.14Å
452	L	94	Very high	88.7	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-59.2	-43.5	172.8	-73.3	170.2	0	0	0	110.1	M380 L383 L412 V427 V430 V448 M455 L456	M380-L452 HydrophobicContact CB-CD1 4.35Å; M380-L452 HydrophobicContact CE-CD2 4.47Å; M380-L452 HydrophobicContact CG-CD1 3.95Å; M380-L452 HydrophobicContact CG-CD2 3.86Å; M380-L452 HydrophobicContact SD-CD1 4.22Å; L383-L452 HydrophobicContact CD1-CD2 3.87Å; L412-L452 HydrophobicContact CD2-CD2 4.21Å; V427-L452 HydrophobicContact CG1-CB 3.82Å; V427-L452 HydrophobicContact CG2-CB 4.24Å; V430-L452 HydrophobicContact CG1-CD1 4.14Å; V448-L452 HydrophobicContact CG1-CD1 3.85Å; V448-L452 HydrophobicContact CG1-CG 4.04Å; V448-L452 WeakPolarHBondContact O-CB 3.29Å; V448-L452 VanDerWaalsContact O-CG 3.24Å; V448-L452 WeakPolarHBondContact O-CG 3.34Å; V448-L452 PolarHBondContact O-N 3.11Å; L452-M455 HydrophobicContact CD2-CE 3.77Å; L452-M455 HydrophobicContact CG-CE 4.45Å; L452-M455 PolarHBondContact O-N 3.18Å; L452-L456 WeakPolarHBondContact O-CG 3.22Å; L452-L456 PolarHBondContact O-N 2.88Å; L452-L456 VanDerWaalsContact O-N 3.17Å
453	L	93.1	Very high	86.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-47.7	171.5	177.6	60.9	0	0	0	111.1	F431 A449 I450 R451 M455 L456 L478 M481 M482 L485 T505 Y509	F431-L453 HydrophobicContact CD2-CB 4.14Å; F431-L453 HydrophobicContact CD2-CD2 4.22Å; F431-L453 HydrophobicContact CE1-CD2 4.49Å; F431-L453 HydrophobicContact CE2-CB 4.22Å; F431-L453 HydrophobicContact CE2-CD2 3.6Å; F431-L453 HydrophobicContact CZ-CD2 3.76Å; A449-L453 PolarHBondContact O-N 2.71Å; I450-L453 CarbonylContact O-C 3.6Å; I450-L453 WeakPolarHBondContact O-CA 3.29Å; I450-L453 WeakPolarHBondContact O-CB 3.32Å; I450-L453 PolarHBondContact O-N 3.17Å; R451-L453 VanDerWaalsContact C-N 3.26Å; R451-L453 PolarHBondContact O-N 3.38Å; L453-M455 VanDerWaalsContact C-N 3.3Å; L453-M455 PolarHBondContact O-N 3.23Å; L453-L456 WeakPolarHBondContact O-CB 3.35Å; L453-L456 PolarHBondContact O-N 2.84Å; L453-L478 HydrophobicContact CD1-CD1 3.48Å; L453-L478 VanDerWaalsContact CD1-CD1 3.48Å; L453-M481 HydrophobicContact CD1-CB 3.92Å; L453-M481 HydrophobicContact CD1-CE 3.89Å; L453-M481 HydrophobicContact CD1-SD 4.18Å; L453-M481 HydrophobicContact CD2-CB 4.18Å; L453-M482 HydrophobicContact CD2-SD 4.07Å; L453-L485 HydrophobicContact CD2-CD2 4.19Å; L453-T505 HydrophobicContact CD2-CG2 4.02Å; L453-T505 HydrophobicContact CG-CG2 4.01Å; L453-Y509 HydrophobicContact CD1-CE2 4.18Å; L453-Y509 HydrophobicContact CG-CE2 4.08Å; L453-Y509 WeakPolarHBondContact O-CE2 3.4Å; L453-Y509 PolarHBondContact O-OH 2.8Å
454	Y	92.5	Very high	85.2	Confident	51 Å²	51	34.9 Å²	34.9	20%	0.2	19%	0.19	C	C	.	.	H	α-helix	trans	-54	-42.6	176.2	176.2	-94.6	0	0	0	113.6	I450 R451 E501 E504 R508	I450-Y454 PolarHBondContact O-N 2.92Å; R451-Y454 WeakPolarHBondContact O-CB 3.38Å; R451-Y454 PolarHBondContact O-N 3.43Å; R451-Y454 VanDerWaalsContact O-N 3.13Å; Y454-E501 VanDerWaalsContact CB-OE1 3.29Å; Y454-E501 WeakPolarHBondContact CB-OE1 3.33Å; Y454-E504 HydrophobicContact CD2-CB 4.01Å; Y454-E504 HydrophobicContact CE2-CB 3.74Å; Y454-R508 HydrophobicContact CD2-CB 4.26Å; Y454-R508 VanDerWaalsContact CD2-CD 3.46Å; Y454-R508 HydrophobicContact CE2-CB 4.12Å; Y454-R508 VanDerWaalsContact CE2-CD 3.47Å; Y454-R508 HydrophobicContact CE2-CG 4.44Å; Y454-R508 WeakPolarHBondContact O-CD 3.43Å; Y454-R508 PolarHBondContact O-NH1 3.08Å; Y454-R508 VanDerWaalsContact O-NH1 3.1Å; Y454-R508 PolarHBondContact OH-NE 2.82Å; Y454-R508 PolarHBondContact OH-NH2 3.31Å
455	M	91.3	Very high	83.2	Confident	8 Å²	8	34.6 Å²	34.6	4%	0.039	19%	0.194	C	C	.	.	H	α-helix	trans	-72.6	-30.2	-177.9	-68.8	-173.6	-62.4	0	0	113	L383 K409 L412 R451 L452 L453 A457 E458 A459	L383-M455 HydrophobicContact CD1-CE 3.67Å; K409-M455 HydrophobicContact CB-SD 4.23Å; K409-M455 HydrophobicContact CD-SD 4.42Å; K409-M455 HydrophobicContact CG-SD 3.9Å; L412-M455 HydrophobicContact CD2-CB 4.02Å; L412-M455 HydrophobicContact CD2-CE 3.46Å; L412-M455 VanDerWaalsContact CD2-CE 3.46Å; L412-M455 HydrophobicContact CD2-SD 4.04Å; R451-M455 HydrophobicContact CG-CE 4.02Å; R451-M455 HydrophobicContact CG-CG 4.32Å; R451-M455 HydrophobicContact CG-SD 4.29Å; R451-M455 WeakPolarHBondContact O-CG 3.34Å; R451-M455 PolarHBondContact O-N 2.97Å; L452-M455 HydrophobicContact CD2-CE 3.77Å; L452-M455 HydrophobicContact CG-CE 4.45Å; L452-M455 PolarHBondContact O-N 3.18Å; L453-M455 VanDerWaalsContact C-N 3.3Å; L453-M455 PolarHBondContact O-N 3.23Å; M455-A457 PolarHBondContact O-N 3.01Å; M455-E458 PolarHBondContact O-N 2.98Å; M455-E458 VanDerWaalsContact O-N 3.1Å; M455-A459 PolarHBondContact O-N 3.16Å; M455-A459 VanDerWaalsContact O-N 3.13Å
456	L	88.5	Confident	81.5	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-56.5	-26.9	177.2	-75.7	-177.7	0	0	0	113.3	L423 L424 V427 L452 L453 E458 L460 M481	L423-L456 HydrophobicContact CD2-CD2 4.02Å; L423-L456 HydrophobicContact CG-CD2 4.02Å; L424-L456 HydrophobicContact CD1-CD1 4Å; V427-L456 HydrophobicContact CB-CD1 3.93Å; V427-L456 HydrophobicContact CB-CG 4.44Å; V427-L456 HydrophobicContact CG1-CD1 3.56Å; V427-L456 HydrophobicContact CG1-CG 4.13Å; V427-L456 HydrophobicContact CG2-CD1 4.33Å; V427-L456 HydrophobicContact CG2-CD2 4.08Å; V427-L456 HydrophobicContact CG2-CG 4.31Å; L452-L456 WeakPolarHBondContact O-CG 3.22Å; L452-L456 PolarHBondContact O-N 2.88Å; L452-L456 VanDerWaalsContact O-N 3.17Å; L453-L456 WeakPolarHBondContact O-CB 3.35Å; L453-L456 PolarHBondContact O-N 2.84Å; L456-E458 VanDerWaalsContact C-N 3.28Å; L456-E458 PolarHBondContact O-N 3.45Å; L456-L460 HydrophobicContact CB-CD1 4.27Å; L456-L460 HydrophobicContact CD2-CD1 3.95Å; L456-L460 HydrophobicContact CD2-CG 4.11Å; L456-L460 HydrophobicContact CG-CD1 4.48Å; L456-L460 WeakPolarHBondContact O-CB 3.45Å; L456-L460 PolarHBondContact O-N 3.35Å; L456-L460 VanDerWaalsContact O-N 3.08Å; L456-M481 HydrophobicContact CD1-CE 3.75Å
457	A	80.2	Confident	79.9	Confident	32 Å²	32	35.6 Å²	35.6	26%	0.264	20%	0.203	S	C	.	.	H	α-helix	trans	-63.9	-33.3	-179.8	0	0	0	0	0	113.1	M455 R508 Y509	M455-A457 PolarHBondContact O-N 3.01Å; A457-R508 HydrophobicContact CB-CG 3.77Å; A457-Y509 WeakPolarHBondContact CA-OH 3.28Å; A457-Y509 HydrophobicContact CB-CD1 4.38Å; A457-Y509 HydrophobicContact CB-CE1 3.47Å; A457-Y509 VanDerWaalsContact CB-CE1 3.47Å; A457-Y509 HydrophobicContact CB-CE2 4.31Å; A457-Y509 VanDerWaalsContact CB-CZ 3.45Å; A457-Y509 WeakPolarHBondContact CB-OH 3.47Å; A457-Y509 PolarHBondContact N-OH 3.24Å
458	E	79.1	Confident	78.7	Confident	100 Å²	100	36.7 Å²	36.7	47%	0.467	21%	0.208	S	C	.	.	H	α-helix	trans	-91.3	-36.2	178.5	-79.6	171.4	-179.1	0	0	111.3	K409 M455 L456 R508	K409-E458 WeakPolarHBondContact CE-OE2 3.32Å; K409-E458 IonicContact NZ-OE2 3.64Å; K409-E458 PolarHBondContact NZ-OE2 3.05Å; M455-E458 PolarHBondContact O-N 2.98Å; M455-E458 VanDerWaalsContact O-N 3.1Å; L456-E458 VanDerWaalsContact C-N 3.28Å; L456-E458 PolarHBondContact O-N 3.45Å; E458-R508 VanDerWaalsContact CG-NH1 3.31Å; E458-R508 IonicContact OE1-CZ 3.91Å; E458-R508 VanDerWaalsContact OE1-CZ 3.29Å; E458-R508 IonicContact OE1-NH1 2.96Å; E458-R508 PolarHBondContact OE1-NH1 3.45Å; E458-R508 IonicContact OE1-NH2 3.81Å; E458-R508 PolarHBondContact OE1-NH2 3.17Å; E458-R508 IonicContact OE2-NH1 2.77Å; E458-R508 PolarHBondContact OE2-NH1 2.66Å; E458-R508 IonicContact OE2-NH2 3.28Å
459	A	80.5	Confident	76.9	Confident	11 Å²	11	38.8 Å²	38.8	9%	0.091	22%	0.223	C	C	.	.	H	α-helix	trans	-74.2	-37.4	-173.4	0	0	0	0	0	113.2	D413 A416 M455	D413-A459 WeakPolarHBondContact OD1-CB 3.4Å; A416-A459 HydrophobicContact CB-CB 3.7Å; A416-A459 WeakPolarHBondContact CB-O 3.23Å; M455-A459 PolarHBondContact O-N 3.16Å; M455-A459 VanDerWaalsContact O-N 3.13Å
460	L	77.6	Confident	75	Confident	9 Å²	9	41.6 Å²	41.6	5%	0.047	25%	0.252	C	S	.	.	S	Bend	trans	-88.8	128.9	-175.5	-67.9	176.8	0	0	0	112.4	P420 L424 L456	P420-L460 HydrophobicContact CB-CD2 3.79Å; L424-L460 HydrophobicContact CB-CD1 4.43Å; L424-L460 HydrophobicContact CD1-CD1 4.03Å; L456-L460 HydrophobicContact CB-CD1 4.27Å; L456-L460 HydrophobicContact CD2-CD1 3.95Å; L456-L460 HydrophobicContact CD2-CG 4.11Å; L456-L460 HydrophobicContact CG-CD1 4.48Å; L456-L460 WeakPolarHBondContact O-CB 3.45Å; L456-L460 PolarHBondContact O-N 3.35Å; L456-L460 VanDerWaalsContact O-N 3.08Å
461	P	68.2	Low	73.1	Confident	60 Å²	60	44.6 Å²	44.6	39%	0.39	27%	0.268	S	S	.	.			trans	-61.6	154.1	172	-20.9	31.5	0	0	0	112.6	S463 H464	P461-S463 PolarHBondContact O-N 3.02Å; P461-S463 VanDerWaalsContact O-N 3.08Å; P461-H464 PolarHBondContact O-N 3.25Å
462	V	64.3	Low	71.2	Confident	99 Å²	99	47.6 Å²	47.6	60%	0.6	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-47	-38.1	173.4	159.9	0	0	0	0	113.3	H464 H467	V462-H464 VanDerWaalsContact C-N 3.32Å; V462-H464 PolarHBondContact O-N 3.2Å; V462-H467 WeakPolarHBondContact CG1-CD2 3.48Å; V462-H467 WeakPolarHBondContact CG1-NE2 3.21Å; V462-H467 WeakPolarHBondContact CG2-NE2 3.27Å
463	S	56.5	Low	69	Low	98 Å²	98	52.5 Å²	52.5	69%	0.685	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-71	-19.3	-179.5	52.8	0	0	0	0	114.9	P461	P461-S463 PolarHBondContact O-N 3.02Å; P461-S463 VanDerWaalsContact O-N 3.08Å
464	H	57	Low	67	Low	80 Å²	80	59.2 Å²	59.2	37%	0.37	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-107.1	30	-174.1	-70.5	-76	0	0	0	113.1	P420 P461 V462	P420-H464 HydrophobicContact CB-CB 4.47Å; P461-H464 PolarHBondContact O-N 3.25Å; V462-H464 VanDerWaalsContact C-N 3.32Å; V462-H464 PolarHBondContact O-N 3.2Å
465	G	54.4	Low	65.4	Low	22 Å²	22	58.4 Å²	58.4	23%	0.227	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	11.8	171.1	0	0	0	0	0	115.7	H467	G465-H467 PolarHBondContact O-N 3Å
466	A	57.5	Low	64.7	Low	25 Å²	25	59 Å²	59	21%	0.207	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-12	170.3	0	0	0	0	0	113.3
467	H	64.1	Low	64.3	Low	91 Å²	91	59.9 Å²	59.9	42%	0.421	37%	0.371	S	S	.	.	S	Bend	trans	-95.7	132.3	170.6	-78.2	-101.4	0	0	0	111.6	V462 G465 S469	V462-H467 WeakPolarHBondContact CG1-CD2 3.48Å; V462-H467 WeakPolarHBondContact CG1-NE2 3.21Å; V462-H467 WeakPolarHBondContact CG2-NE2 3.27Å; G465-H467 PolarHBondContact O-N 3Å; H467-S469 PolarHBondContact O-N 3.03Å
468	F	71.2	Confident	64.5	Low	23 Å²	23	58.4 Å²	58.4	10%	0.101	36%	0.359	C	S	.	.			trans	-74.5	103	165.2	-57.4	-74.2	0	0	0	108.3	L478 Q479 M482 Y509 K511 F512 V515	F468-L478 HydrophobicContact CE1-CD2 4.21Å; F468-L478 HydrophobicContact CE1-CG 4.1Å; F468-L478 HydrophobicContact CZ-CD2 4Å; F468-L478 HydrophobicContact CZ-CG 4.16Å; F468-Q479 HydrophobicContact CD1-CB 4.02Å; F468-Q479 HydrophobicContact CD1-CG 4.16Å; F468-Q479 HydrophobicContact CE1-CB 4.33Å; F468-M482 HydrophobicContact CE1-CB 4.47Å; F468-M482 HydrophobicContact CE1-CG 4.1Å; F468-M482 HydrophobicContact CZ-CG 4Å; F468-Y509 AromaticContact CE2-CD1 3.87Å; F468-Y509 HydrophobicContact CE2-CD1 3.87Å; F468-Y509 HydrophobicContact CE2-CG 4.5Å; F468-Y509 AromaticContact CZ-CD1 3.66Å; F468-Y509 HydrophobicContact CZ-CD1 3.66Å; F468-Y509 HydrophobicContact CZ-CE1 4.41Å; F468-Y509 HydrophobicContact CZ-CG 4.15Å; F468-K511 HydrophobicContact CD2-CB 4.03Å; F468-K511 HydrophobicContact CE2-CB 4.47Å; F468-F512 HydrophobicContact CD1-CB 4.14Å; F468-F512 AromaticContact CD1-CD2 3.74Å; F468-F512 HydrophobicContact CD1-CD2 3.74Å; F468-F512 HydrophobicContact CD1-CG 4.43Å; F468-F512 HydrophobicContact CD2-CB 3.91Å; F468-F512 VanDerWaalsContact CD2-N 3.3Å; F468-F512 HydrophobicContact CE1-CB 3.92Å; F468-F512 AromaticContact CE1-CD2 3.74Å; F468-F512 HydrophobicContact CE1-CD2 3.74Å; F468-F512 HydrophobicContact CE1-CG 4.24Å; F468-F512 HydrophobicContact CE2-CB 3.69Å; F468-F512 HydrophobicContact CG-CB 4.13Å; F468-F512 HydrophobicContact CG-CD2 4.37Å; F468-F512 HydrophobicContact CZ-CB 3.7Å; F468-F512 HydrophobicContact CZ-CD2 4.38Å; F468-F512 HydrophobicContact CZ-CG 4.44Å; F468-V515 HydrophobicContact CB-CB 4.31Å; F468-V515 HydrophobicContact CB-CG2 3.84Å
469	S	57.3	Low	64.9	Low	51 Å²	51	53.7 Å²	53.7	36%	0.357	34%	0.337	S	S	.	.			trans	-84	115	170.9	54.6	0	0	0	0	108	H467 D471 K474	H467-S469 PolarHBondContact O-N 3.03Å; S469-D471 PolarHBondContact O-N 3.48Å; S469-K474 PolarHBondContact OG-O 3.23Å
470	G	56.8	Low	65.3	Low	59 Å²	59	55.2 Å²	55.2	61%	0.608	34%	0.343	S	S	*	.	S	Bend	trans	-65.6	20.1	-178.5	0	0	0	0	0	117.4
471	D	55.8	Low	65.9	Low	64 Å²	64	54.8 Å²	54.8	34%	0.342	34%	0.341	S	S	.	.			trans	-93	108.2	170.2	-174.2	-8.4	0	0	0	109.1	S469 S473 K474 A475	S469-D471 PolarHBondContact O-N 3.48Å; D471-S473 VanDerWaalsContact CG-OG 3.26Å; D471-S473 PolarHBondContact O-N 3.12Å; D471-S473 VanDerWaalsContact O-N 3.17Å; D471-S473 WeakPolarHBondContact OD1-CB 3.43Å; D471-S473 PolarHBondContact OD1-N 2.96Å; D471-S473 PolarHBondContact OD1-OG 3.38Å; D471-S473 PolarHBondContact OD2-OG 3.47Å; D471-K474 HydrophobicContact CB-CB 4.28Å; D471-K474 CarbonylContact O-C 3.42Å; D471-K474 PolarHBondContact O-N 3.08Å; D471-K474 WeakPolarHBondContact OD2-CD 3.44Å; D471-K474 WeakPolarHBondContact OD2-CE 3.15Å; D471-K474 IonicContact OD2-NZ 3.32Å; D471-A475 PolarHBondContact O-N 3.42Å
472	V	54.8	Low	67.1	Low	115 Å²	115	52 Å²	52	70%	0.697	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-60.2	-25.7	-179.9	-177.8	0	0	0	0	111.8	K474	V472-K474 PolarHBondContact O-N 3.5Å
473	S	48.1	Very low	68.4	Low	103 Å²	103	51 Å²	51	72%	0.72	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-76.8	-10.9	176.9	73.9	0	0	0	0	113.7	D471	D471-S473 VanDerWaalsContact CG-OG 3.26Å; D471-S473 PolarHBondContact O-N 3.12Å; D471-S473 VanDerWaalsContact O-N 3.17Å; D471-S473 WeakPolarHBondContact OD1-CB 3.43Å; D471-S473 PolarHBondContact OD1-N 2.96Å; D471-S473 PolarHBondContact OD1-OG 3.38Å; D471-S473 PolarHBondContact OD2-OG 3.47Å
474	K	52.4	Low	70.2	Confident	141 Å²	141	48.9 Å²	48.9	61%	0.613	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-125.4	34.3	178.9	-59.9	179.8	-173.6	169.9	0	111.8	S469 D471 V472 S476	S469-K474 PolarHBondContact OG-O 3.23Å; D471-K474 HydrophobicContact CB-CB 4.28Å; D471-K474 CarbonylContact O-C 3.42Å; D471-K474 PolarHBondContact O-N 3.08Å; D471-K474 WeakPolarHBondContact OD2-CD 3.44Å; D471-K474 WeakPolarHBondContact OD2-CE 3.15Å; D471-K474 IonicContact OD2-NZ 3.32Å; V472-K474 PolarHBondContact O-N 3.5Å; K474-S476 PolarHBondContact O-N 2.71Å
475	A	58.8	Low	72	Confident	35 Å²	35	45.1 Å²	45.1	29%	0.289	27%	0.274	S	S	.	.			trans	-57.4	124.3	178.3	0	0	0	0	0	110.2	D471	D471-A475 PolarHBondContact O-N 3.42Å
476	S	74.8	Confident	73.9	Confident	20 Å²	20	44.4 Å²	44.4	14%	0.14	27%	0.265	C	S	.	.			trans	-74	154.7	176.8	71.6	0	0	0	0	110.1	K474 L478 Q479 D480	K474-S476 PolarHBondContact O-N 2.71Å; S476-L478 PolarHBondContact O-N 2.87Å; S476-L478 VanDerWaalsContact O-N 3.1Å; S476-Q479 WeakPolarHBondContact O-CA 3.35Å; S476-Q479 WeakPolarHBondContact O-CB 3.43Å; S476-Q479 PolarHBondContact O-N 3.13Å; S476-Q479 PolarHBondContact OG-N 3.2Å; S476-D480 PolarHBondContact O-N 3.15Å; S476-D480 VanDerWaalsContact O-N 3.17Å
477	A	81.5	Confident	75.6	Confident	19 Å²	19	47.4 Å²	47.4	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-55.2	-30.4	173.9	0	0	0	0	0	112.4	L424 D480 M481	L424-A477 HydrophobicContact CD1-CB 4.07Å; L424-A477 HydrophobicContact CD2-CB 4.02Å; L424-A477 HydrophobicContact CG-CB 4.02Å; A477-D480 PolarHBondContact O-N 3.23Å; A477-M481 WeakPolarHBondContact O-CG 3.46Å; A477-M481 PolarHBondContact O-N 2.93Å; A477-M481 VanDerWaalsContact O-N 3.1Å
478	L	84.5	Confident	76.9	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-39.8	174.5	-175.3	68.1	0	0	0	112.5	L453 F468 S476 M481 M482 Y509	L453-L478 HydrophobicContact CD1-CD1 3.48Å; L453-L478 VanDerWaalsContact CD1-CD1 3.48Å; F468-L478 HydrophobicContact CE1-CD2 4.21Å; F468-L478 HydrophobicContact CE1-CG 4.1Å; F468-L478 HydrophobicContact CZ-CD2 4Å; F468-L478 HydrophobicContact CZ-CG 4.16Å; S476-L478 PolarHBondContact O-N 2.87Å; S476-L478 VanDerWaalsContact O-N 3.1Å; L478-M481 HydrophobicContact CD1-CE 4.21Å; L478-M481 PolarHBondContact O-N 3.08Å; L478-M482 WeakPolarHBondContact O-CG 3.42Å; L478-M482 PolarHBondContact O-N 2.87Å; L478-Y509 HydrophobicContact CD1-CE1 3.93Å; L478-Y509 HydrophobicContact CD1-CE2 4.47Å; L478-Y509 WeakPolarHBondContact CD1-OH 3.32Å; L478-Y509 HydrophobicContact CD2-CD1 4.35Å; L478-Y509 HydrophobicContact CD2-CE1 3.73Å; L478-Y509 HydrophobicContact CG-CE1 4.21Å
479	Q	86.6	Confident	77.8	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-40.9	175.8	-168.4	172.3	-6.9	0	0	111.6	F468 S476 M482 R483 F512 E516	F468-Q479 HydrophobicContact CD1-CB 4.02Å; F468-Q479 HydrophobicContact CD1-CG 4.16Å; F468-Q479 HydrophobicContact CE1-CB 4.33Å; S476-Q479 WeakPolarHBondContact O-CA 3.35Å; S476-Q479 WeakPolarHBondContact O-CB 3.43Å; S476-Q479 PolarHBondContact O-N 3.13Å; S476-Q479 PolarHBondContact OG-N 3.2Å; Q479-M482 PolarHBondContact O-N 3.17Å; Q479-R483 WeakPolarHBondContact O-CB 3.5Å; Q479-R483 PolarHBondContact O-N 3.37Å; Q479-F512 HydrophobicContact CG-CD2 4.21Å; Q479-F512 HydrophobicContact CG-CE2 3.88Å; Q479-E516 PolarHBondContact NE2-OE1 3.45Å
480	D	88.1	Confident	79.5	Confident	42 Å²	42	42.1 Å²	42.1	23%	0.225	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-43.4	174.8	-73.3	-19	0	0	0	112.1	R428 S476 A477 R483 T484	R428-D480 IonicContact CZ-OD2 3.93Å; R428-D480 IonicContact NH1-OD2 2.91Å; R428-D480 IonicContact NH2-OD2 2.62Å; R428-D480 PolarHBondContact NH2-OD2 3Å; S476-D480 PolarHBondContact O-N 3.15Å; S476-D480 VanDerWaalsContact O-N 3.17Å; A477-D480 PolarHBondContact O-N 3.23Å; D480-R483 PolarHBondContact O-N 3.14Å; D480-T484 WeakPolarHBondContact O-CB 3.3Å; D480-T484 PolarHBondContact O-N 2.91Å; D480-T484 PolarHBondContact O-OG1 3.38Å
481	M	92.1	Very high	81.2	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-43.1	176.6	-72.3	-171.9	-69.9	0	0	111.5	L424 V427 R428 F431 L453 L456 A477 L478 T484 L485	L424-M481 HydrophobicContact CD1-CE 3.82Å; V427-M481 HydrophobicContact CG1-SD 4.37Å; R428-M481 VanDerWaalsContact CA-SD 3.58Å; R428-M481 HydrophobicContact CB-SD 3.97Å; R428-M481 HydrophobicContact CG-CG 4.29Å; R428-M481 HydrophobicContact CG-SD 4.28Å; F431-M481 HydrophobicContact CB-SD 4.12Å; F431-M481 HydrophobicContact CD1-CB 3.94Å; F431-M481 HydrophobicContact CD1-CG 3.69Å; F431-M481 HydrophobicContact CD1-SD 4.1Å; F431-M481 HydrophobicContact CE1-CB 3.85Å; F431-M481 HydrophobicContact CE1-CG 4.11Å; F431-M481 WeakPolarHBondContact CE1-O 3.37Å; F431-M481 HydrophobicContact CG-CG 4.36Å; F431-M481 HydrophobicContact CG-SD 4.17Å; L453-M481 HydrophobicContact CD1-CB 3.92Å; L453-M481 HydrophobicContact CD1-CE 3.89Å; L453-M481 HydrophobicContact CD1-SD 4.18Å; L453-M481 HydrophobicContact CD2-CB 4.18Å; L456-M481 HydrophobicContact CD1-CE 3.75Å; A477-M481 WeakPolarHBondContact O-CG 3.46Å; A477-M481 PolarHBondContact O-N 2.93Å; A477-M481 VanDerWaalsContact O-N 3.1Å; L478-M481 HydrophobicContact CD1-CE 4.21Å; L478-M481 PolarHBondContact O-N 3.08Å; M481-T484 WeakPolarHBondContact O-CB 3.44Å; M481-T484 PolarHBondContact O-N 2.91Å; M481-L485 PolarHBondContact O-N 2.96Å
482	M	92.6	Very high	82.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.5	-43.2	175.3	-78.7	-56.4	-58.3	0	0	112.5	L453 F468 L478 Q479 T484 L485 V486 T505 Y509 F512	L453-M482 HydrophobicContact CD2-SD 4.07Å; F468-M482 HydrophobicContact CE1-CB 4.47Å; F468-M482 HydrophobicContact CE1-CG 4.1Å; F468-M482 HydrophobicContact CZ-CG 4Å; L478-M482 WeakPolarHBondContact O-CG 3.42Å; L478-M482 PolarHBondContact O-N 2.87Å; Q479-M482 PolarHBondContact O-N 3.17Å; M482-T484 VanDerWaalsContact C-N 3.27Å; M482-T484 PolarHBondContact O-N 3.39Å; M482-L485 HydrophobicContact CE-CD2 4.24Å; M482-L485 WeakPolarHBondContact O-CB 3.42Å; M482-L485 PolarHBondContact O-N 3.34Å; M482-L485 HydrophobicContact SD-CD2 4.1Å; M482-V486 WeakPolarHBondContact O-CG2 3.31Å; M482-V486 PolarHBondContact O-N 3.2Å; M482-T505 HydrophobicContact SD-CG2 4.26Å; M482-Y509 HydrophobicContact CE-CD2 4.29Å; M482-Y509 HydrophobicContact CE-CG 4.34Å; M482-Y509 HydrophobicContact CG-CD2 4.29Å; M482-Y509 HydrophobicContact CG-CG 4.21Å; M482-Y509 HydrophobicContact SD-CD2 3.39Å; M482-Y509 WeakPolarHBondContact SD-CD2 3.26Å; M482-Y509 HydrophobicContact SD-CE2 4.16Å; M482-Y509 HydrophobicContact SD-CG 3.76Å; M482-F512 HydrophobicContact CB-CD1 4.36Å; M482-F512 HydrophobicContact CB-CD2 3.93Å; M482-F512 HydrophobicContact CB-CE1 4.43Å; M482-F512 HydrophobicContact CB-CE2 4.01Å; M482-F512 HydrophobicContact CB-CG 4.11Å; M482-F512 HydrophobicContact CB-CZ 4.26Å; M482-F512 HydrophobicContact CE-CD1 4.44Å
483	R	92.2	Very high	84.8	Confident	79 Å²	79	36 Å²	36	30%	0.298	21%	0.213	S	C	.	.	H	α-helix	trans	-59.3	-42	174.4	-169.7	-175.9	-64.6	147.6	1.9	111	Q479 D480 V486 T487 F512 E516	Q479-R483 WeakPolarHBondContact O-CB 3.5Å; Q479-R483 PolarHBondContact O-N 3.37Å; D480-R483 PolarHBondContact O-N 3.14Å; R483-V486 WeakPolarHBondContact O-CG2 3.41Å; R483-T487 WeakPolarHBondContact O-CB 3.39Å; R483-T487 VanDerWaalsContact O-CG2 3.31Å; R483-T487 WeakPolarHBondContact O-CG2 3.48Å; R483-T487 PolarHBondContact O-N 3.23Å; R483-T487 VanDerWaalsContact O-N 3.17Å; R483-T487 PolarHBondContact O-OG1 3.05Å; R483-F512 HydrophobicContact CB-CZ 4.41Å; R483-E516 IonicContact CZ-OE1 2.7Å; R483-E516 IonicContact CZ-OE2 3.16Å; R483-E516 IonicContact NE-OE1 3.26Å; R483-E516 IonicContact NE-OE2 3.3Å; R483-E516 PolarHBondContact NE-OE2 3.06Å; R483-E516 IonicContact NH2-OE1 3.38Å; R483-E516 PolarHBondContact NH2-OE1 3.49Å; R483-E516 IonicContact NH2-OE2 3.18Å
484	T	93.9	Very high	86.7	Confident	53 Å²	53	39.9 Å²	39.9	33%	0.325	22%	0.22	S	C	.	.	H	α-helix	trans	-64.8	-45	176.2	-55.2	0	0	0	0	111.2	F431 L435 D480 M481 M482 V486 T487 S488	F431-T484 HydrophobicContact CE1-CG2 4.16Å; L435-T484 HydrophobicContact CB-CG2 4.33Å; D480-T484 WeakPolarHBondContact O-CB 3.3Å; D480-T484 PolarHBondContact O-N 2.91Å; D480-T484 PolarHBondContact O-OG1 3.38Å; M481-T484 WeakPolarHBondContact O-CB 3.44Å; M481-T484 PolarHBondContact O-N 2.91Å; M482-T484 VanDerWaalsContact C-N 3.27Å; M482-T484 PolarHBondContact O-N 3.39Å; T484-V486 PolarHBondContact O-N 3.39Å; T484-T487 PolarHBondContact O-N 2.93Å; T484-T487 PolarHBondContact O-OG1 2.71Å; T484-S488 WeakPolarHBondContact O-CB 3.18Å; T484-S488 PolarHBondContact O-N 3.39Å; T484-S488 PolarHBondContact O-OG 2.95Å
485	L	95.1	Very high	88.6	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-55.1	-51.5	178.2	-173.4	69	0	0	0	111.5	F431 I450 L453 M481 M482 T487 S488 V490 F502 T505 V506	F431-L485 HydrophobicContact CE2-CD1 4.18Å; F431-L485 HydrophobicContact CZ-CB 4Å; F431-L485 HydrophobicContact CZ-CD1 4.11Å; I450-L485 HydrophobicContact CD1-CD1 4.24Å; I450-L485 HydrophobicContact CG1-CD1 3.99Å; I450-L485 HydrophobicContact CG2-CD1 4.15Å; L453-L485 HydrophobicContact CD2-CD2 4.19Å; M481-L485 PolarHBondContact O-N 2.96Å; M482-L485 HydrophobicContact CE-CD2 4.24Å; M482-L485 WeakPolarHBondContact O-CB 3.42Å; M482-L485 PolarHBondContact O-N 3.34Å; M482-L485 HydrophobicContact SD-CD2 4.1Å; L485-T487 VanDerWaalsContact C-N 3.34Å; L485-T487 PolarHBondContact O-N 3.03Å; L485-S488 PolarHBondContact O-OG 3.46Å; L485-V490 HydrophobicContact CD1-CG1 3.9Å; L485-F502 HydrophobicContact CD1-CD2 4.03Å; L485-F502 HydrophobicContact CD2-CD2 4.39Å; L485-F502 HydrophobicContact CG-CD2 4Å; L485-F502 HydrophobicContact CG-CE2 4.05Å; L485-T505 HydrophobicContact CD2-CG2 3.61Å; L485-V506 HydrophobicContact CD2-CG2 4.3Å
486	V	93.6	Very high	90.2	Very high	7 Å²	7	35.6 Å²	35.6	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-74.9	-20.6	-175.1	-57.6	0	0	0	0	113.9	M482 R483 T484 F512 F513 H519 C522 V523	M482-V486 WeakPolarHBondContact O-CG2 3.31Å; M482-V486 PolarHBondContact O-N 3.2Å; R483-V486 WeakPolarHBondContact O-CG2 3.41Å; T484-V486 PolarHBondContact O-N 3.39Å; V486-F512 HydrophobicContact CG2-CE1 4.41Å; V486-F513 HydrophobicContact CG1-CE1 4.28Å; V486-F513 HydrophobicContact CG1-CZ 4.07Å; V486-H519 HydrophobicContact CG2-CB 3.96Å; V486-C522 PolarHBondContact O-SG 3.42Å; V486-C522 VanDerWaalsContact O-SG 3.41Å; V486-V523 HydrophobicContact CB-CG2 4.25Å; V486-V523 HydrophobicContact CG1-CG2 3.88Å
487	T	92.6	Very high	91.1	Very high	89 Å²	89	35.2 Å²	35.2	55%	0.546	20%	0.196	S	C	.	.	H	α-helix	trans	-101	-20.6	-179.6	57.7	0	0	0	0	114.1	R483 T484 L485 G489	R483-T487 WeakPolarHBondContact O-CB 3.39Å; R483-T487 VanDerWaalsContact O-CG2 3.31Å; R483-T487 WeakPolarHBondContact O-CG2 3.48Å; R483-T487 PolarHBondContact O-N 3.23Å; R483-T487 VanDerWaalsContact O-N 3.17Å; R483-T487 PolarHBondContact O-OG1 3.05Å; T484-T487 PolarHBondContact O-N 2.93Å; T484-T487 PolarHBondContact O-OG1 2.71Å; L485-T487 VanDerWaalsContact C-N 3.34Å; L485-T487 PolarHBondContact O-N 3.03Å; T487-G489 PolarHBondContact O-N 3.39Å
488	S	92.1	Very high	91.7	Very high	28 Å²	28	34.3 Å²	34.3	20%	0.196	19%	0.189	C	C	.	.	S	Bend	trans	-62.9	-23.7	-177.4	62.4	0	0	0	0	114.6	W438 T484 L485 V490	W438-S488 PolarHBondContact NE1-O 2.96Å; T484-S488 WeakPolarHBondContact O-CB 3.18Å; T484-S488 PolarHBondContact O-N 3.39Å; T484-S488 PolarHBondContact O-OG 2.95Å; L485-S488 PolarHBondContact O-OG 3.46Å; S488-V490 VanDerWaalsContact C-N 3.3Å; S488-V490 WeakPolarHBondContact OG-CB 3.18Å; S488-V490 WeakPolarHBondContact OG-CG1 3.37Å; S488-V490 PolarHBondContact OG-N 3.4Å
489	G	90.3	Very high	92.2	Very high	26 Å²	26	34.2 Å²	34.2	27%	0.268	19%	0.188	S	C	.	.			trans	79.9	7	-173	0	0	0	0	0	114.5	T487 S491 S492	T487-G489 PolarHBondContact O-N 3.39Å; G489-S491 PolarHBondContact O-N 2.86Å; G489-S492 PolarHBondContact O-N 3.41Å; G489-S492 PolarHBondContact O-OG 2.66Å
490	V	93.4	Very high	92.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-58.6	-19.1	-179	75.1	0	0	0	0	113.7	L435 W438 V446 I450 L485 S488 S492 Y493 V498 F502	L435-V490 HydrophobicContact CD1-CB 3.87Å; L435-V490 HydrophobicContact CD1-CG1 4.02Å; L435-V490 HydrophobicContact CD1-CG2 3.96Å; W438-V490 HydrophobicContact CB-CG2 4.48Å; W438-V490 HydrophobicContact CD2-CB 4.47Å; W438-V490 HydrophobicContact CD2-CG2 4.36Å; W438-V490 HydrophobicContact CG-CG2 4.39Å; V446-V490 HydrophobicContact CG1-CG2 3.73Å; I450-V490 HydrophobicContact CD1-CG1 4.22Å; I450-V490 HydrophobicContact CD1-CG2 4.06Å; L485-V490 HydrophobicContact CD1-CG1 3.9Å; S488-V490 VanDerWaalsContact C-N 3.3Å; S488-V490 WeakPolarHBondContact OG-CB 3.18Å; S488-V490 WeakPolarHBondContact OG-CG1 3.37Å; S488-V490 PolarHBondContact OG-N 3.4Å; V490-S492 PolarHBondContact O-N 2.64Å; V490-S492 VanDerWaalsContact O-N 3.07Å; V490-Y493 VanDerWaalsContact O-CB 3.24Å; V490-Y493 WeakPolarHBondContact O-CB 3.42Å; V490-Y493 PolarHBondContact O-N 3.04Å; V490-V498 HydrophobicContact CG2-CG1 4.19Å; V490-F502 HydrophobicContact CG1-CD2 3.83Å; V490-F502 HydrophobicContact CG1-CE2 4.32Å
491	S	92.4	Very high	93	Very high	5 Å²	5	34 Å²	34	4%	0.035	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-60.8	-14.7	172.4	60.6	0	0	0	0	114.5	G489 R531	G489-S491 PolarHBondContact O-N 2.86Å; S491-R531 WeakPolarHBondContact O-CD 3.46Å; S491-R531 WeakPolarHBondContact O-CG 3.4Å; S491-R531 PolarHBondContact OG-NH1 3.3Å
492	S	91.8	Very high	93.3	Very high	62 Å²	62	34.2 Å²	34.2	43%	0.434	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-90.2	2.3	174.4	63.2	0	0	0	0	114.1	W438 G489 V490	W438-S492 WeakPolarHBondContact CH2-OG 3.44Å; G489-S492 PolarHBondContact O-N 3.41Å; G489-S492 PolarHBondContact O-OG 2.66Å; V490-S492 PolarHBondContact O-N 2.64Å; V490-S492 VanDerWaalsContact O-N 3.07Å
493	Y	93.7	Very high	93.5	Very high	42 Å²	42	34.2 Å²	34.2	17%	0.165	19%	0.187	C	C	.	.			trans	-61.4	137.4	175.6	-155.1	-84.4	0	0	0	110.8	W438 T441 F443 V446 V490 H495 V498 T499	W438-Y493 AromaticContact CE3-CD2 3.58Å; W438-Y493 HydrophobicContact CE3-CD2 3.58Å; W438-Y493 HydrophobicContact CE3-CE2 4.15Å; W438-Y493 AromaticContact CZ3-CD2 3.78Å; W438-Y493 HydrophobicContact CZ3-CD2 3.78Å; W438-Y493 WeakPolarHBondContact O-CE2 3.41Å; T441-Y493 PolarHBondContact O-OH 3.46Å; T441-Y493 VanDerWaalsContact O-OH 3.07Å; F443-Y493 WeakPolarHBondContact CA-OH 3.49Å; F443-Y493 HydrophobicContact CB-CE1 3.51Å; F443-Y493 PolarHBondContact N-OH 2.62Å; F443-Y493 VanDerWaalsContact N-OH 3.12Å; V446-Y493 HydrophobicContact CG2-CE2 4.24Å; V490-Y493 VanDerWaalsContact O-CB 3.24Å; V490-Y493 WeakPolarHBondContact O-CB 3.42Å; V490-Y493 PolarHBondContact O-N 3.04Å; Y493-H495 HydrophobicContact CD1-CB 3.76Å; Y493-H495 HydrophobicContact CE1-CB 3.68Å; Y493-V498 HydrophobicContact CD1-CB 3.85Å; Y493-V498 HydrophobicContact CD1-CG1 4.06Å; Y493-V498 HydrophobicContact CD1-CG2 3.8Å; Y493-V498 HydrophobicContact CE1-CG2 4.07Å; Y493-V498 HydrophobicContact CG-CB 4.18Å; Y493-V498 HydrophobicContact CG-CG1 3.87Å; Y493-V498 HydrophobicContact CG-CG2 4.37Å; Y493-T499 PolarHBondContact O-OG1 2.66Å
494	Q	88.1	Confident	93.7	Very high	184 Å²	184	31.5 Å²	31.5	86%	0.86	18%	0.178	S	C	*	.	S	Bend	trans	-77.7	-27.3	-170.1	-65.7	-174.6	-6.1	0	0	114
495	H	92.7	Very high	93.7	Very high	47 Å²	47	29 Å²	29	22%	0.218	16%	0.163	C	C	.	.	S	Bend	trans	-74.8	127.3	-176.9	-162.3	-79.8	0	0	0	112.1	F391 F443 Y493 S497 V498 T499	F391-H495 AromaticContact CD2-CE1 3.83Å; F391-H495 AromaticContact CD2-NE2 3.89Å; F391-H495 AromaticContact CE2-CE1 3.78Å; F391-H495 AromaticContact CE2-NE2 3.99Å; F391-H495 AromaticContact CZ-CE1 3.94Å; F443-H495 HydrophobicContact CB-CB 3.85Å; F443-H495 AromaticContact CD1-CD2 3.91Å; F443-H495 HydrophobicContact CD2-CB 4.48Å; F443-H495 AromaticContact CD2-CD2 3.88Å; F443-H495 AromaticContact CD2-CE1 3.61Å; F443-H495 AromaticContact CD2-CG 3.71Å; F443-H495 AromaticContact CD2-ND1 3.53Å; F443-H495 AromaticContact CD2-NE2 3.84Å; F443-H495 AromaticContact CE2-CE1 3.54Å; F443-H495 AromaticContact CE2-ND1 3.96Å; F443-H495 AromaticContact CE2-NE2 3.72Å; F443-H495 HydrophobicContact CG-CB 4.21Å; F443-H495 AromaticContact CG-CD2 3.73Å; F443-H495 AromaticContact CG-CG 3.72Å; F443-H495 AromaticContact CZ-NE2 3.85Å; Y493-H495 HydrophobicContact CD1-CB 3.76Å; Y493-H495 HydrophobicContact CE1-CB 3.68Å; H495-S497 VanDerWaalsContact C-N 3.32Å; H495-S497 PolarHBondContact CE1-OG 3.23Å; H495-S497 VanDerWaalsContact CE1-OG 3.24Å; H495-S497 PolarHBondContact ND1-N 3.33Å; H495-S497 PolarHBondContact ND1-OG 3.16Å; H495-S497 PolarHBondContact O-N 3.37Å; H495-V498 HydrophobicContact CB-CG2 4.41Å; H495-V498 PolarHBondContact O-N 2.71Å; H495-V498 VanDerWaalsContact O-N 3.11Å; H495-T499 PolarHBondContact O-N 3.23Å; H495-T499 PolarHBondContact O-OG1 2.98Å
496	T	92.6	Very high	93.7	Very high	39 Å²	39	29 Å²	29	24%	0.239	16%	0.163	C	C	.	.	H	α-helix	trans	-55.9	-41	-173.8	52.4	0	0	0	0	113.3	V498 T499 L500 V540	T496-V498 PolarHBondContact O-N 3.17Å; T496-T499 PolarHBondContact O-N 3.16Å; T496-L500 WeakPolarHBondContact O-CB 3.38Å; T496-L500 WeakPolarHBondContact O-CG 3.41Å; T496-L500 PolarHBondContact O-N 3.32Å; T496-V540 HydrophobicContact CG2-CG2 3.86Å
497	S	92.9	Very high	93.8	Very high	12 Å²	12	28.6 Å²	28.6	8%	0.084	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-41.5	179.2	-45.1	0	0	0	0	112.8	F391 H495 E501	F391-S497 VanDerWaalsContact CD1-OG 3.25Å; F391-S497 WeakPolarHBondContact CD1-OG 3.48Å; F391-S497 WeakPolarHBondContact CE1-OG 3.34Å; H495-S497 VanDerWaalsContact C-N 3.32Å; H495-S497 PolarHBondContact CE1-OG 3.23Å; H495-S497 VanDerWaalsContact CE1-OG 3.24Å; H495-S497 PolarHBondContact ND1-N 3.33Å; H495-S497 PolarHBondContact ND1-OG 3.16Å; H495-S497 PolarHBondContact O-N 3.37Å; S497-E501 VanDerWaalsContact O-CB 3.31Å; S497-E501 WeakPolarHBondContact O-CB 3.42Å; S497-E501 PolarHBondContact O-N 3.16Å
498	V	95.4	Very high	93.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.1	-43.5	176.9	177.7	0	0	0	0	110.1	F443 V446 E447 I450 V490 Y493 H495 T496 E501 F502	F443-V498 HydrophobicContact CB-CG2 4.02Å; V446-V498 HydrophobicContact CB-CG2 4.36Å; V446-V498 HydrophobicContact CG1-CG1 3.78Å; V446-V498 HydrophobicContact CG1-CG2 4.34Å; E447-V498 HydrophobicContact CB-CG2 3.98Å; I450-V498 HydrophobicContact CD1-CG1 3.97Å; V490-V498 HydrophobicContact CG2-CG1 4.19Å; Y493-V498 HydrophobicContact CD1-CB 3.85Å; Y493-V498 HydrophobicContact CD1-CG1 4.06Å; Y493-V498 HydrophobicContact CD1-CG2 3.8Å; Y493-V498 HydrophobicContact CE1-CG2 4.07Å; Y493-V498 HydrophobicContact CG-CB 4.18Å; Y493-V498 HydrophobicContact CG-CG1 3.87Å; Y493-V498 HydrophobicContact CG-CG2 4.37Å; H495-V498 HydrophobicContact CB-CG2 4.41Å; H495-V498 PolarHBondContact O-N 2.71Å; H495-V498 VanDerWaalsContact O-N 3.11Å; T496-V498 PolarHBondContact O-N 3.17Å; V498-E501 PolarHBondContact O-N 3.3Å; V498-F502 WeakPolarHBondContact O-CB 3.3Å; V498-F502 PolarHBondContact O-N 2.97Å
499	T	94.9	Very high	93.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-61.5	-45.7	178.4	-46.9	0	0	0	0	111.7	Y493 H495 T496 F502 F503 R531 V540	Y493-T499 PolarHBondContact O-OG1 2.66Å; H495-T499 PolarHBondContact O-N 3.23Å; H495-T499 PolarHBondContact O-OG1 2.98Å; T496-T499 PolarHBondContact O-N 3.16Å; T499-F502 PolarHBondContact O-N 2.92Å; T499-F503 HydrophobicContact CG2-CD2 4.07Å; T499-F503 HydrophobicContact CG2-CE2 3.72Å; T499-F503 WeakPolarHBondContact O-CD2 3.35Å; T499-F503 PolarHBondContact O-N 2.87Å; T499-R531 WeakPolarHBondContact CG2-O 3.47Å; T499-V540 HydrophobicContact CG2-CG1 4.12Å
500	L	95.4	Very high	93.6	Very high	29 Å²	29	26.7 Å²	26.7	15%	0.152	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-49.2	176.7	-73.3	174	0	0	0	111.3	T496 F502 F503 E504 V540 R543	T496-L500 WeakPolarHBondContact O-CB 3.38Å; T496-L500 WeakPolarHBondContact O-CG 3.41Å; T496-L500 PolarHBondContact O-N 3.32Å; L500-F502 VanDerWaalsContact C-N 3.28Å; L500-F502 PolarHBondContact O-N 3.34Å; L500-F503 PolarHBondContact O-N 3.22Å; L500-F503 VanDerWaalsContact O-N 3.14Å; L500-E504 WeakPolarHBondContact O-CG 3.31Å; L500-E504 PolarHBondContact O-N 3.05Å; L500-V540 HydrophobicContact CD2-CB 4.46Å; L500-V540 HydrophobicContact CD2-CG1 4.43Å; L500-V540 HydrophobicContact CD2-CG2 4.29Å; L500-V540 HydrophobicContact CG-CG2 4.2Å; L500-R543 HydrophobicContact CD2-CB 3.7Å; L500-R543 HydrophobicContact CD2-CG 3.86Å
501	E	96.2	Very high	93.4	Very high	10 Å²	10	32.9 Å²	32.9	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-62.2	-35.9	-179.3	-164.7	65.9	-141.6	0	0	111.7	I450 R451 Y454 S497 V498 T505	I450-E501 HydrophobicContact CB-CG 4Å; I450-E501 HydrophobicContact CG2-CB 4.29Å; I450-E501 HydrophobicContact CG2-CG 3.76Å; R451-E501 WeakPolarHBondContact CA-OE1 3.35Å; R451-E501 HydrophobicContact CB-CG 4.02Å; R451-E501 IonicContact CZ-OE2 2.68Å; R451-E501 VanDerWaalsContact CZ-OE2 3.28Å; R451-E501 IonicContact NE-OE1 3.96Å; R451-E501 IonicContact NE-OE2 3.41Å; R451-E501 PolarHBondContact NE-OE2 3.39Å; R451-E501 IonicContact NH2-OE2 3.34Å; R451-E501 PolarHBondContact NH2-OE2 3.14Å; Y454-E501 VanDerWaalsContact CB-OE1 3.29Å; Y454-E501 WeakPolarHBondContact CB-OE1 3.33Å; S497-E501 VanDerWaalsContact O-CB 3.31Å; S497-E501 WeakPolarHBondContact O-CB 3.42Å; S497-E501 PolarHBondContact O-N 3.16Å; V498-E501 PolarHBondContact O-N 3.3Å; E501-T505 VanDerWaalsContact O-CB 3.29Å; E501-T505 WeakPolarHBondContact O-CB 3.42Å; E501-T505 PolarHBondContact O-N 3.1Å; E501-T505 PolarHBondContact O-OG1 3.12Å
502	F	97	Very high	93.3	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-52.4	171.8	169.4	-93.2	0	0	0	111.9	L485 V490 V498 T499 L500 T505 V506 A526	L485-F502 HydrophobicContact CD1-CD2 4.03Å; L485-F502 HydrophobicContact CD2-CD2 4.39Å; L485-F502 HydrophobicContact CG-CD2 4Å; L485-F502 HydrophobicContact CG-CE2 4.05Å; V490-F502 HydrophobicContact CG1-CD2 3.83Å; V490-F502 HydrophobicContact CG1-CE2 4.32Å; V498-F502 WeakPolarHBondContact O-CB 3.3Å; V498-F502 PolarHBondContact O-N 2.97Å; T499-F502 PolarHBondContact O-N 2.92Å; L500-F502 VanDerWaalsContact C-N 3.28Å; L500-F502 PolarHBondContact O-N 3.34Å; F502-T505 PolarHBondContact O-N 3.38Å; F502-V506 HydrophobicContact CD1-CG2 4.49Å; F502-V506 HydrophobicContact CD2-CG2 4.38Å; F502-V506 HydrophobicContact CE1-CG2 4.05Å; F502-V506 HydrophobicContact CE2-CG2 3.94Å; F502-V506 HydrophobicContact CZ-CG2 3.75Å; F502-V506 WeakPolarHBondContact O-CB 3.47Å; F502-V506 WeakPolarHBondContact O-CG2 3.44Å; F502-V506 PolarHBondContact O-N 3.45Å; F502-A526 HydrophobicContact CE1-CB 4.48Å
503	F	97.3	Very high	93.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67	-39	-178.5	-74	-64.9	0	0	0	112.2	T499 L500 T505 V506 V507 A526 F527 R531 T544 L547	T499-F503 HydrophobicContact CG2-CD2 4.07Å; T499-F503 HydrophobicContact CG2-CE2 3.72Å; T499-F503 WeakPolarHBondContact O-CD2 3.35Å; T499-F503 PolarHBondContact O-N 2.87Å; L500-F503 PolarHBondContact O-N 3.22Å; L500-F503 VanDerWaalsContact O-N 3.14Å; F503-T505 VanDerWaalsContact C-N 3.34Å; F503-T505 PolarHBondContact O-N 2.84Å; F503-V506 PolarHBondContact O-N 2.91Å; F503-V507 WeakPolarHBondContact O-CG2 3.4Å; F503-V507 PolarHBondContact O-N 2.63Å; F503-A526 HydrophobicContact CE1-CB 4.17Å; F503-A526 HydrophobicContact CZ-CB 4.24Å; F503-A526 WeakPolarHBondContact CZ-O 3.48Å; F503-F527 HydrophobicContact CB-CE1 4.36Å; F503-F527 AromaticContact CD1-CD1 3.69Å; F503-F527 HydrophobicContact CD1-CD1 3.69Å; F503-F527 HydrophobicContact CD1-CD2 4.27Å; F503-F527 AromaticContact CD1-CE1 3.3Å; F503-F527 HydrophobicContact CD1-CE1 3.3Å; F503-F527 AromaticContact CD1-CE2 3.94Å; F503-F527 HydrophobicContact CD1-CE2 3.94Å; F503-F527 HydrophobicContact CD1-CG 4.16Å; F503-F527 AromaticContact CD1-CZ 3.44Å; F503-F527 HydrophobicContact CD1-CZ 3.44Å; F503-F527 VanDerWaalsContact CD1-CZ 3.44Å; F503-F527 HydrophobicContact CE1-CB 4.47Å; F503-F527 AromaticContact CE1-CD1 3.6Å; F503-F527 HydrophobicContact CE1-CD1 3.6Å; F503-F527 HydrophobicContact CE1-CD2 4.07Å; F503-F527 AromaticContact CE1-CE1 3.75Å; F503-F527 HydrophobicContact CE1-CE1 3.75Å; F503-F527 HydrophobicContact CE1-CE2 4.2Å; F503-F527 AromaticContact CE1-CG 3.77Å; F503-F527 HydrophobicContact CE1-CG 3.77Å; F503-F527 HydrophobicContact CE1-CZ 4.05Å; F503-F527 HydrophobicContact CG-CE1 4.04Å; F503-F527 HydrophobicContact CG-CZ 4.36Å; F503-F527 HydrophobicContact CZ-CD1 4.45Å; F503-R531 WeakPolarHBondContact CE2-O 3.5Å; F503-T544 HydrophobicContact CD2-CG2 3.45Å; F503-T544 VanDerWaalsContact CD2-CG2 3.45Å; F503-T544 HydrophobicContact CE2-CG2 3.69Å; F503-T544 HydrophobicContact CG-CG2 4Å; F503-T544 HydrophobicContact CZ-CG2 4.39Å; F503-L547 HydrophobicContact CB-CD1 3.67Å
504	E	96.2	Very high	93	Very high	23 Å²	23	31.4 Å²	31.4	11%	0.107	15%	0.152	C	C	.	.	H	α-helix	trans	-57.7	-47.6	174	-73.2	-67.7	173.2	0	0	111.6	Y454 L500 V507 R508 R543 L547	Y454-E504 HydrophobicContact CD2-CB 4.01Å; Y454-E504 HydrophobicContact CE2-CB 3.74Å; L500-E504 WeakPolarHBondContact O-CG 3.31Å; L500-E504 PolarHBondContact O-N 3.05Å; E504-V507 PolarHBondContact O-N 3.35Å; E504-R508 WeakPolarHBondContact O-CB 3.39Å; E504-R508 PolarHBondContact O-N 3.4Å; E504-R543 IonicContact OE1-CZ 3.77Å; E504-R543 IonicContact OE1-NE 2.6Å; E504-R543 PolarHBondContact OE1-NE 3.38Å; E504-R543 IonicContact OE1-NH2 2.73Å; E504-R543 PolarHBondContact OE1-NH2 3.3Å; E504-R543 IonicContact OE2-NH2 2.79Å; E504-R543 PolarHBondContact OE2-NH2 3.18Å; E504-L547 HydrophobicContact CG-CD1 4.17Å
505	T	95.2	Very high	93	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-46.5	179.7	-57.1	0	0	0	0	111.4	I450 L453 M482 L485 E501 F502 F503 V507 R508 Y509	I450-T505 HydrophobicContact CG2-CG2 4.38Å; I450-T505 WeakPolarHBondContact CG2-OG1 3.4Å; L453-T505 HydrophobicContact CD2-CG2 4.02Å; L453-T505 HydrophobicContact CG-CG2 4.01Å; M482-T505 HydrophobicContact SD-CG2 4.26Å; L485-T505 HydrophobicContact CD2-CG2 3.61Å; E501-T505 VanDerWaalsContact O-CB 3.29Å; E501-T505 WeakPolarHBondContact O-CB 3.42Å; E501-T505 PolarHBondContact O-N 3.1Å; E501-T505 PolarHBondContact O-OG1 3.12Å; F502-T505 PolarHBondContact O-N 3.38Å; F503-T505 VanDerWaalsContact C-N 3.34Å; F503-T505 PolarHBondContact O-N 2.84Å; T505-V507 PolarHBondContact O-N 3.15Å; T505-R508 PolarHBondContact O-N 3.05Å; T505-Y509 HydrophobicContact CG2-CD2 3.78Å; T505-Y509 HydrophobicContact CG2-CE2 3.93Å; T505-Y509 VanDerWaalsContact O-CD2 3.25Å; T505-Y509 WeakPolarHBondContact O-CD2 3.39Å; T505-Y509 PolarHBondContact O-N 3.33Å
506	V	94.9	Very high	92.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.5	-46.8	177.7	161.3	0	0	0	0	112	L485 F502 F503 Y509 E510 F513 V523 F527 F551	L485-V506 HydrophobicContact CD2-CG2 4.3Å; F502-V506 HydrophobicContact CD1-CG2 4.49Å; F502-V506 HydrophobicContact CD2-CG2 4.38Å; F502-V506 HydrophobicContact CE1-CG2 4.05Å; F502-V506 HydrophobicContact CE2-CG2 3.94Å; F502-V506 HydrophobicContact CZ-CG2 3.75Å; F502-V506 WeakPolarHBondContact O-CB 3.47Å; F502-V506 WeakPolarHBondContact O-CG2 3.44Å; F502-V506 PolarHBondContact O-N 3.45Å; F503-V506 PolarHBondContact O-N 2.91Å; V506-Y509 CarbonylContact O-C 3.47Å; V506-Y509 PolarHBondContact O-N 3.44Å; V506-E510 PolarHBondContact O-N 2.94Å; V506-F513 HydrophobicContact CG1-CE2 3.98Å; V506-F513 HydrophobicContact CG1-CZ 3.94Å; V506-V523 HydrophobicContact CG1-CG1 3.44Å; V506-V523 VanDerWaalsContact CG1-CG1 3.44Å; V506-V523 HydrophobicContact CG1-CG2 4.37Å; V506-F527 HydrophobicContact CG1-CE2 4.34Å; V506-F551 HydrophobicContact CG1-CD2 4.33Å; V506-F551 HydrophobicContact CG1-CE2 3.95Å
507	V	94.6	Very high	92.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-71.7	-38.2	-178.7	176.6	0	0	0	0	111.6	F503 E504 T505 Y509 E510 F527 L547 R550 F551	F503-V507 WeakPolarHBondContact O-CG2 3.4Å; F503-V507 PolarHBondContact O-N 2.63Å; E504-V507 PolarHBondContact O-N 3.35Å; T505-V507 PolarHBondContact O-N 3.15Å; V507-Y509 PolarHBondContact O-N 3.4Å; V507-E510 WeakPolarHBondContact O-CB 3.38Å; V507-E510 WeakPolarHBondContact O-CG 3.21Å; V507-E510 PolarHBondContact O-N 3.4Å; V507-E510 VanDerWaalsContact O-N 3.16Å; V507-F527 HydrophobicContact CG2-CZ 3.78Å; V507-L547 HydrophobicContact CB-CD2 4.16Å; V507-L547 HydrophobicContact CG1-CD2 4.25Å; V507-L547 HydrophobicContact CG2-CB 3.97Å; V507-L547 HydrophobicContact CG2-CD2 4.19Å; V507-R550 HydrophobicContact CG1-CB 4.01Å; V507-R550 HydrophobicContact CG1-CG 3.69Å; V507-F551 HydrophobicContact CG2-CB 4Å; V507-F551 HydrophobicContact CG2-CD2 4.19Å; V507-F551 HydrophobicContact CG2-CG 4.48Å
508	R	92.1	Very high	92.7	Very high	56 Å²	56	28.8 Å²	28.8	21%	0.211	14%	0.144	C	C	.	.	H	α-helix	trans	-58.5	-39.3	174.5	175.8	170	-80.8	-131	-9.1	111.9	Y454 A457 E458 E504 T505 E510	Y454-R508 HydrophobicContact CD2-CB 4.26Å; Y454-R508 VanDerWaalsContact CD2-CD 3.46Å; Y454-R508 HydrophobicContact CE2-CB 4.12Å; Y454-R508 VanDerWaalsContact CE2-CD 3.47Å; Y454-R508 HydrophobicContact CE2-CG 4.44Å; Y454-R508 WeakPolarHBondContact O-CD 3.43Å; Y454-R508 PolarHBondContact O-NH1 3.08Å; Y454-R508 VanDerWaalsContact O-NH1 3.1Å; Y454-R508 PolarHBondContact OH-NE 2.82Å; Y454-R508 PolarHBondContact OH-NH2 3.31Å; A457-R508 HydrophobicContact CB-CG 3.77Å; E458-R508 VanDerWaalsContact CG-NH1 3.31Å; E458-R508 IonicContact OE1-CZ 3.91Å; E458-R508 VanDerWaalsContact OE1-CZ 3.29Å; E458-R508 IonicContact OE1-NH1 2.96Å; E458-R508 PolarHBondContact OE1-NH1 3.45Å; E458-R508 IonicContact OE1-NH2 3.81Å; E458-R508 PolarHBondContact OE1-NH2 3.17Å; E458-R508 IonicContact OE2-NH1 2.77Å; E458-R508 PolarHBondContact OE2-NH1 2.66Å; E458-R508 IonicContact OE2-NH2 3.28Å; E504-R508 WeakPolarHBondContact O-CB 3.39Å; E504-R508 PolarHBondContact O-N 3.4Å; T505-R508 PolarHBondContact O-N 3.05Å; R508-E510 VanDerWaalsContact C-N 3.34Å; R508-E510 PolarHBondContact O-N 3.41Å
509	Y	91	Very high	92.6	Very high	9 Å²	9	30.2 Å²	30.2	4%	0.035	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	28.7	177.1	-68	-64.1	0	0	0	114.1	L453 A457 F468 L478 M482 T505 V506 V507 K511 F512	L453-Y509 HydrophobicContact CD1-CE2 4.18Å; L453-Y509 HydrophobicContact CG-CE2 4.08Å; L453-Y509 WeakPolarHBondContact O-CE2 3.4Å; L453-Y509 PolarHBondContact O-OH 2.8Å; A457-Y509 WeakPolarHBondContact CA-OH 3.28Å; A457-Y509 HydrophobicContact CB-CD1 4.38Å; A457-Y509 HydrophobicContact CB-CE1 3.47Å; A457-Y509 VanDerWaalsContact CB-CE1 3.47Å; A457-Y509 HydrophobicContact CB-CE2 4.31Å; A457-Y509 VanDerWaalsContact CB-CZ 3.45Å; A457-Y509 WeakPolarHBondContact CB-OH 3.47Å; A457-Y509 PolarHBondContact N-OH 3.24Å; F468-Y509 AromaticContact CE2-CD1 3.87Å; F468-Y509 HydrophobicContact CE2-CD1 3.87Å; F468-Y509 HydrophobicContact CE2-CG 4.5Å; F468-Y509 AromaticContact CZ-CD1 3.66Å; F468-Y509 HydrophobicContact CZ-CD1 3.66Å; F468-Y509 HydrophobicContact CZ-CE1 4.41Å; F468-Y509 HydrophobicContact CZ-CG 4.15Å; L478-Y509 HydrophobicContact CD1-CE1 3.93Å; L478-Y509 HydrophobicContact CD1-CE2 4.47Å; L478-Y509 WeakPolarHBondContact CD1-OH 3.32Å; L478-Y509 HydrophobicContact CD2-CD1 4.35Å; L478-Y509 HydrophobicContact CD2-CE1 3.73Å; L478-Y509 HydrophobicContact CG-CE1 4.21Å; M482-Y509 HydrophobicContact CE-CD2 4.29Å; M482-Y509 HydrophobicContact CE-CG 4.34Å; M482-Y509 HydrophobicContact CG-CD2 4.29Å; M482-Y509 HydrophobicContact CG-CG 4.21Å; M482-Y509 HydrophobicContact SD-CD2 3.39Å; M482-Y509 WeakPolarHBondContact SD-CD2 3.26Å; M482-Y509 HydrophobicContact SD-CE2 4.16Å; M482-Y509 HydrophobicContact SD-CG 3.76Å; T505-Y509 HydrophobicContact CG2-CD2 3.78Å; T505-Y509 HydrophobicContact CG2-CE2 3.93Å; T505-Y509 VanDerWaalsContact O-CD2 3.25Å; T505-Y509 WeakPolarHBondContact O-CD2 3.39Å; T505-Y509 PolarHBondContact O-N 3.33Å; V506-Y509 CarbonylContact O-C 3.47Å; V506-Y509 PolarHBondContact O-N 3.44Å; V507-Y509 PolarHBondContact O-N 3.4Å; Y509-K511 PolarHBondContact O-N 2.82Å; Y509-F512 WeakPolarHBondContact O-CB 3.42Å; Y509-F512 PolarHBondContact O-N 3.23Å
510	E	89	Confident	92.6	Very high	38 Å²	38	30.2 Å²	30.2	18%	0.178	15%	0.15	C	C	.	.	H	α-helix	trans	-46.4	-36.3	178	55.4	-176.4	-139.7	0	0	114.3	V506 V507 R508 F512 F513 S554	V506-E510 PolarHBondContact O-N 2.94Å; V507-E510 WeakPolarHBondContact O-CB 3.38Å; V507-E510 WeakPolarHBondContact O-CG 3.21Å; V507-E510 PolarHBondContact O-N 3.4Å; V507-E510 VanDerWaalsContact O-N 3.16Å; R508-E510 VanDerWaalsContact C-N 3.34Å; R508-E510 PolarHBondContact O-N 3.41Å; E510-F512 PolarHBondContact O-N 3.1Å; E510-F512 VanDerWaalsContact O-N 3.15Å; E510-F513 PolarHBondContact O-N 3.43Å; E510-S554 VanDerWaalsContact OE1-CB 3.29Å; E510-S554 WeakPolarHBondContact OE1-CB 3.28Å; E510-S554 PolarHBondContact OE1-OG 3.36Å; E510-S554 WeakPolarHBondContact OE2-CB 3.43Å; E510-S554 PolarHBondContact OE2-OG 3.45Å
511	K	87.9	Confident	92.5	Very high	130 Å²	130	31.3 Å²	31.3	57%	0.565	16%	0.16	S	C	*	.	H	α-helix	trans	-60	-25.8	178.1	-67.9	179.4	-177.9	170	0	113.4	F468 Y509 F513 T514	F468-K511 HydrophobicContact CD2-CB 4.03Å; F468-K511 HydrophobicContact CE2-CB 4.47Å; Y509-K511 PolarHBondContact O-N 2.82Å; K511-F513 VanDerWaalsContact C-N 3.27Å; K511-F513 PolarHBondContact O-N 3.48Å; K511-T514 WeakPolarHBondContact O-CB 3.39Å; K511-T514 PolarHBondContact O-N 3.14Å
512	F	89.9	Confident	92.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.3	-43.2	173.7	171.7	-106.5	0	0	0	111.3	F468 Q479 M482 R483 V486 Y509 E510 T514 V515 E516 H519	F468-F512 HydrophobicContact CD1-CB 4.14Å; F468-F512 AromaticContact CD1-CD2 3.74Å; F468-F512 HydrophobicContact CD1-CD2 3.74Å; F468-F512 HydrophobicContact CD1-CG 4.43Å; F468-F512 HydrophobicContact CD2-CB 3.91Å; F468-F512 VanDerWaalsContact CD2-N 3.3Å; F468-F512 HydrophobicContact CE1-CB 3.92Å; F468-F512 AromaticContact CE1-CD2 3.74Å; F468-F512 HydrophobicContact CE1-CD2 3.74Å; F468-F512 HydrophobicContact CE1-CG 4.24Å; F468-F512 HydrophobicContact CE2-CB 3.69Å; F468-F512 HydrophobicContact CG-CB 4.13Å; F468-F512 HydrophobicContact CG-CD2 4.37Å; F468-F512 HydrophobicContact CZ-CB 3.7Å; F468-F512 HydrophobicContact CZ-CD2 4.38Å; F468-F512 HydrophobicContact CZ-CG 4.44Å; Q479-F512 HydrophobicContact CG-CD2 4.21Å; Q479-F512 HydrophobicContact CG-CE2 3.88Å; M482-F512 HydrophobicContact CB-CD1 4.36Å; M482-F512 HydrophobicContact CB-CD2 3.93Å; M482-F512 HydrophobicContact CB-CE1 4.43Å; M482-F512 HydrophobicContact CB-CE2 4.01Å; M482-F512 HydrophobicContact CB-CG 4.11Å; M482-F512 HydrophobicContact CB-CZ 4.26Å; M482-F512 HydrophobicContact CE-CD1 4.44Å; R483-F512 HydrophobicContact CB-CZ 4.41Å; V486-F512 HydrophobicContact CG2-CE1 4.41Å; Y509-F512 WeakPolarHBondContact O-CB 3.42Å; Y509-F512 PolarHBondContact O-N 3.23Å; E510-F512 PolarHBondContact O-N 3.1Å; E510-F512 VanDerWaalsContact O-N 3.15Å; F512-T514 VanDerWaalsContact C-N 3.25Å; F512-T514 PolarHBondContact O-N 3.37Å; F512-V515 WeakPolarHBondContact O-CB 3.42Å; F512-V515 PolarHBondContact O-N 2.97Å; F512-E516 HydrophobicContact CE1-CB 4.35Å; F512-E516 HydrophobicContact CE2-CB 4.16Å; F512-E516 HydrophobicContact CE2-CG 4.19Å; F512-E516 HydrophobicContact CZ-CB 3.95Å; F512-E516 HydrophobicContact CZ-CG 4.36Å; F512-E516 PolarHBondContact O-N 3.42Å; F512-H519 HydrophobicContact CE1-CB 4.22Å; F512-H519 AromaticContact CE1-CD2 3.93Å; F512-H519 AromaticContact CZ-CD2 3.76Å
513	F	91.3	Very high	92.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-74.5	-15.1	-177.1	-58.6	-80.8	0	0	0	113.6	V486 V506 E510 K511 V515 P517 H519 I520 V523 F551 L555	V486-F513 HydrophobicContact CG1-CE1 4.28Å; V486-F513 HydrophobicContact CG1-CZ 4.07Å; V506-F513 HydrophobicContact CG1-CE2 3.98Å; V506-F513 HydrophobicContact CG1-CZ 3.94Å; E510-F513 PolarHBondContact O-N 3.43Å; K511-F513 VanDerWaalsContact C-N 3.27Å; K511-F513 PolarHBondContact O-N 3.48Å; F513-V515 VanDerWaalsContact C-N 3.26Å; F513-P517 WeakPolarHBondContact O-CA 3.47Å; F513-H519 HydrophobicContact CD1-CB 4.33Å; F513-H519 HydrophobicContact CE1-CB 4.15Å; F513-I520 HydrophobicContact CB-CD1 4.2Å; F513-I520 HydrophobicContact CB-CG1 3.81Å; F513-I520 HydrophobicContact CD1-CG1 3.87Å; F513-I520 HydrophobicContact CG-CG1 4.2Å; F513-V523 HydrophobicContact CE1-CB 4.39Å; F513-V523 HydrophobicContact CE1-CG2 3.78Å; F513-V523 HydrophobicContact CZ-CG2 3.85Å; F513-F551 HydrophobicContact CD1-CZ 4.39Å; F513-F551 AromaticContact CD2-CE2 3.6Å; F513-F551 HydrophobicContact CD2-CE2 3.6Å; F513-F551 AromaticContact CD2-CZ 3.98Å; F513-F551 HydrophobicContact CD2-CZ 3.98Å; F513-F551 HydrophobicContact CE1-CZ 4.47Å; F513-F551 AromaticContact CE2-CE2 3.61Å; F513-F551 HydrophobicContact CE2-CE2 3.61Å; F513-F551 HydrophobicContact CE2-CZ 4.07Å; F513-F551 HydrophobicContact CG-CE2 4.23Å; F513-F551 HydrophobicContact CG-CZ 4.15Å; F513-F551 HydrophobicContact CZ-CE2 4.23Å; F513-F551 HydrophobicContact CZ-CZ 4.32Å; F513-L555 HydrophobicContact CB-CD1 3.6Å; F513-L555 HydrophobicContact CB-CD2 3.94Å; F513-L555 HydrophobicContact CB-CG 4.44Å; F513-L555 HydrophobicContact CD2-CD1 4.22Å; F513-L555 HydrophobicContact CG-CD1 4.06Å
514	T	88.5	Confident	92.1	Very high	77 Å²	77	33.9 Å²	33.9	47%	0.472	18%	0.178	S	C	.	.	H	α-helix	trans	-69.9	-30.8	168	-61.8	0	0	0	0	111.3	K511 F512	K511-T514 WeakPolarHBondContact O-CB 3.39Å; K511-T514 PolarHBondContact O-N 3.14Å; F512-T514 VanDerWaalsContact C-N 3.25Å; F512-T514 PolarHBondContact O-N 3.37Å
515	V	87.6	Confident	92	Very high	45 Å²	45	36 Å²	36	27%	0.273	19%	0.188	S	C	.	.	H	α-helix	trans	-90.7	-43	-178	174.4	0	0	0	0	111.7	F468 F512 F513 P517	F468-V515 HydrophobicContact CB-CB 4.31Å; F468-V515 HydrophobicContact CB-CG2 3.84Å; F512-V515 WeakPolarHBondContact O-CB 3.42Å; F512-V515 PolarHBondContact O-N 2.97Å; F513-V515 VanDerWaalsContact C-N 3.26Å; V515-P517 VanDerWaalsContact O-CD 3.25Å; V515-P517 WeakPolarHBondContact O-CD 3.29Å
516	E	90.3	Very high	92	Very high	7 Å²	7	36 Å²	36	3%	0.033	19%	0.188	C	C	.	.			trans	-118	69.5	179.2	-69.5	-165.2	-161.6	0	0	111.5	Q479 R483 F512 Q518 H519	Q479-E516 PolarHBondContact NE2-OE1 3.45Å; R483-E516 IonicContact CZ-OE1 2.7Å; R483-E516 IonicContact CZ-OE2 3.16Å; R483-E516 IonicContact NE-OE1 3.26Å; R483-E516 IonicContact NE-OE2 3.3Å; R483-E516 PolarHBondContact NE-OE2 3.06Å; R483-E516 IonicContact NH2-OE1 3.38Å; R483-E516 PolarHBondContact NH2-OE1 3.49Å; R483-E516 IonicContact NH2-OE2 3.18Å; F512-E516 HydrophobicContact CE1-CB 4.35Å; F512-E516 HydrophobicContact CE2-CB 4.16Å; F512-E516 HydrophobicContact CE2-CG 4.19Å; F512-E516 HydrophobicContact CZ-CB 3.95Å; F512-E516 HydrophobicContact CZ-CG 4.36Å; F512-E516 PolarHBondContact O-N 3.42Å; E516-Q518 VanDerWaalsContact CA-OE1 3.26Å; E516-Q518 PolarHBondContact O-N 3.36Å; E516-Q518 VanDerWaalsContact O-N 3.12Å; E516-Q518 PolarHBondContact OE2-NE2 3.41Å; E516-H519 PolarHBondContact O-N 3.17Å; E516-H519 IonicContact OE2-CD2 2.83Å; E516-H519 PolarHBondContact OE2-CD2 2.94Å; E516-H519 VanDerWaalsContact OE2-CD2 3.31Å; E516-H519 IonicContact OE2-NE2 2.68Å; E516-H519 PolarHBondContact OE2-NE2 2.99Å
517	P	90.9	Very high	92	Very high	59 Å²	59	36 Å²	36	38%	0.383	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-64.3	-18	-176	27.2	-35.6	0	0	0	113.6	F513 V515 H519 I520	F513-P517 WeakPolarHBondContact O-CA 3.47Å; V515-P517 VanDerWaalsContact O-CD 3.25Å; V515-P517 WeakPolarHBondContact O-CD 3.29Å; P517-H519 PolarHBondContact O-N 3.07Å; P517-H519 VanDerWaalsContact O-N 3.1Å; P517-I520 HydrophobicContact CB-CD1 3.96Å; P517-I520 WeakPolarHBondContact O-CB 3.32Å; P517-I520 WeakPolarHBondContact O-CG1 3.45Å; P517-I520 PolarHBondContact O-N 3.3Å; P517-I520 VanDerWaalsContact O-N 3.09Å
518	Q	92	Very high	92	Very high	117 Å²	117	36.2 Å²	36.2	55%	0.547	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-59.2	-20.9	176.3	67.2	-84.9	12.6	0	0	113.9	E516 P521	E516-Q518 VanDerWaalsContact CA-OE1 3.26Å; E516-Q518 PolarHBondContact O-N 3.36Å; E516-Q518 VanDerWaalsContact O-N 3.12Å; E516-Q518 PolarHBondContact OE2-NE2 3.41Å; Q518-P521 WeakPolarHBondContact O-CD 3.41Å
519	H	93.4	Very high	92.1	Very high	29 Å²	29	35 Å²	35	13%	0.134	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-90.1	-9.1	179.4	-65.7	-56.3	0	0	0	113.9	V486 F512 F513 E516 P517 C522	V486-H519 HydrophobicContact CG2-CB 3.96Å; F512-H519 HydrophobicContact CE1-CB 4.22Å; F512-H519 AromaticContact CE1-CD2 3.93Å; F512-H519 AromaticContact CZ-CD2 3.76Å; F513-H519 HydrophobicContact CD1-CB 4.33Å; F513-H519 HydrophobicContact CE1-CB 4.15Å; E516-H519 PolarHBondContact O-N 3.17Å; E516-H519 IonicContact OE2-CD2 2.83Å; E516-H519 PolarHBondContact OE2-CD2 2.94Å; E516-H519 VanDerWaalsContact OE2-CD2 3.31Å; E516-H519 IonicContact OE2-NE2 2.68Å; E516-H519 PolarHBondContact OE2-NE2 2.99Å; P517-H519 PolarHBondContact O-N 3.07Å; P517-H519 VanDerWaalsContact O-N 3.1Å; H519-C522 PolarHBondContact O-N 2.87Å
520	I	94.4	Very high	92.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-56.6	-46.9	178.5	-65.5	170.7	0	0	0	112.3	F513 P517 C522 V523 L524 Q558 M559 F562	F513-I520 HydrophobicContact CB-CD1 4.2Å; F513-I520 HydrophobicContact CB-CG1 3.81Å; F513-I520 HydrophobicContact CD1-CG1 3.87Å; F513-I520 HydrophobicContact CG-CG1 4.2Å; P517-I520 HydrophobicContact CB-CD1 3.96Å; P517-I520 WeakPolarHBondContact O-CB 3.32Å; P517-I520 WeakPolarHBondContact O-CG1 3.45Å; P517-I520 PolarHBondContact O-N 3.3Å; P517-I520 VanDerWaalsContact O-N 3.09Å; I520-C522 VanDerWaalsContact C-N 3.32Å; I520-C522 PolarHBondContact O-N 3.32Å; I520-V523 PolarHBondContact O-N 3.09Å; I520-L524 VanDerWaalsContact O-CB 3.27Å; I520-L524 WeakPolarHBondContact O-CB 3.32Å; I520-L524 PolarHBondContact O-N 3.23Å; I520-Q558 HydrophobicContact CD1-CB 3.67Å; I520-Q558 HydrophobicContact CD1-CG 4.32Å; I520-M559 HydrophobicContact CG2-CE 3.9Å; I520-M559 HydrophobicContact CG2-SD 4.46Å; I520-F562 HydrophobicContact CG2-CD2 4.31Å; I520-F562 HydrophobicContact CG2-CE2 3.98Å
521	P	93.7	Very high	92.4	Very high	53 Å²	53	41 Å²	41	34%	0.344	21%	0.214	S	C	.	.	H	α-helix	trans	-59.9	-39.1	-175.9	-25	35	0	0	0	113.7	Q518 L524 M525 F562	Q518-P521 WeakPolarHBondContact O-CD 3.41Å; P521-L524 PolarHBondContact O-N 3.14Å; P521-M525 WeakPolarHBondContact O-CB 3.25Å; P521-M525 VanDerWaalsContact O-CG 3.32Å; P521-M525 WeakPolarHBondContact O-CG 3.33Å; P521-M525 PolarHBondContact O-N 3.43Å; P521-F562 HydrophobicContact CG-CE1 3.91Å; P521-F562 HydrophobicContact CG-CZ 3.82Å
522	C	92.5	Very high	92.7	Very high	60 Å²	60	34.8 Å²	34.8	41%	0.405	19%	0.187	S	C	.	.	H	α-helix	trans	-62.4	-46.9	179.8	-178.8	0	0	0	0	111.4	V486 H519 I520 A526	V486-C522 PolarHBondContact O-SG 3.42Å; V486-C522 VanDerWaalsContact O-SG 3.41Å; H519-C522 PolarHBondContact O-N 2.87Å; I520-C522 VanDerWaalsContact C-N 3.32Å; I520-C522 PolarHBondContact O-N 3.32Å; C522-A526 PolarHBondContact O-N 3.18Å
523	V	94.7	Very high	92.8	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-69.7	-41.7	179.8	169.6	0	0	0	0	111.2	V486 V506 F513 I520 M525 A526 F527 F551	V486-V523 HydrophobicContact CB-CG2 4.25Å; V486-V523 HydrophobicContact CG1-CG2 3.88Å; V506-V523 HydrophobicContact CG1-CG1 3.44Å; V506-V523 VanDerWaalsContact CG1-CG1 3.44Å; V506-V523 HydrophobicContact CG1-CG2 4.37Å; F513-V523 HydrophobicContact CE1-CB 4.39Å; F513-V523 HydrophobicContact CE1-CG2 3.78Å; F513-V523 HydrophobicContact CZ-CG2 3.85Å; I520-V523 PolarHBondContact O-N 3.09Å; V523-M525 VanDerWaalsContact C-N 3.31Å; V523-M525 PolarHBondContact O-N 3.01Å; V523-A526 WeakPolarHBondContact O-CB 3.36Å; V523-A526 PolarHBondContact O-N 3.42Å; V523-A526 VanDerWaalsContact O-N 3.09Å; V523-F527 HydrophobicContact CG1-CD2 3.85Å; V523-F527 HydrophobicContact CG1-CE2 3.64Å; V523-F527 WeakPolarHBondContact O-CD2 3.35Å; V523-F527 PolarHBondContact O-N 3Å; V523-F551 HydrophobicContact CG1-CE1 4.05Å; V523-F551 HydrophobicContact CG1-CE2 4.33Å; V523-F551 HydrophobicContact CG1-CZ 3.79Å
524	L	94.4	Very high	93	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-43.8	177.3	-176.9	63.6	0	0	0	111.2	I520 P521 A526 F527 L528 F548 F562 I566	I520-L524 VanDerWaalsContact O-CB 3.27Å; I520-L524 WeakPolarHBondContact O-CB 3.32Å; I520-L524 PolarHBondContact O-N 3.23Å; P521-L524 PolarHBondContact O-N 3.14Å; L524-A526 VanDerWaalsContact C-N 3.3Å; L524-A526 PolarHBondContact O-N 3.03Å; L524-F527 PolarHBondContact O-N 3.48Å; L524-L528 HydrophobicContact CD1-CD1 4.05Å; L524-L528 HydrophobicContact CD1-CG 4.34Å; L524-L528 HydrophobicContact CG-CD1 3.88Å; L524-L528 VanDerWaalsContact O-CG 3.29Å; L524-L528 WeakPolarHBondContact O-CG 3.46Å; L524-L528 PolarHBondContact O-N 2.97Å; L524-F548 HydrophobicContact CD1-CE2 3.67Å; L524-F548 HydrophobicContact CD1-CZ 4.37Å; L524-F562 HydrophobicContact CD2-CB 3.81Å; L524-F562 HydrophobicContact CD2-CD1 4.38Å; L524-F562 HydrophobicContact CD2-CG 4Å; L524-I566 HydrophobicContact CD1-CD1 3.89Å; L524-I566 HydrophobicContact CD1-CG1 4.02Å; L524-I566 HydrophobicContact CD2-CD1 3.77Å; L524-I566 HydrophobicContact CD2-CG1 3.78Å; L524-I566 HydrophobicContact CG-CD1 4.43Å; L524-I566 HydrophobicContact CG-CG1 4.33Å
525	M	93.5	Very high	93.2	Very high	68 Å²	68	35.3 Å²	35.3	34%	0.335	18%	0.181	S	C	.	.	H	α-helix	trans	-60.5	-40.1	173.8	-75.8	-59.4	-57.5	0	0	112.1	P521 V523 F527 L528 D529	P521-M525 WeakPolarHBondContact O-CB 3.25Å; P521-M525 VanDerWaalsContact O-CG 3.32Å; P521-M525 WeakPolarHBondContact O-CG 3.33Å; P521-M525 PolarHBondContact O-N 3.43Å; V523-M525 VanDerWaalsContact C-N 3.31Å; V523-M525 PolarHBondContact O-N 3.01Å; M525-F527 VanDerWaalsContact C-N 3.35Å; M525-F527 PolarHBondContact O-N 3.23Å; M525-L528 PolarHBondContact O-N 3Å; M525-D529 WeakPolarHBondContact O-CB 3.45Å; M525-D529 PolarHBondContact O-N 2.98Å
526	A	94.9	Very high	93.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-38.2	176.2	0	0	0	0	0	112.8	F502 F503 C522 V523 L524 G532	F502-A526 HydrophobicContact CE1-CB 4.48Å; F503-A526 HydrophobicContact CE1-CB 4.17Å; F503-A526 HydrophobicContact CZ-CB 4.24Å; F503-A526 WeakPolarHBondContact CZ-O 3.48Å; C522-A526 PolarHBondContact O-N 3.18Å; V523-A526 WeakPolarHBondContact O-CB 3.36Å; V523-A526 PolarHBondContact O-N 3.42Å; V523-A526 VanDerWaalsContact O-N 3.09Å; L524-A526 VanDerWaalsContact C-N 3.3Å; L524-A526 PolarHBondContact O-N 3.03Å; A526-G532 PolarHBondContact O-N 3.39Å; A526-G532 VanDerWaalsContact O-N 3.15Å
527	F	96.1	Very high	93.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.5	-43.4	172.3	-82.4	-71.1	0	0	0	112	F503 V506 V507 V523 L524 M525 L533 L547 F548 F551	F503-F527 HydrophobicContact CB-CE1 4.36Å; F503-F527 AromaticContact CD1-CD1 3.69Å; F503-F527 HydrophobicContact CD1-CD1 3.69Å; F503-F527 HydrophobicContact CD1-CD2 4.27Å; F503-F527 AromaticContact CD1-CE1 3.3Å; F503-F527 HydrophobicContact CD1-CE1 3.3Å; F503-F527 AromaticContact CD1-CE2 3.94Å; F503-F527 HydrophobicContact CD1-CE2 3.94Å; F503-F527 HydrophobicContact CD1-CG 4.16Å; F503-F527 AromaticContact CD1-CZ 3.44Å; F503-F527 HydrophobicContact CD1-CZ 3.44Å; F503-F527 VanDerWaalsContact CD1-CZ 3.44Å; F503-F527 HydrophobicContact CE1-CB 4.47Å; F503-F527 AromaticContact CE1-CD1 3.6Å; F503-F527 HydrophobicContact CE1-CD1 3.6Å; F503-F527 HydrophobicContact CE1-CD2 4.07Å; F503-F527 AromaticContact CE1-CE1 3.75Å; F503-F527 HydrophobicContact CE1-CE1 3.75Å; F503-F527 HydrophobicContact CE1-CE2 4.2Å; F503-F527 AromaticContact CE1-CG 3.77Å; F503-F527 HydrophobicContact CE1-CG 3.77Å; F503-F527 HydrophobicContact CE1-CZ 4.05Å; F503-F527 HydrophobicContact CG-CE1 4.04Å; F503-F527 HydrophobicContact CG-CZ 4.36Å; F503-F527 HydrophobicContact CZ-CD1 4.45Å; V506-F527 HydrophobicContact CG1-CE2 4.34Å; V507-F527 HydrophobicContact CG2-CZ 3.78Å; V523-F527 HydrophobicContact CG1-CD2 3.85Å; V523-F527 HydrophobicContact CG1-CE2 3.64Å; V523-F527 WeakPolarHBondContact O-CD2 3.35Å; V523-F527 PolarHBondContact O-N 3Å; L524-F527 PolarHBondContact O-N 3.48Å; M525-F527 VanDerWaalsContact C-N 3.35Å; M525-F527 PolarHBondContact O-N 3.23Å; F527-L533 WeakPolarHBondContact O-CB 3.18Å; F527-L533 VanDerWaalsContact O-CG 3.26Å; F527-L533 WeakPolarHBondContact O-CG 3.49Å; F527-L533 PolarHBondContact O-N 3.08Å; F527-L547 HydrophobicContact CE1-CB 4.03Å; F527-L547 HydrophobicContact CZ-CB 4.46Å; F527-F548 HydrophobicContact CB-CD2 3.74Å; F527-F548 HydrophobicContact CB-CE2 4.31Å; F527-F548 HydrophobicContact CB-CG 4.4Å; F527-F548 HydrophobicContact CD1-CB 3.71Å; F527-F548 HydrophobicContact CD1-CD2 4.15Å; F527-F548 HydrophobicContact CD1-CG 4.35Å; F527-F548 HydrophobicContact CD2-CD2 4.25Å; F527-F548 HydrophobicContact CE1-CB 4.07Å; F527-F548 HydrophobicContact CG-CB 4.26Å; F527-F548 AromaticContact CG-CD2 3.81Å; F527-F548 HydrophobicContact CG-CD2 3.81Å; F527-F548 HydrophobicContact CG-CG 4.43Å; F527-F551 HydrophobicContact CD2-CD1 4.39Å; F527-F551 HydrophobicContact CE2-CB 4.3Å; F527-F551 HydrophobicContact CE2-CD1 4.01Å; F527-F551 HydrophobicContact CE2-CD2 4.48Å; F527-F551 HydrophobicContact CE2-CE1 4.46Å; F527-F551 HydrophobicContact CE2-CG 4.02Å; F527-F551 HydrophobicContact CZ-CB 4.38Å
528	L	94.6	Very high	93.4	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-82.3	-18.2	-170.3	-64.8	174.4	0	0	0	114	L524 M525 L533 R534 F548 I566 R569 I570	L524-L528 HydrophobicContact CD1-CD1 4.05Å; L524-L528 HydrophobicContact CD1-CG 4.34Å; L524-L528 HydrophobicContact CG-CD1 3.88Å; L524-L528 VanDerWaalsContact O-CG 3.29Å; L524-L528 WeakPolarHBondContact O-CG 3.46Å; L524-L528 PolarHBondContact O-N 2.97Å; M525-L528 PolarHBondContact O-N 3Å; L528-L533 HydrophobicContact CD2-CD1 4.16Å; L528-R534 PolarHBondContact O-NH1 3.13Å; L528-F548 HydrophobicContact CD2-CE1 4.36Å; L528-F548 HydrophobicContact CD2-CE2 4.31Å; L528-F548 HydrophobicContact CD2-CZ 3.9Å; L528-I566 HydrophobicContact CD1-CG1 4.28Å; L528-R569 HydrophobicContact CD1-CB 4.35Å; L528-I570 HydrophobicContact CD2-CG2 3.81Å
529	D	93.2	Very high	93.3	Very high	31 Å²	31	39.3 Å²	39.3	17%	0.166	22%	0.216	C	C	.	.	S	Bend	trans	-100.1	-162.6	-177.9	71.5	23.6	0	0	0	113.8	M525 R531 G532 R534	M525-D529 WeakPolarHBondContact O-CB 3.45Å; M525-D529 PolarHBondContact O-N 2.98Å; D529-R531 PolarHBondContact O-N 2.91Å; D529-R531 VanDerWaalsContact O-N 3.13Å; D529-R531 VanDerWaalsContact OD1-CB 3.28Å; D529-R531 WeakPolarHBondContact OD1-CB 3.44Å; D529-R531 WeakPolarHBondContact OD1-CG 3.37Å; D529-R531 IonicContact OD1-CZ 2.85Å; D529-R531 PolarHBondContact OD1-N 3.36Å; D529-R531 IonicContact OD1-NE 2.7Å; D529-R531 PolarHBondContact OD1-NE 3.1Å; D529-R531 IonicContact OD1-NH2 2.75Å; D529-R531 IonicContact OD2-CZ 2.93Å; D529-R531 VanDerWaalsContact OD2-CZ 3.3Å; D529-R531 IonicContact OD2-NE 3.87Å; D529-R531 PolarHBondContact OD2-NE 3.24Å; D529-R531 VanDerWaalsContact OD2-NE 3.11Å; D529-R531 IonicContact OD2-NH2 2.63Å; D529-R531 PolarHBondContact OD2-NH2 3.06Å; D529-G532 PolarHBondContact O-N 3.38Å; D529-R534 WeakPolarHBondContact O-CB 3.41Å; D529-R534 PolarHBondContact O-N 3.44Å
530	H	92.2	Very high	93.3	Very high	130 Å²	130	38 Å²	38	60%	0.602	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-11.5	-178.9	65.8	-82.9	0	0	0	113.8	H535	H530-H535 WeakPolarHBondContact O-CA 3.48Å; H530-H535 PolarHBondContact O-CD2 2.72Å
531	R	93.9	Very high	93.3	Very high	42 Å²	42	39.7 Å²	39.7	16%	0.158	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-29.5	175.3	-64.2	172.3	-74.7	177	-5.1	112.3	S491 T499 F503 D529	S491-R531 WeakPolarHBondContact O-CD 3.46Å; S491-R531 WeakPolarHBondContact O-CG 3.4Å; S491-R531 PolarHBondContact OG-NH1 3.3Å; T499-R531 WeakPolarHBondContact CG2-O 3.47Å; F503-R531 WeakPolarHBondContact CE2-O 3.5Å; D529-R531 PolarHBondContact O-N 2.91Å; D529-R531 VanDerWaalsContact O-N 3.13Å; D529-R531 VanDerWaalsContact OD1-CB 3.28Å; D529-R531 WeakPolarHBondContact OD1-CB 3.44Å; D529-R531 WeakPolarHBondContact OD1-CG 3.37Å; D529-R531 IonicContact OD1-CZ 2.85Å; D529-R531 PolarHBondContact OD1-N 3.36Å; D529-R531 IonicContact OD1-NE 2.7Å; D529-R531 PolarHBondContact OD1-NE 3.1Å; D529-R531 IonicContact OD1-NH2 2.75Å; D529-R531 IonicContact OD2-CZ 2.93Å; D529-R531 VanDerWaalsContact OD2-CZ 3.3Å; D529-R531 IonicContact OD2-NE 3.87Å; D529-R531 PolarHBondContact OD2-NE 3.24Å; D529-R531 VanDerWaalsContact OD2-NE 3.11Å; D529-R531 IonicContact OD2-NH2 2.63Å; D529-R531 PolarHBondContact OD2-NH2 3.06Å
532	G	93.9	Very high	93.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-104.3	-174.2	0	0	0	0	0	113.4	A526 D529 R534 H535 T544	A526-G532 PolarHBondContact O-N 3.39Å; A526-G532 VanDerWaalsContact O-N 3.15Å; D529-G532 PolarHBondContact O-N 3.38Å; G532-R534 PolarHBondContact O-N 3.1Å; G532-H535 WeakPolarHBondContact O-CB 3.45Å; G532-H535 PolarHBondContact O-N 3.36Å; G532-T544 PolarHBondContact O-OG1 2.94Å
533	L	93.9	Very high	93.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.2	-174.2	-66.7	176.1	0	0	0	113.9	F527 L528 R541 A545 F548 L573 I595	F527-L533 WeakPolarHBondContact O-CB 3.18Å; F527-L533 VanDerWaalsContact O-CG 3.26Å; F527-L533 WeakPolarHBondContact O-CG 3.49Å; F527-L533 PolarHBondContact O-N 3.08Å; L528-L533 HydrophobicContact CD2-CD1 4.16Å; L533-R541 VanDerWaalsContact O-CD 3.3Å; L533-R541 WeakPolarHBondContact O-CD 3.26Å; L533-A545 HydrophobicContact CD2-CB 3.91Å; L533-F548 HydrophobicContact CD1-CD1 4Å; L533-F548 HydrophobicContact CD1-CE1 4.32Å; L533-F548 HydrophobicContact CD1-CG 4.45Å; L533-L573 HydrophobicContact CB-CD1 3.93Å; L533-L573 HydrophobicContact CD1-CD1 3.84Å; L533-L573 HydrophobicContact CG-CD1 4.46Å; L533-I595 HydrophobicContact CD1-CD1 4.1Å; L533-I595 HydrophobicContact CD2-CD1 3.82Å
534	R	93.6	Very high	93.6	Very high	69 Å²	69	41.3 Å²	41.3	26%	0.26	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	19.4	178.2	-59.7	173.6	167.5	76.1	-0.4	113.3	L528 D529 G532 R569 D572 L586	L528-R534 PolarHBondContact O-NH1 3.13Å; D529-R534 WeakPolarHBondContact O-CB 3.41Å; D529-R534 PolarHBondContact O-N 3.44Å; G532-R534 PolarHBondContact O-N 3.1Å; R534-R569 PolarHBondContact NH1-O 2.99Å; R534-R569 PolarHBondContact NH2-O 3.18Å; R534-D572 IonicContact CZ-OD1 3.7Å; R534-D572 IonicContact CZ-OD2 2.64Å; R534-D572 IonicContact NE-OD2 3.15Å; R534-D572 IonicContact NH2-OD1 2.76Å; R534-D572 PolarHBondContact NH2-OD1 3.38Å; R534-D572 IonicContact NH2-OD2 3.8Å; R534-D572 PolarHBondContact NH2-OD2 3.4Å; R534-L586 HydrophobicContact CB-CD2 4.22Å; R534-L586 HydrophobicContact CG-CD2 3.87Å
535	H	93.9	Very high	93.6	Very high	19 Å²	19	41 Å²	41	9%	0.088	21%	0.212	C	C	.	.			trans	-63.1	151.9	178.2	-167.4	-87.8	0	0	0	112.3	H530 G532 S537 V540 R541	H530-H535 WeakPolarHBondContact O-CA 3.48Å; H530-H535 PolarHBondContact O-CD2 2.72Å; G532-H535 WeakPolarHBondContact O-CB 3.45Å; G532-H535 PolarHBondContact O-N 3.36Å; H535-S537 PolarHBondContact ND1-N 3.35Å; H535-V540 HydrophobicContact CB-CB 4.06Å; H535-V540 HydrophobicContact CB-CG1 3.77Å; H535-R541 HydrophobicContact CB-CG 4.12Å; H535-R541 WeakPolarHBondContact O-CD 3.44Å; H535-R541 VanDerWaalsContact O-CG 3.23Å; H535-R541 WeakPolarHBondContact O-CG 3.41Å; H535-R541 PolarHBondContact O-NH1 2.88Å
536	S	91.3	Very high	93.8	Very high	109 Å²	109	41.7 Å²	41.7	76%	0.762	21%	0.212	S	C	*	.	S	Bend	trans	-65.7	-41.5	-179.1	55.4	0	0	0	0	112.8	R541	S536-R541 PolarHBondContact O-NH1 3.09Å
537	S	90.8	Very high	93.9	Very high	35 Å²	35	41.7 Å²	41.7	25%	0.245	21%	0.212	C	C	.	.	S	Bend	trans	-74	128.1	175.3	175.4	0	0	0	0	112.7	H535 K539 V540 R541	H535-S537 PolarHBondContact ND1-N 3.35Å; S537-K539 VanDerWaalsContact C-N 3.34Å; S537-K539 PolarHBondContact O-N 3.47Å; S537-K539 PolarHBondContact OG-N 2.85Å; S537-V540 PolarHBondContact O-N 3.36Å; S537-R541 PolarHBondContact O-N 3.42Å; S537-R541 VanDerWaalsContact O-N 3.16Å
538	A	89.9	Confident	93.9	Very high	60 Å²	60	41.7 Å²	41.7	50%	0.496	21%	0.212	S	C	.	.	H	α-helix	trans	-63.4	-36.1	175.3	0	0	0	0	0	112.8	V540 R541 S542	A538-V540 VanDerWaalsContact C-N 3.3Å; A538-V540 PolarHBondContact O-N 3.41Å; A538-R541 PolarHBondContact O-N 3.03Å; A538-S542 WeakPolarHBondContact O-CB 3.49Å; A538-S542 PolarHBondContact O-N 3.48Å
539	K	90.8	Very high	94	Very high	108 Å²	108	41.5 Å²	41.5	47%	0.47	21%	0.211	S	C	.	.	H	α-helix	trans	-57.7	-43.9	176.1	-171.7	176.2	-174.9	173.9	0	111.1	E394 S537 R543	E394-K539 IonicContact OE1-NZ 3.94Å; E394-K539 PolarHBondContact OE1-NZ 3.48Å; S537-K539 VanDerWaalsContact C-N 3.34Å; S537-K539 PolarHBondContact O-N 3.47Å; S537-K539 PolarHBondContact OG-N 2.85Å; K539-R543 PolarHBondContact O-N 3.19Å; K539-R543 VanDerWaalsContact O-N 3.15Å
540	V	93.4	Very high	94.1	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68	-46.9	177.1	-179.1	0	0	0	0	111.2	T496 T499 L500 H535 S537 A538 S542 R543 T544	T496-V540 HydrophobicContact CG2-CG2 3.86Å; T499-V540 HydrophobicContact CG2-CG1 4.12Å; L500-V540 HydrophobicContact CD2-CB 4.46Å; L500-V540 HydrophobicContact CD2-CG1 4.43Å; L500-V540 HydrophobicContact CD2-CG2 4.29Å; L500-V540 HydrophobicContact CG-CG2 4.2Å; H535-V540 HydrophobicContact CB-CB 4.06Å; H535-V540 HydrophobicContact CB-CG1 3.77Å; S537-V540 PolarHBondContact O-N 3.36Å; A538-V540 VanDerWaalsContact C-N 3.3Å; A538-V540 PolarHBondContact O-N 3.41Å; V540-S542 VanDerWaalsContact C-N 3.34Å; V540-S542 PolarHBondContact O-N 3.16Å; V540-R543 PolarHBondContact O-N 3.3Å; V540-T544 HydrophobicContact CG1-CG2 3.94Å; V540-T544 VanDerWaalsContact O-CB 3.3Å; V540-T544 WeakPolarHBondContact O-CB 3.36Å; V540-T544 WeakPolarHBondContact O-CG2 3.22Å; V540-T544 PolarHBondContact O-N 2.65Å; V540-T544 PolarHBondContact O-OG1 3.39Å
541	R	94.6	Very high	94.2	Very high	38 Å²	38	38.8 Å²	38.8	14%	0.143	19%	0.193	C	C	.	.	H	α-helix	trans	-58.7	-45.2	178.8	-68.7	-163	-57.8	-82.7	4.6	112.4	L533 H535 S536 S537 A538 T544 A545 L586 L587	L533-R541 VanDerWaalsContact O-CD 3.3Å; L533-R541 WeakPolarHBondContact O-CD 3.26Å; H535-R541 HydrophobicContact CB-CG 4.12Å; H535-R541 WeakPolarHBondContact O-CD 3.44Å; H535-R541 VanDerWaalsContact O-CG 3.23Å; H535-R541 WeakPolarHBondContact O-CG 3.41Å; H535-R541 PolarHBondContact O-NH1 2.88Å; S536-R541 PolarHBondContact O-NH1 3.09Å; S537-R541 PolarHBondContact O-N 3.42Å; S537-R541 VanDerWaalsContact O-N 3.16Å; A538-R541 PolarHBondContact O-N 3.03Å; R541-T544 WeakPolarHBondContact CA-OG1 3.28Å; R541-T544 PolarHBondContact O-N 3.48Å; R541-T544 PolarHBondContact O-OG1 3.27Å; R541-T544 VanDerWaalsContact O-OG1 3.05Å; R541-A545 WeakPolarHBondContact O-CB 3.37Å; R541-A545 PolarHBondContact O-N 2.91Å; R541-L586 VanDerWaalsContact CZ-O 3.28Å; R541-L586 PolarHBondContact NE-O 2.94Å; R541-L586 PolarHBondContact NH2-O 3.49Å; R541-L587 HydrophobicContact CB-CD2 3.91Å
542	S	94.1	Very high	94.2	Very high	48 Å²	48	36.8 Å²	36.8	34%	0.336	19%	0.186	S	C	.	.	H	α-helix	trans	-62.9	-49.7	179.4	178.7	0	0	0	0	111.9	A538 V540 T544 A545 Y546 D591	A538-S542 WeakPolarHBondContact O-CB 3.49Å; A538-S542 PolarHBondContact O-N 3.48Å; V540-S542 VanDerWaalsContact C-N 3.34Å; V540-S542 PolarHBondContact O-N 3.16Å; S542-T544 PolarHBondContact O-N 2.68Å; S542-A545 PolarHBondContact O-N 3.28Å; S542-Y546 PolarHBondContact O-N 2.68Å; S542-D591 VanDerWaalsContact CA-CG 3.46Å; S542-D591 WeakPolarHBondContact CA-OD1 3.33Å; S542-D591 WeakPolarHBondContact CA-OD2 3.49Å; S542-D591 WeakPolarHBondContact CB-OD1 3.49Å; S542-D591 WeakPolarHBondContact CB-OD2 3.45Å; S542-D591 PolarHBondContact OG-OD1 3.45Å
543	R	95.6	Very high	94.1	Very high	99 Å²	99	40.2 Å²	40.2	37%	0.374	20%	0.2	S	C	.	.	H	α-helix	trans	-65.3	-39.4	179.6	-171	57.6	179	-176.1	0.1	112.5	L500 E504 K539 V540 Y546 L547	L500-R543 HydrophobicContact CD2-CB 3.7Å; L500-R543 HydrophobicContact CD2-CG 3.86Å; E504-R543 IonicContact OE1-CZ 3.77Å; E504-R543 IonicContact OE1-NE 2.6Å; E504-R543 PolarHBondContact OE1-NE 3.38Å; E504-R543 IonicContact OE1-NH2 2.73Å; E504-R543 PolarHBondContact OE1-NH2 3.3Å; E504-R543 IonicContact OE2-NH2 2.79Å; E504-R543 PolarHBondContact OE2-NH2 3.18Å; K539-R543 PolarHBondContact O-N 3.19Å; K539-R543 VanDerWaalsContact O-N 3.15Å; V540-R543 PolarHBondContact O-N 3.3Å; R543-Y546 PolarHBondContact O-N 3.44Å; R543-L547 HydrophobicContact CG-CD1 4.01Å; R543-L547 HydrophobicContact CG-CG 4.39Å; R543-L547 WeakPolarHBondContact O-CG 3.35Å; R543-L547 PolarHBondContact O-N 3Å
544	T	96.2	Very high	94	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69.5	-31.1	178.6	54.6	0	0	0	0	112.8	F503 G532 V540 R541 S542 L547 F548	F503-T544 HydrophobicContact CD2-CG2 3.45Å; F503-T544 VanDerWaalsContact CD2-CG2 3.45Å; F503-T544 HydrophobicContact CE2-CG2 3.69Å; F503-T544 HydrophobicContact CG-CG2 4Å; F503-T544 HydrophobicContact CZ-CG2 4.39Å; G532-T544 PolarHBondContact O-OG1 2.94Å; V540-T544 HydrophobicContact CG1-CG2 3.94Å; V540-T544 VanDerWaalsContact O-CB 3.3Å; V540-T544 WeakPolarHBondContact O-CB 3.36Å; V540-T544 WeakPolarHBondContact O-CG2 3.22Å; V540-T544 PolarHBondContact O-N 2.65Å; V540-T544 PolarHBondContact O-OG1 3.39Å; R541-T544 WeakPolarHBondContact CA-OG1 3.28Å; R541-T544 PolarHBondContact O-N 3.48Å; R541-T544 PolarHBondContact O-OG1 3.27Å; R541-T544 VanDerWaalsContact O-OG1 3.05Å; S542-T544 PolarHBondContact O-N 2.68Å; T544-L547 PolarHBondContact O-N 3.05Å; T544-F548 WeakPolarHBondContact O-CB 3.46Å; T544-F548 PolarHBondContact O-N 3.24Å
545	A	96.2	Very high	93.9	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-45.8	171.5	0	0	0	0	0	112.2	L533 R541 S542 S549 D591 F594 I595	L533-A545 HydrophobicContact CD2-CB 3.91Å; R541-A545 WeakPolarHBondContact O-CB 3.37Å; R541-A545 PolarHBondContact O-N 2.91Å; S542-A545 PolarHBondContact O-N 3.28Å; A545-S549 PolarHBondContact O-N 3.49Å; A545-D591 HydrophobicContact CB-CB 4.02Å; A545-F594 HydrophobicContact CB-CB 4.47Å; A545-I595 HydrophobicContact CB-CD1 4.09Å
546	Y	96.2	Very high	93.5	Very high	82 Å²	82	40.5 Å²	40.5	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-63.3	-50.6	173.8	169.1	-105.3	0	0	0	112.4	S542 R543 F548 S549 R550 F594	S542-Y546 PolarHBondContact O-N 2.68Å; R543-Y546 PolarHBondContact O-N 3.44Å; Y546-F548 VanDerWaalsContact C-N 3.34Å; Y546-F548 PolarHBondContact O-N 3.12Å; Y546-S549 WeakPolarHBondContact O-CB 3.41Å; Y546-S549 PolarHBondContact O-N 3.24Å; Y546-R550 PolarHBondContact O-N 2.67Å; Y546-F594 HydrophobicContact CD2-CD1 4.21Å; Y546-F594 AromaticContact CD2-CE1 3.63Å; Y546-F594 HydrophobicContact CD2-CE1 3.63Å; Y546-F594 HydrophobicContact CD2-CE2 4.38Å; Y546-F594 AromaticContact CD2-CZ 3.72Å; Y546-F594 HydrophobicContact CD2-CZ 3.72Å; Y546-F594 HydrophobicContact CE2-CE1 4.41Å; Y546-F594 HydrophobicContact CG-CZ 4.4Å
547	L	97.1	Very high	93.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-40	-177.8	-72.3	177	0	0	0	112.1	F503 E504 V507 F527 R543 T544 S549 R550 F551	F503-L547 HydrophobicContact CB-CD1 3.67Å; E504-L547 HydrophobicContact CG-CD1 4.17Å; V507-L547 HydrophobicContact CB-CD2 4.16Å; V507-L547 HydrophobicContact CG1-CD2 4.25Å; V507-L547 HydrophobicContact CG2-CB 3.97Å; V507-L547 HydrophobicContact CG2-CD2 4.19Å; F527-L547 HydrophobicContact CE1-CB 4.03Å; F527-L547 HydrophobicContact CZ-CB 4.46Å; R543-L547 HydrophobicContact CG-CD1 4.01Å; R543-L547 HydrophobicContact CG-CG 4.39Å; R543-L547 WeakPolarHBondContact O-CG 3.35Å; R543-L547 PolarHBondContact O-N 3Å; T544-L547 PolarHBondContact O-N 3.05Å; L547-S549 PolarHBondContact O-N 2.95Å; L547-R550 PolarHBondContact O-N 3.23Å; L547-F551 WeakPolarHBondContact O-CB 3.43Å; L547-F551 PolarHBondContact O-N 2.95Å
548	F	97.1	Very high	93.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.1	-45.8	174.3	177.9	-121	0	0	0	111.4	L524 F527 L528 L533 T544 Y546 R550 F551 V552 I566 I595 T598	L524-F548 HydrophobicContact CD1-CE2 3.67Å; L524-F548 HydrophobicContact CD1-CZ 4.37Å; F527-F548 HydrophobicContact CB-CD2 3.74Å; F527-F548 HydrophobicContact CB-CE2 4.31Å; F527-F548 HydrophobicContact CB-CG 4.4Å; F527-F548 HydrophobicContact CD1-CB 3.71Å; F527-F548 HydrophobicContact CD1-CD2 4.15Å; F527-F548 HydrophobicContact CD1-CG 4.35Å; F527-F548 HydrophobicContact CD2-CD2 4.25Å; F527-F548 HydrophobicContact CE1-CB 4.07Å; F527-F548 HydrophobicContact CG-CB 4.26Å; F527-F548 AromaticContact CG-CD2 3.81Å; F527-F548 HydrophobicContact CG-CD2 3.81Å; F527-F548 HydrophobicContact CG-CG 4.43Å; L528-F548 HydrophobicContact CD2-CE1 4.36Å; L528-F548 HydrophobicContact CD2-CE2 4.31Å; L528-F548 HydrophobicContact CD2-CZ 3.9Å; L533-F548 HydrophobicContact CD1-CD1 4Å; L533-F548 HydrophobicContact CD1-CE1 4.32Å; L533-F548 HydrophobicContact CD1-CG 4.45Å; T544-F548 WeakPolarHBondContact O-CB 3.46Å; T544-F548 PolarHBondContact O-N 3.24Å; Y546-F548 VanDerWaalsContact C-N 3.34Å; Y546-F548 PolarHBondContact O-N 3.12Å; F548-R550 VanDerWaalsContact C-N 3.3Å; F548-R550 PolarHBondContact O-N 3.09Å; F548-F551 PolarHBondContact O-N 3.37Å; F548-V552 HydrophobicContact CD2-CG2 4Å; F548-V552 HydrophobicContact CE1-CG2 4.42Å; F548-V552 HydrophobicContact CE2-CG2 3.54Å; F548-V552 HydrophobicContact CZ-CG2 3.79Å; F548-V552 WeakPolarHBondContact O-CG2 3.13Å; F548-V552 PolarHBondContact O-N 3.18Å; F548-I566 HydrophobicContact CZ-CG2 3.89Å; F548-I595 HydrophobicContact CD1-CD1 4.26Å; F548-T598 HydrophobicContact CD1-CG2 4.14Å; F548-T598 HydrophobicContact CE1-CG2 3.72Å; F548-T598 HydrophobicContact CZ-CG2 4.23Å
549	S	95.3	Very high	93.3	Very high	1 Å²	1	41 Å²	41	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-59.3	-42.2	176.2	-168.6	0	0	0	0	112.4	A545 Y546 L547 K553 T598	A545-S549 PolarHBondContact O-N 3.49Å; Y546-S549 WeakPolarHBondContact O-CB 3.41Å; Y546-S549 PolarHBondContact O-N 3.24Å; L547-S549 PolarHBondContact O-N 2.95Å; S549-K553 WeakPolarHBondContact O-CB 3.43Å; S549-K553 WeakPolarHBondContact O-CD 3.33Å; S549-K553 VanDerWaalsContact O-CG 3.24Å; S549-K553 WeakPolarHBondContact O-CG 3.44Å; S549-K553 PolarHBondContact O-N 3.32Å; S549-K553 VanDerWaalsContact O-N 3.12Å; S549-K553 WeakPolarHBondContact OG-CE 3.3Å; S549-K553 PolarHBondContact OG-NZ 2.74Å; S549-K553 VanDerWaalsContact OG-NZ 3.17Å; S549-T598 WeakPolarHBondContact CA-OG1 3.34Å; S549-T598 WeakPolarHBondContact CB-OG1 3.45Å; S549-T598 PolarHBondContact OG-OG1 3.49Å
550	R	95.5	Very high	93.3	Very high	105 Å²	105	36.9 Å²	36.9	40%	0.396	17%	0.168	S	C	.	.	H	α-helix	trans	-65.9	-46.1	176.8	-176.4	174.6	169.2	-174.2	-0.4	111.9	V507 Y546 L547 F548 V552 K553 S554	V507-R550 HydrophobicContact CG1-CB 4.01Å; V507-R550 HydrophobicContact CG1-CG 3.69Å; Y546-R550 PolarHBondContact O-N 2.67Å; L547-R550 PolarHBondContact O-N 3.23Å; F548-R550 VanDerWaalsContact C-N 3.3Å; F548-R550 PolarHBondContact O-N 3.09Å; R550-V552 PolarHBondContact O-N 3.3Å; R550-K553 PolarHBondContact O-N 3.38Å; R550-S554 PolarHBondContact O-N 2.99Å; R550-S554 VanDerWaalsContact O-N 3.08Å
551	F	95.5	Very high	93.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-48.9	178.6	-171	-111.1	0	0	0	112.1	V506 V507 F513 V523 F527 L547 F548 S554 L555 M559	V506-F551 HydrophobicContact CG1-CD2 4.33Å; V506-F551 HydrophobicContact CG1-CE2 3.95Å; V507-F551 HydrophobicContact CG2-CB 4Å; V507-F551 HydrophobicContact CG2-CD2 4.19Å; V507-F551 HydrophobicContact CG2-CG 4.48Å; F513-F551 HydrophobicContact CD1-CZ 4.39Å; F513-F551 AromaticContact CD2-CE2 3.6Å; F513-F551 HydrophobicContact CD2-CE2 3.6Å; F513-F551 AromaticContact CD2-CZ 3.98Å; F513-F551 HydrophobicContact CD2-CZ 3.98Å; F513-F551 HydrophobicContact CE1-CZ 4.47Å; F513-F551 AromaticContact CE2-CE2 3.61Å; F513-F551 HydrophobicContact CE2-CE2 3.61Å; F513-F551 HydrophobicContact CE2-CZ 4.07Å; F513-F551 HydrophobicContact CG-CE2 4.23Å; F513-F551 HydrophobicContact CG-CZ 4.15Å; F513-F551 HydrophobicContact CZ-CE2 4.23Å; F513-F551 HydrophobicContact CZ-CZ 4.32Å; V523-F551 HydrophobicContact CG1-CE1 4.05Å; V523-F551 HydrophobicContact CG1-CE2 4.33Å; V523-F551 HydrophobicContact CG1-CZ 3.79Å; F527-F551 HydrophobicContact CD2-CD1 4.39Å; F527-F551 HydrophobicContact CE2-CB 4.3Å; F527-F551 HydrophobicContact CE2-CD1 4.01Å; F527-F551 HydrophobicContact CE2-CD2 4.48Å; F527-F551 HydrophobicContact CE2-CE1 4.46Å; F527-F551 HydrophobicContact CE2-CG 4.02Å; F527-F551 HydrophobicContact CZ-CB 4.38Å; L547-F551 WeakPolarHBondContact O-CB 3.43Å; L547-F551 PolarHBondContact O-N 2.95Å; F548-F551 PolarHBondContact O-N 3.37Å; F551-S554 PolarHBondContact O-N 2.71Å; F551-L555 HydrophobicContact CD1-CD1 4.32Å; F551-L555 HydrophobicContact CD2-CD1 4.05Å; F551-L555 HydrophobicContact CE1-CD1 3.8Å; F551-L555 HydrophobicContact CE2-CD1 3.5Å; F551-L555 VanDerWaalsContact CE2-CD1 3.5Å; F551-L555 HydrophobicContact CG-CD1 4.43Å; F551-L555 HydrophobicContact CZ-CD1 3.35Å; F551-L555 PolarHBondContact O-N 3.5Å; F551-L555 VanDerWaalsContact O-N 3.15Å; F551-M559 HydrophobicContact CD1-CE 4.05Å; F551-M559 HydrophobicContact CE1-CE 3.77Å
552	V	94.1	Very high	93	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-41.1	179.4	170.1	0	0	0	0	111.9	F548 R550 S554 L555 N556 T598 L602	F548-V552 HydrophobicContact CD2-CG2 4Å; F548-V552 HydrophobicContact CE1-CG2 4.42Å; F548-V552 HydrophobicContact CE2-CG2 3.54Å; F548-V552 HydrophobicContact CZ-CG2 3.79Å; F548-V552 WeakPolarHBondContact O-CG2 3.13Å; F548-V552 PolarHBondContact O-N 3.18Å; R550-V552 PolarHBondContact O-N 3.3Å; V552-S554 VanDerWaalsContact C-N 3.33Å; V552-S554 PolarHBondContact O-N 2.8Å; V552-L555 PolarHBondContact O-N 3.34Å; V552-N556 PolarHBondContact O-N 3.5Å; V552-T598 HydrophobicContact CB-CG2 3.78Å; V552-T598 HydrophobicContact CG1-CG2 3.73Å; V552-T598 HydrophobicContact CG2-CG2 3.83Å; V552-L602 HydrophobicContact CG1-CD1 4.28Å; V552-L602 HydrophobicContact CG1-CD2 3.43Å; V552-L602 VanDerWaalsContact CG1-CD2 3.43Å; V552-L602 HydrophobicContact CG1-CG 3.67Å
553	K	92.1	Very high	92.9	Very high	71 Å²	71	40.2 Å²	40.2	31%	0.309	19%	0.188	S	C	.	.	H	α-helix	trans	-61.9	-40.6	177.9	-78.1	170.9	-165.9	165.7	0	112.3	S549 R550 E597 V601	S549-K553 WeakPolarHBondContact O-CB 3.43Å; S549-K553 WeakPolarHBondContact O-CD 3.33Å; S549-K553 VanDerWaalsContact O-CG 3.24Å; S549-K553 WeakPolarHBondContact O-CG 3.44Å; S549-K553 PolarHBondContact O-N 3.32Å; S549-K553 VanDerWaalsContact O-N 3.12Å; S549-K553 WeakPolarHBondContact OG-CE 3.3Å; S549-K553 PolarHBondContact OG-NZ 2.74Å; S549-K553 VanDerWaalsContact OG-NZ 3.17Å; R550-K553 PolarHBondContact O-N 3.38Å; K553-E597 WeakPolarHBondContact CE-OE1 3.22Å; K553-E597 IonicContact NZ-OE1 2.68Å; K553-E597 PolarHBondContact NZ-OE1 3.44Å; K553-V601 HydrophobicContact CG-CB 4.43Å; K553-V601 HydrophobicContact CG-CG1 3.88Å; K553-V601 HydrophobicContact CG-CG2 4.03Å
554	S	91.4	Very high	92.6	Very high	43 Å²	43	39.4 Å²	39.4	30%	0.301	19%	0.189	S	C	.	.	H	α-helix	trans	-71.8	-38.3	-179.7	-174	0	0	0	0	112.9	E510 R550 F551 V552 N556	E510-S554 VanDerWaalsContact OE1-CB 3.29Å; E510-S554 WeakPolarHBondContact OE1-CB 3.28Å; E510-S554 PolarHBondContact OE1-OG 3.36Å; E510-S554 WeakPolarHBondContact OE2-CB 3.43Å; E510-S554 PolarHBondContact OE2-OG 3.45Å; R550-S554 PolarHBondContact O-N 2.99Å; R550-S554 VanDerWaalsContact O-N 3.08Å; F551-S554 PolarHBondContact O-N 2.71Å; V552-S554 VanDerWaalsContact C-N 3.33Å; V552-S554 PolarHBondContact O-N 2.8Å; S554-N556 PolarHBondContact O-N 2.92Å
555	L	90.8	Very high	92.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	24.3	-176.9	-62.7	177	0	0	0	113.8	F513 F551 V552 K557 Q558 M559	F513-L555 HydrophobicContact CB-CD1 3.6Å; F513-L555 HydrophobicContact CB-CD2 3.94Å; F513-L555 HydrophobicContact CB-CG 4.44Å; F513-L555 HydrophobicContact CD2-CD1 4.22Å; F513-L555 HydrophobicContact CG-CD1 4.06Å; F551-L555 HydrophobicContact CD1-CD1 4.32Å; F551-L555 HydrophobicContact CD2-CD1 4.05Å; F551-L555 HydrophobicContact CE1-CD1 3.8Å; F551-L555 HydrophobicContact CE2-CD1 3.5Å; F551-L555 VanDerWaalsContact CE2-CD1 3.5Å; F551-L555 HydrophobicContact CG-CD1 4.43Å; F551-L555 HydrophobicContact CZ-CD1 3.35Å; F551-L555 PolarHBondContact O-N 3.5Å; F551-L555 VanDerWaalsContact O-N 3.15Å; V552-L555 PolarHBondContact O-N 3.34Å; L555-K557 PolarHBondContact O-N 3.43Å; L555-Q558 PolarHBondContact O-N 3.3Å; L555-Q558 PolarHBondContact O-OE1 2.91Å; L555-M559 HydrophobicContact CB-CE 3.57Å; L555-M559 HydrophobicContact CB-CG 4.35Å; L555-M559 HydrophobicContact CD1-CE 3.82Å; L555-M559 HydrophobicContact CG-CE 4.35Å; L555-M559 VanDerWaalsContact O-CG 3.26Å; L555-M559 WeakPolarHBondContact O-CG 3.37Å; L555-M559 PolarHBondContact O-N 2.92Å; L555-M559 VanDerWaalsContact O-N 3.16Å
556	N	86.1	Confident	92.3	Very high	52 Å²	52	42.7 Å²	42.7	28%	0.278	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-36	-170.3	64.7	-2.6	0	0	0	114.6	V552 S554 N605	V552-N556 PolarHBondContact O-N 3.5Å; S554-N556 PolarHBondContact O-N 2.92Å; N556-N605 HydrophobicContact CB-CB 4.12Å
557	K	86.6	Confident	92.1	Very high	165 Å²	165	40.1 Å²	40.1	72%	0.717	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-40.5	177.8	-66.1	-178.7	-178.6	-179.9	0	112.9	L555 M559 N560	L555-K557 PolarHBondContact O-N 3.43Å; K557-M559 VanDerWaalsContact C-N 3.3Å; K557-N560 PolarHBondContact O-ND2 3.06Å
558	Q	90.1	Very high	91.8	Very high	48 Å²	48	45 Å²	45	22%	0.224	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-12.2	-177.9	-62.3	81.6	0.9	0	0	112.5	I520 L555 P561	I520-Q558 HydrophobicContact CD1-CB 3.67Å; I520-Q558 HydrophobicContact CD1-CG 4.32Å; L555-Q558 PolarHBondContact O-N 3.3Å; L555-Q558 PolarHBondContact O-OE1 2.91Å; Q558-P561 WeakPolarHBondContact O-CD 3.31Å
559	M	91.1	Very high	91.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-15.4	-177	-70.4	-65.2	156.7	0	0	114.3	I520 F551 L555 K557 P561 F562 I563 I566 L602	I520-M559 HydrophobicContact CG2-CE 3.9Å; I520-M559 HydrophobicContact CG2-SD 4.46Å; F551-M559 HydrophobicContact CD1-CE 4.05Å; F551-M559 HydrophobicContact CE1-CE 3.77Å; L555-M559 HydrophobicContact CB-CE 3.57Å; L555-M559 HydrophobicContact CB-CG 4.35Å; L555-M559 HydrophobicContact CD1-CE 3.82Å; L555-M559 HydrophobicContact CG-CE 4.35Å; L555-M559 VanDerWaalsContact O-CG 3.26Å; L555-M559 WeakPolarHBondContact O-CG 3.37Å; L555-M559 PolarHBondContact O-N 2.92Å; L555-M559 VanDerWaalsContact O-N 3.16Å; K557-M559 VanDerWaalsContact C-N 3.3Å; M559-P561 VanDerWaalsContact C-CD 3.4Å; M559-P561 VanDerWaalsContact O-N 3.16Å; M559-F562 PolarHBondContact O-N 3.16Å; M559-I563 WeakPolarHBondContact O-CG1 3.38Å; M559-I563 PolarHBondContact O-N 2.79Å; M559-I566 HydrophobicContact SD-CD1 4.32Å; M559-L602 HydrophobicContact CB-CD2 3.97Å; M559-L602 HydrophobicContact CG-CD2 4.44Å
560	N	89.4	Confident	91.4	Very high	23 Å²	23	49.9 Å²	49.9	12%	0.123	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-45.8	-45.3	-177	-81.9	-50.4	0	0	0	115.3	K557 F562 S606 E607	K557-N560 PolarHBondContact O-ND2 3.06Å; N560-F562 PolarHBondContact O-N 3.29Å; N560-S606 WeakPolarHBondContact OD1-CA 3.48Å; N560-E607 VanDerWaalsContact ND2-CD 3.32Å; N560-E607 WeakPolarHBondContact ND2-CG 3.5Å; N560-E607 PolarHBondContact ND2-OE1 3.35Å; N560-E607 PolarHBondContact OD1-N 3.42Å
561	P	90.8	Very high	91.1	Very high	105 Å²	105	51.3 Å²	51.3	68%	0.682	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-67.6	-19.2	-179.1	-20.4	34.3	0	0	0	114.3	Q558 M559	Q558-P561 WeakPolarHBondContact O-CD 3.31Å; M559-P561 VanDerWaalsContact C-CD 3.4Å; M559-P561 VanDerWaalsContact O-N 3.16Å
562	F	92.6	Very high	90.8	Very high	49 Å²	49	55.6 Å²	55.6	22%	0.215	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-107.1	-5.8	-170.1	-49.8	-68.1	0	0	0	113.2	I520 P521 L524 M559 N560 E564 D565 I566	I520-F562 HydrophobicContact CG2-CD2 4.31Å; I520-F562 HydrophobicContact CG2-CE2 3.98Å; P521-F562 HydrophobicContact CG-CE1 3.91Å; P521-F562 HydrophobicContact CG-CZ 3.82Å; L524-F562 HydrophobicContact CD2-CB 3.81Å; L524-F562 HydrophobicContact CD2-CD1 4.38Å; L524-F562 HydrophobicContact CD2-CG 4Å; M559-F562 PolarHBondContact O-N 3.16Å; N560-F562 PolarHBondContact O-N 3.29Å; F562-E564 PolarHBondContact O-N 3.28Å; F562-D565 PolarHBondContact O-N 3.44Å; F562-I566 HydrophobicContact CB-CD1 3.78Å; F562-I566 HydrophobicContact CB-CG1 4.2Å; F562-I566 WeakPolarHBondContact O-CB 2.92Å; F562-I566 WeakPolarHBondContact O-CG1 3.45Å; F562-I566 PolarHBondContact O-N 3.29Å
563	I	91.2	Very high	90.5	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-54.8	-52.2	-170.4	-62.7	-176	0	0	0	112.1	M559 I566 L567 L602 S606 Y608	M559-I563 WeakPolarHBondContact O-CG1 3.38Å; M559-I563 PolarHBondContact O-N 2.79Å; I563-I566 PolarHBondContact O-N 3.46Å; I563-L567 HydrophobicContact CG2-CD1 3.79Å; I563-L567 HydrophobicContact CG2-CG 4.25Å; I563-L567 WeakPolarHBondContact O-CB 3.39Å; I563-L567 VanDerWaalsContact O-CG 3.27Å; I563-L567 WeakPolarHBondContact O-CG 3.5Å; I563-L567 PolarHBondContact O-N 3.42Å; I563-L602 HydrophobicContact CG1-CD2 4.23Å; I563-L602 HydrophobicContact CG2-CB 4.28Å; I563-S606 VanDerWaalsContact CD1-CB 3.42Å; I563-Y608 HydrophobicContact CB-CE2 4.45Å; I563-Y608 HydrophobicContact CG2-CE2 4.15Å
564	E	89.3	Confident	90.3	Very high	81 Å²	81	53.3 Å²	53.3	38%	0.379	27%	0.268	S	S	.	.	H	α-helix	trans	-66.1	-40.5	-176.9	-64.6	-163.4	160	0	0	112.4	F562 L567 N568 R612	F562-E564 PolarHBondContact O-N 3.28Å; E564-L567 PolarHBondContact O-N 3.26Å; E564-N568 WeakPolarHBondContact O-CB 3.22Å; E564-N568 PolarHBondContact O-N 3.28Å; E564-N568 PolarHBondContact O-ND2 3.39Å; E564-N568 VanDerWaalsContact O-ND2 3.12Å; E564-R612 IonicContact OE1-CZ 3.04Å; E564-R612 IonicContact OE1-NE 2.8Å; E564-R612 IonicContact OE1-NH2 3.09Å; E564-R612 PolarHBondContact OE1-NH2 3.12Å
565	D	91.9	Very high	89.9	Confident	70 Å²	70	56.6 Å²	56.6	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-65.2	-41.7	176.9	-171.7	37.1	0	0	0	111.3	F562 N568 R569	F562-D565 PolarHBondContact O-N 3.44Å; D565-N568 PolarHBondContact O-N 2.91Å; D565-R569 VanDerWaalsContact CG-NE 3.34Å; D565-R569 WeakPolarHBondContact O-CB 3.17Å; D565-R569 VanDerWaalsContact O-CG 3.26Å; D565-R569 WeakPolarHBondContact O-CG 3.21Å; D565-R569 PolarHBondContact O-N 2.82Å; D565-R569 IonicContact OD1-CZ 2.69Å; D565-R569 IonicContact OD1-NE 3.56Å; D565-R569 PolarHBondContact OD1-NE 2.87Å; D565-R569 IonicContact OD1-NH2 3.11Å; D565-R569 IonicContact OD2-CZ 3.82Å; D565-R569 IonicContact OD2-NE 2.95Å; D565-R569 PolarHBondContact OD2-NE 3.02Å; D565-R569 VanDerWaalsContact OD2-NE 3.14Å; D565-R569 IonicContact OD2-NH2 3.81Å
566	I	93.6	Very high	89.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-51.7	174.7	-65.6	165.9	0	0	0	110.3	L524 L528 F548 M559 F562 I563 N568 R569 I570 L602	L524-I566 HydrophobicContact CD1-CD1 3.89Å; L524-I566 HydrophobicContact CD1-CG1 4.02Å; L524-I566 HydrophobicContact CD2-CD1 3.77Å; L524-I566 HydrophobicContact CD2-CG1 3.78Å; L524-I566 HydrophobicContact CG-CD1 4.43Å; L524-I566 HydrophobicContact CG-CG1 4.33Å; L528-I566 HydrophobicContact CD1-CG1 4.28Å; F548-I566 HydrophobicContact CZ-CG2 3.89Å; M559-I566 HydrophobicContact SD-CD1 4.32Å; F562-I566 HydrophobicContact CB-CD1 3.78Å; F562-I566 HydrophobicContact CB-CG1 4.2Å; F562-I566 WeakPolarHBondContact O-CB 2.92Å; F562-I566 WeakPolarHBondContact O-CG1 3.45Å; F562-I566 PolarHBondContact O-N 3.29Å; I563-I566 PolarHBondContact O-N 3.46Å; I566-N568 VanDerWaalsContact C-N 3.28Å; I566-N568 PolarHBondContact O-N 3.31Å; I566-R569 PolarHBondContact O-N 3.44Å; I566-R569 VanDerWaalsContact O-N 3.14Å; I566-I570 HydrophobicContact CG2-CG2 4.38Å; I566-I570 WeakPolarHBondContact O-CG1 3.36Å; I566-I570 WeakPolarHBondContact O-CG2 3.22Å; I566-I570 PolarHBondContact O-N 3.32Å; I566-L602 HydrophobicContact CB-CD1 4.25Å; I566-L602 HydrophobicContact CD1-CD1 4.4Å; I566-L602 HydrophobicContact CD1-CD2 4.41Å; I566-L602 HydrophobicContact CG2-CD1 3.62Å
567	L	92.1	Very high	88.6	Confident	27 Å²	27	56.6 Å²	56.6	14%	0.141	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-38.6	-178.4	-71	177.8	0	0	0	111.9	I563 E564 I570 Q571 A599 I603 L616	I563-L567 HydrophobicContact CG2-CD1 3.79Å; I563-L567 HydrophobicContact CG2-CG 4.25Å; I563-L567 WeakPolarHBondContact O-CB 3.39Å; I563-L567 VanDerWaalsContact O-CG 3.27Å; I563-L567 WeakPolarHBondContact O-CG 3.5Å; I563-L567 PolarHBondContact O-N 3.42Å; E564-L567 PolarHBondContact O-N 3.26Å; L567-I570 HydrophobicContact CD2-CD1 4.16Å; L567-I570 WeakPolarHBondContact O-CG1 3.43Å; L567-Q571 PolarHBondContact O-N 3.36Å; L567-A599 HydrophobicContact CD2-CB 3.86Å; L567-I603 HydrophobicContact CD1-CG1 4.06Å; L567-L616 HydrophobicContact CD1-CD2 4.41Å
568	N	91.5	Very high	87.7	Confident	104 Å²	104	49.7 Å²	49.7	56%	0.556	25%	0.254	S	S	*	.	H	α-helix	trans	-67	-41.7	175.3	-70.3	-26.3	0	0	0	112	E564 D565 I566 I570 Q571	E564-N568 WeakPolarHBondContact O-CB 3.22Å; E564-N568 PolarHBondContact O-N 3.28Å; E564-N568 PolarHBondContact O-ND2 3.39Å; E564-N568 VanDerWaalsContact O-ND2 3.12Å; D565-N568 PolarHBondContact O-N 2.91Å; I566-N568 VanDerWaalsContact C-N 3.28Å; I566-N568 PolarHBondContact O-N 3.31Å; N568-I570 VanDerWaalsContact C-N 3.33Å; N568-I570 PolarHBondContact O-N 2.95Å; N568-Q571 WeakPolarHBondContact O-CB 3.41Å; N568-Q571 PolarHBondContact O-N 3.3Å
569	R	92.1	Very high	86.2	Confident	102 Å²	102	50.9 Å²	50.9	39%	0.385	27%	0.266	S	S	.	.	H	α-helix	trans	-76.3	-13.6	-178.1	-72.7	176.2	-176.3	-85.5	-0.6	114.8	L528 R534 D565 I566	L528-R569 HydrophobicContact CD1-CB 4.35Å; R534-R569 PolarHBondContact NH1-O 2.99Å; R534-R569 PolarHBondContact NH2-O 3.18Å; D565-R569 VanDerWaalsContact CG-NE 3.34Å; D565-R569 WeakPolarHBondContact O-CB 3.17Å; D565-R569 VanDerWaalsContact O-CG 3.26Å; D565-R569 WeakPolarHBondContact O-CG 3.21Å; D565-R569 PolarHBondContact O-N 2.82Å; D565-R569 IonicContact OD1-CZ 2.69Å; D565-R569 IonicContact OD1-NE 3.56Å; D565-R569 PolarHBondContact OD1-NE 2.87Å; D565-R569 IonicContact OD1-NH2 3.11Å; D565-R569 IonicContact OD2-CZ 3.82Å; D565-R569 IonicContact OD2-NE 2.95Å; D565-R569 PolarHBondContact OD2-NE 3.02Å; D565-R569 VanDerWaalsContact OD2-NE 3.14Å; D565-R569 IonicContact OD2-NH2 3.81Å; I566-R569 PolarHBondContact O-N 3.44Å; I566-R569 VanDerWaalsContact O-N 3.14Å
570	I	92.6	Very high	84.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-2.9	175.2	67.6	179.9	0	0	0	112.5	L528 I566 L567 N568 D572 L573 L574 I595 A599	L528-I570 HydrophobicContact CD2-CG2 3.81Å; I566-I570 HydrophobicContact CG2-CG2 4.38Å; I566-I570 WeakPolarHBondContact O-CG1 3.36Å; I566-I570 WeakPolarHBondContact O-CG2 3.22Å; I566-I570 PolarHBondContact O-N 3.32Å; L567-I570 HydrophobicContact CD2-CD1 4.16Å; L567-I570 WeakPolarHBondContact O-CG1 3.43Å; N568-I570 VanDerWaalsContact C-N 3.33Å; N568-I570 PolarHBondContact O-N 2.95Å; I570-D572 VanDerWaalsContact C-N 3.33Å; I570-D572 PolarHBondContact O-N 3.3Å; I570-L573 HydrophobicContact CG2-CD1 4.49Å; I570-L573 WeakPolarHBondContact O-CA 3.37Å; I570-L573 WeakPolarHBondContact O-CB 3.37Å; I570-L573 PolarHBondContact O-N 3.46Å; I570-L574 HydrophobicContact CD1-CD1 4.27Å; I570-L574 HydrophobicContact CG1-CD1 4.02Å; I570-L574 WeakPolarHBondContact O-CG 3.27Å; I570-L574 PolarHBondContact O-N 3.11Å; I570-I595 HydrophobicContact CB-CG2 4.05Å; I570-I595 HydrophobicContact CD1-CG2 4.01Å; I570-I595 HydrophobicContact CG1-CG2 4.43Å; I570-I595 HydrophobicContact CG2-CG2 4.46Å; I570-A599 HydrophobicContact CD1-CB 4.06Å
571	Q	89	Confident	82.9	Confident	135 Å²	135	58 Å²	58	63%	0.631	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-60.1	-40	-171.6	-171	177.1	7.2	0	0	113.2	L567 N568 L573 L574	L567-Q571 PolarHBondContact O-N 3.36Å; N568-Q571 WeakPolarHBondContact O-CB 3.41Å; N568-Q571 PolarHBondContact O-N 3.3Å; Q571-L573 VanDerWaalsContact C-N 3.3Å; Q571-L573 PolarHBondContact O-N 2.89Å; Q571-L574 PolarHBondContact O-N 3.48Å
572	D	88.3	Confident	81.2	Confident	90 Å²	90	56.4 Å²	56.4	48%	0.481	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-67.4	-27.3	173.8	60.3	-38.5	0	0	0	113	R534 I570 L574	R534-D572 IonicContact CZ-OD1 3.7Å; R534-D572 IonicContact CZ-OD2 2.64Å; R534-D572 IonicContact NE-OD2 3.15Å; R534-D572 IonicContact NH2-OD1 2.76Å; R534-D572 PolarHBondContact NH2-OD1 3.38Å; R534-D572 IonicContact NH2-OD2 3.8Å; R534-D572 PolarHBondContact NH2-OD2 3.4Å; I570-D572 VanDerWaalsContact C-N 3.33Å; I570-D572 PolarHBondContact O-N 3.3Å; D572-L574 VanDerWaalsContact C-N 3.32Å
573	L	89.1	Confident	79.5	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.026	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-78.6	-17.7	177	-54.8	179.9	0	0	0	112.9	L533 I570 Q571 E575 L586 L587 Q592	L533-L573 HydrophobicContact CB-CD1 3.93Å; L533-L573 HydrophobicContact CD1-CD1 3.84Å; L533-L573 HydrophobicContact CG-CD1 4.46Å; I570-L573 HydrophobicContact CG2-CD1 4.49Å; I570-L573 WeakPolarHBondContact O-CA 3.37Å; I570-L573 WeakPolarHBondContact O-CB 3.37Å; I570-L573 PolarHBondContact O-N 3.46Å; Q571-L573 VanDerWaalsContact C-N 3.3Å; Q571-L573 PolarHBondContact O-N 2.89Å; L573-E575 VanDerWaalsContact C-N 3.34Å; L573-L586 HydrophobicContact CD2-CD2 3.76Å; L573-L587 HydrophobicContact CB-CD1 4.05Å; L573-L587 HydrophobicContact CD1-CD1 4.35Å; L573-L587 HydrophobicContact CD2-CD1 4.41Å; L573-L587 HydrophobicContact CD2-CG 4.49Å; L573-Q592 PolarHBondContact O-NE2 3.42Å
574	L	86.8	Confident	78.1	Confident	19 Å²	19	70.4 Å²	70.4	10%	0.099	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-89.4	3.9	179.8	-66.3	168.8	0	0	0	112.6	I570 Q571 D572 L576 I595 Y596 L620	I570-L574 HydrophobicContact CD1-CD1 4.27Å; I570-L574 HydrophobicContact CG1-CD1 4.02Å; I570-L574 WeakPolarHBondContact O-CG 3.27Å; I570-L574 PolarHBondContact O-N 3.11Å; Q571-L574 PolarHBondContact O-N 3.48Å; D572-L574 VanDerWaalsContact C-N 3.32Å; L574-L576 PolarHBondContact O-N 3.47Å; L574-I595 HydrophobicContact CD2-CB 4.23Å; L574-I595 HydrophobicContact CD2-CG2 3.7Å; L574-I595 HydrophobicContact CG-CG2 4.19Å; L574-Y596 HydrophobicContact CB-CE2 4.34Å; L574-Y596 HydrophobicContact CD2-CD1 3.84Å; L574-Y596 HydrophobicContact CD2-CD2 3.6Å; L574-Y596 HydrophobicContact CD2-CE1 3.81Å; L574-Y596 HydrophobicContact CD2-CE2 3.59Å; L574-Y596 HydrophobicContact CD2-CG 3.74Å; L574-Y596 PolarHBondContact O-OH 3.2Å; L574-L620 HydrophobicContact CD1-CD1 3.6Å
575	E	83.3	Confident	77.3	Confident	111 Å²	111	68.7 Å²	68.7	52%	0.519	37%	0.367	S	S	.	.			trans	-72.8	121.3	-177.3	-173.4	161.1	-159.4	0	0	112.4	L573 S577 Q592 K627	L573-E575 VanDerWaalsContact C-N 3.34Å; E575-S577 PolarHBondContact O-N 3.22Å; E575-Q592 PolarHBondContact O-NE2 2.98Å; E575-Q592 VanDerWaalsContact O-NE2 3.16Å; E575-K627 VanDerWaalsContact CG-NZ 3.34Å; E575-K627 IonicContact OE1-NZ 2.72Å; E575-K627 PolarHBondContact OE1-NZ 3.39Å
576	L	80.5	Confident	76.8	Confident	7 Å²	7	68.9 Å²	68.9	4%	0.037	37%	0.368	C	S	.	.			trans	-69.7	110.4	166.7	-170.1	75.8	0	0	0	109.1	L574 L624 K627 L631 H653 A654 F657	L574-L576 PolarHBondContact O-N 3.47Å; L576-L624 HydrophobicContact CB-CD2 4.14Å; L576-L624 HydrophobicContact CD2-CD2 4.46Å; L576-K627 HydrophobicContact CB-CD 4.09Å; L576-K627 HydrophobicContact CD2-CB 4.18Å; L576-K627 HydrophobicContact CD2-CD 4.49Å; L576-K627 PolarHBondContact O-NZ 3.33Å; L576-L631 HydrophobicContact CD2-CD1 3.74Å; L576-H653 HydrophobicContact CD1-CB 4.38Å; L576-A654 HydrophobicContact CD1-CB 4.39Å; L576-A654 HydrophobicContact CD2-CB 3.95Å; L576-F657 HydrophobicContact CD1-CD2 4.22Å; L576-F657 HydrophobicContact CD1-CE2 3.72Å
577	S	69.9	Low	76.4	Confident	45 Å²	45	69 Å²	69	32%	0.315	37%	0.368	S	S	.	.			trans	-103.6	110.2	-178.2	-62.6	0	0	0	0	110.2	E575	E575-S577 PolarHBondContact O-N 3.22Å
578	P	65.9	Low	76.2	Confident	20 Å²	20	70.2 Å²	70.2	13%	0.13	38%	0.379	C	S	.	.			trans	-68.8	146.9	174.6	-11.8	26.6	0	0	0	110.5	E580 N581 L631	P578-E580 PolarHBondContact O-N 3.31Å; P578-N581 PolarHBondContact O-N 3.45Å; P578-L631 HydrophobicContact CB-CD2 4.2Å; P578-L631 HydrophobicContact CG-CD2 4.15Å
579	P	59.3	Low	76	Confident	73 Å²	73	66.9 Å²	66.9	47%	0.474	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-61.1	-19.4	-178.2	19.6	-28.5	0	0	0	113.8	N581 S646	P579-N581 PolarHBondContact O-N 3.4Å; P579-S646 WeakPolarHBondContact CG-OG 3.21Å
580	E	55.4	Low	75.9	Confident	71 Å²	71	67.3 Å²	67.3	33%	0.332	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-65.9	-19.3	-179.2	-58.3	-176.4	153.2	0	0	114.4	P578 G582 K634 R643	P578-E580 PolarHBondContact O-N 3.31Å; E580-G582 PolarHBondContact O-N 3.42Å; E580-K634 IonicContact OE2-NZ 3.73Å; E580-K634 PolarHBondContact OE2-NZ 3.03Å; E580-R643 IonicContact OE1-CZ 3.22Å; E580-R643 IonicContact OE1-NE 2.69Å; E580-R643 PolarHBondContact OE1-NE 3.11Å; E580-R643 IonicContact OE1-NH2 2.75Å; E580-R643 PolarHBondContact OE1-NH2 3.44Å
581	N	56.6	Low	75.9	Confident	102 Å²	102	67.9 Å²	67.9	55%	0.545	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-84.2	-6.1	-172.2	-74.7	-7.2	0	0	0	114.3	P578 P579 H583	P578-N581 PolarHBondContact O-N 3.45Å; P579-N581 PolarHBondContact O-N 3.4Å; N581-H583 PolarHBondContact O-N 3.28Å
582	G	54.4	Low	76.1	Confident	72 Å²	72	61.8 Å²	61.8	74%	0.742	35%	0.348	S	S	*	.			trans	62.3	2	-176.4	0	0	0	0	0	114.9	E580	E580-G582 PolarHBondContact O-N 3.42Å
583	H	57.3	Low	76.3	Confident	152 Å²	152	58.9 Å²	58.9	70%	0.704	33%	0.333	S	S	*	.			trans	-95.5	114.7	176.2	-69.1	-35.8	0	0	0	109.2	N581 S585	N581-H583 PolarHBondContact O-N 3.28Å; H583-S585 PolarHBondContact O-N 2.85Å
584	Q	61.5	Low	76.6	Confident	192 Å²	192	61.3 Å²	61.3	90%	0.897	34%	0.343	S	S	*	.			trans	-68.6	125.3	168.9	-70.5	180	-13.6	0	0	108.7
585	S	72	Confident	77	Confident	45 Å²	45	60.4 Å²	60.4	32%	0.315	34%	0.338	S	S	.	.			trans	-60	144.3	171.7	54.2	0	0	0	0	109.8	H583 L587	H583-S585 PolarHBondContact O-N 2.85Å; S585-L587 VanDerWaalsContact C-N 3.26Å; S585-L587 WeakPolarHBondContact CB-O 3.46Å; S585-L587 PolarHBondContact O-N 3.32Å; S585-L587 PolarHBondContact OG-O 2.86Å
586	L	81.4	Confident	77.5	Confident	75 Å²	75	55.4 Å²	55.4	39%	0.393	32%	0.315	S	S	.	.	S	Bend	trans	-61.2	-40.3	-179.7	-172.4	67.2	0	0	0	111.2	R534 R541 L573	R534-L586 HydrophobicContact CB-CD2 4.22Å; R534-L586 HydrophobicContact CG-CD2 3.87Å; R541-L586 VanDerWaalsContact CZ-O 3.28Å; R541-L586 PolarHBondContact NE-O 2.94Å; R541-L586 PolarHBondContact NH2-O 3.49Å; L573-L586 HydrophobicContact CD2-CD2 3.76Å
587	L	85.2	Confident	78.2	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.016	32%	0.318	C	S	.	.	S	Bend	trans	-102.8	147.6	175.5	-63.9	-176.5	0	0	0	110.5	R541 L573 S585 D591 Q592 I595	R541-L587 HydrophobicContact CB-CD2 3.91Å; L573-L587 HydrophobicContact CB-CD1 4.05Å; L573-L587 HydrophobicContact CD1-CD1 4.35Å; L573-L587 HydrophobicContact CD2-CD1 4.41Å; L573-L587 HydrophobicContact CD2-CG 4.49Å; S585-L587 VanDerWaalsContact C-N 3.26Å; S585-L587 WeakPolarHBondContact CB-O 3.46Å; S585-L587 PolarHBondContact O-N 3.32Å; S585-L587 PolarHBondContact OG-O 2.86Å; L587-D591 HydrophobicContact CB-CB 4.1Å; L587-D591 HydrophobicContact CD2-CB 4.4Å; L587-Q592 HydrophobicContact CB-CG 3.91Å; L587-I595 HydrophobicContact CD1-CD1 4.35Å; L587-I595 HydrophobicContact CD1-CG1 3.7Å
588	S	88.6	Confident	79.4	Confident	52 Å²	52	54 Å²	54	36%	0.364	30%	0.303	S	S	.	.			trans	-68.2	161.4	168.1	72.5	0	0	0	0	110.5	D590 D591 Q592	S588-D590 PolarHBondContact O-N 3.32Å; S588-D591 PolarHBondContact N-OD2 3.44Å; S588-D591 PolarHBondContact O-N 3.33Å; S588-D591 VanDerWaalsContact O-N 3.16Å; S588-D591 PolarHBondContact OG-N 2.84Å; S588-D591 VanDerWaalsContact OG-N 3.16Å; S588-D591 PolarHBondContact OG-OD2 3.49Å; S588-Q592 WeakPolarHBondContact O-CG 3.44Å; S588-Q592 PolarHBondContact O-N 3.24Å
589	S	87	Confident	80.8	Confident	33 Å²	33	53 Å²	53	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-34.9	176.7	-56.4	0	0	0	0	112.1	Q592 L593 H653 F657	S589-Q592 PolarHBondContact O-N 3.1Å; S589-L593 PolarHBondContact O-N 3.45Å; S589-H653 VanDerWaalsContact CB-CE1 3.42Å; S589-H653 WeakPolarHBondContact CB-CE1 2.76Å; S589-H653 PolarHBondContact OG-CE1 3.02Å; S589-H653 VanDerWaalsContact OG-CE1 3.23Å; S589-H653 PolarHBondContact OG-ND1 3.19Å; S589-H653 VanDerWaalsContact OG-ND1 3.17Å; S589-F657 WeakPolarHBondContact O-CE1 3.38Å
590	D	89.6	Confident	82.4	Confident	112 Å²	112	49.5 Å²	49.5	60%	0.599	27%	0.274	S	S	*	.	H	α-helix	trans	-66.7	-39.4	174.7	-73.8	-36.8	0	0	0	112.6	S588 L593	S588-D590 PolarHBondContact O-N 3.32Å; D590-L593 VanDerWaalsContact O-CB 3.3Å; D590-L593 WeakPolarHBondContact O-CB 3.26Å; D590-L593 PolarHBondContact O-N 3.49Å
591	D	92.1	Very high	84.2	Confident	11 Å²	11	46.7 Å²	46.7	6%	0.059	26%	0.261	C	S	.	.	H	α-helix	trans	-67.7	-38.2	177.1	-60.9	-37.8	0	0	0	111.6	S542 A545 L587 S588 L593 F594 I595	S542-D591 VanDerWaalsContact CA-CG 3.46Å; S542-D591 WeakPolarHBondContact CA-OD1 3.33Å; S542-D591 WeakPolarHBondContact CA-OD2 3.49Å; S542-D591 WeakPolarHBondContact CB-OD1 3.49Å; S542-D591 WeakPolarHBondContact CB-OD2 3.45Å; S542-D591 PolarHBondContact OG-OD1 3.45Å; A545-D591 HydrophobicContact CB-CB 4.02Å; L587-D591 HydrophobicContact CB-CB 4.1Å; L587-D591 HydrophobicContact CD2-CB 4.4Å; S588-D591 PolarHBondContact N-OD2 3.44Å; S588-D591 PolarHBondContact O-N 3.33Å; S588-D591 VanDerWaalsContact O-N 3.16Å; S588-D591 PolarHBondContact OG-N 2.84Å; S588-D591 VanDerWaalsContact OG-N 3.16Å; S588-D591 PolarHBondContact OG-OD2 3.49Å; D591-L593 PolarHBondContact O-N 3.16Å; D591-F594 WeakPolarHBondContact O-CB 3.13Å; D591-F594 PolarHBondContact O-N 3.05Å; D591-I595 PolarHBondContact O-N 3Å
592	Q	93.1	Very high	86	Confident	8 Å²	8	42 Å²	42	4%	0.037	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-31.8	175.1	-74.2	-175.6	-37.5	0	0	112.1	L573 E575 L587 S588 S589 F594 I595 Y596 F657	L573-Q592 PolarHBondContact O-NE2 3.42Å; E575-Q592 PolarHBondContact O-NE2 2.98Å; E575-Q592 VanDerWaalsContact O-NE2 3.16Å; L587-Q592 HydrophobicContact CB-CG 3.91Å; S588-Q592 WeakPolarHBondContact O-CG 3.44Å; S588-Q592 PolarHBondContact O-N 3.24Å; S589-Q592 PolarHBondContact O-N 3.1Å; Q592-F594 PolarHBondContact O-N 2.83Å; Q592-I595 PolarHBondContact O-N 3.31Å; Q592-Y596 WeakPolarHBondContact O-CD2 3.4Å; Q592-Y596 PolarHBondContact O-N 3.48Å; Q592-F657 HydrophobicContact CB-CD1 4.39Å; Q592-F657 HydrophobicContact CB-CE1 3.53Å; Q592-F657 HydrophobicContact CB-CZ 3.65Å; Q592-F657 HydrophobicContact CG-CZ 4.49Å; Q592-F657 VanDerWaalsContact OE1-CZ 3.22Å
593	L	93.3	Very high	87.8	Confident	29 Å²	29	38.7 Å²	38.7	15%	0.152	20%	0.202	C	C	.	.	H	α-helix	trans	-56.2	-38.8	174	-64.7	169.6	0	0	0	111.5	S589 D590 D591 E597 F657 R660	S589-L593 PolarHBondContact O-N 3.45Å; D590-L593 VanDerWaalsContact O-CB 3.3Å; D590-L593 WeakPolarHBondContact O-CB 3.26Å; D590-L593 PolarHBondContact O-N 3.49Å; D591-L593 PolarHBondContact O-N 3.16Å; L593-E597 VanDerWaalsContact O-CB 3.26Å; L593-E597 WeakPolarHBondContact O-CB 3.26Å; L593-E597 PolarHBondContact O-N 2.93Å; L593-F657 HydrophobicContact CD2-CD1 3.58Å; L593-F657 HydrophobicContact CD2-CE1 3.82Å; L593-F657 HydrophobicContact CG-CD1 4.23Å; L593-F657 HydrophobicContact CG-CE1 4.05Å; L593-R660 HydrophobicContact CB-CG 3.96Å; L593-R660 HydrophobicContact CD2-CG 3.53Å; L593-R660 HydrophobicContact CG-CG 4.29Å
594	F	94.8	Very high	89.4	Confident	55 Å²	55	32.1 Å²	32.1	24%	0.241	17%	0.172	C	C	.	.	H	α-helix	trans	-68.7	-37.4	176.4	-66	-60.5	0	0	0	112.2	A545 Y546 D591 Q592 E597 T598	A545-F594 HydrophobicContact CB-CB 4.47Å; Y546-F594 HydrophobicContact CD2-CD1 4.21Å; Y546-F594 AromaticContact CD2-CE1 3.63Å; Y546-F594 HydrophobicContact CD2-CE1 3.63Å; Y546-F594 HydrophobicContact CD2-CE2 4.38Å; Y546-F594 AromaticContact CD2-CZ 3.72Å; Y546-F594 HydrophobicContact CD2-CZ 3.72Å; Y546-F594 HydrophobicContact CE2-CE1 4.41Å; Y546-F594 HydrophobicContact CG-CZ 4.4Å; D591-F594 WeakPolarHBondContact O-CB 3.13Å; D591-F594 PolarHBondContact O-N 3.05Å; Q592-F594 PolarHBondContact O-N 2.83Å; F594-E597 PolarHBondContact O-N 3.23Å; F594-T598 WeakPolarHBondContact O-CB 3.37Å; F594-T598 PolarHBondContact O-N 3.01Å; F594-T598 PolarHBondContact O-OG1 3.17Å
595	I	95.3	Very high	90.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68.7	-44.8	179.1	-52	-53.7	0	0	0	110.8	L533 A545 F548 I570 L574 L587 D591 Q592 E597 T598 A599	L533-I595 HydrophobicContact CD1-CD1 4.1Å; L533-I595 HydrophobicContact CD2-CD1 3.82Å; A545-I595 HydrophobicContact CB-CD1 4.09Å; F548-I595 HydrophobicContact CD1-CD1 4.26Å; I570-I595 HydrophobicContact CB-CG2 4.05Å; I570-I595 HydrophobicContact CD1-CG2 4.01Å; I570-I595 HydrophobicContact CG1-CG2 4.43Å; I570-I595 HydrophobicContact CG2-CG2 4.46Å; L574-I595 HydrophobicContact CD2-CB 4.23Å; L574-I595 HydrophobicContact CD2-CG2 3.7Å; L574-I595 HydrophobicContact CG-CG2 4.19Å; L587-I595 HydrophobicContact CD1-CD1 4.35Å; L587-I595 HydrophobicContact CD1-CG1 3.7Å; D591-I595 PolarHBondContact O-N 3Å; Q592-I595 PolarHBondContact O-N 3.31Å; I595-E597 PolarHBondContact O-N 3.29Å; I595-T598 WeakPolarHBondContact O-CB 3.38Å; I595-T598 PolarHBondContact O-N 2.86Å; I595-A599 PolarHBondContact O-N 3.38Å
596	Y	95.1	Very high	91.6	Very high	6 Å²	6	24.2 Å²	24.2	2%	0.024	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-43.6	173.1	-87.2	-77.4	0	0	0	112.4	L574 Q592 T598 A599 G600 L620 L624 F657 T661	L574-Y596 HydrophobicContact CB-CE2 4.34Å; L574-Y596 HydrophobicContact CD2-CD1 3.84Å; L574-Y596 HydrophobicContact CD2-CD2 3.6Å; L574-Y596 HydrophobicContact CD2-CE1 3.81Å; L574-Y596 HydrophobicContact CD2-CE2 3.59Å; L574-Y596 HydrophobicContact CD2-CG 3.74Å; L574-Y596 PolarHBondContact O-OH 3.2Å; Q592-Y596 WeakPolarHBondContact O-CD2 3.4Å; Q592-Y596 PolarHBondContact O-N 3.48Å; Y596-T598 VanDerWaalsContact C-N 3.28Å; Y596-T598 PolarHBondContact O-N 3.39Å; Y596-A599 PolarHBondContact O-N 2.93Å; Y596-G600 PolarHBondContact O-N 3.25Å; Y596-L620 HydrophobicContact CD1-CD1 4.07Å; Y596-L620 HydrophobicContact CD1-CD2 4.5Å; Y596-L620 HydrophobicContact CD1-CG 4.31Å; Y596-L620 HydrophobicContact CE1-CD1 3.85Å; Y596-L620 HydrophobicContact CE1-CG 4.25Å; Y596-L624 HydrophobicContact CD1-CD1 4.35Å; Y596-L624 HydrophobicContact CE1-CD1 3.5Å; Y596-L624 HydrophobicContact CE1-CG 4.3Å; Y596-L624 WeakPolarHBondContact OH-CD2 3.39Å; Y596-L624 WeakPolarHBondContact OH-CG 3.27Å; Y596-F657 HydrophobicContact CD1-CB 4.04Å; Y596-F657 HydrophobicContact CD2-CB 3.56Å; Y596-F657 AromaticContact CD2-CD1 3.47Å; Y596-F657 HydrophobicContact CD2-CD1 3.47Å; Y596-F657 VanDerWaalsContact CD2-CD1 3.47Å; Y596-F657 HydrophobicContact CD2-CD2 4.04Å; Y596-F657 HydrophobicContact CD2-CE1 4.21Å; Y596-F657 AromaticContact CD2-CG 3.41Å; Y596-F657 HydrophobicContact CD2-CG 3.41Å; Y596-F657 VanDerWaalsContact CD2-CG 3.41Å; Y596-F657 HydrophobicContact CE1-CB 4.15Å; Y596-F657 HydrophobicContact CE2-CB 3.67Å; Y596-F657 AromaticContact CE2-CD1 3.85Å; Y596-F657 HydrophobicContact CE2-CD1 3.85Å; Y596-F657 AromaticContact CE2-CD2 3.53Å; Y596-F657 HydrophobicContact CE2-CD2 3.53Å; Y596-F657 HydrophobicContact CE2-CE1 4.43Å; Y596-F657 HydrophobicContact CE2-CE2 4.12Å; Y596-F657 AromaticContact CE2-CG 3.4Å; Y596-F657 HydrophobicContact CE2-CG 3.4Å; Y596-F657 HydrophobicContact CG-CB 3.74Å; Y596-F657 HydrophobicContact CG-CD1 4.27Å; Y596-F657 HydrophobicContact CG-CG 4.13Å; Y596-T661 HydrophobicContact CD1-CG2 3.89Å
597	E	94.8	Very high	92	Very high	22 Å²	22	28.4 Å²	28.4	10%	0.103	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-40.1	175.2	-170.8	168.9	160.6	0	0	111.2	K553 L593 F594 I595 G600 V601 R660 K663	K553-E597 WeakPolarHBondContact CE-OE1 3.22Å; K553-E597 IonicContact NZ-OE1 2.68Å; K553-E597 PolarHBondContact NZ-OE1 3.44Å; L593-E597 VanDerWaalsContact O-CB 3.26Å; L593-E597 WeakPolarHBondContact O-CB 3.26Å; L593-E597 PolarHBondContact O-N 2.93Å; F594-E597 PolarHBondContact O-N 3.23Å; I595-E597 PolarHBondContact O-N 3.29Å; E597-G600 PolarHBondContact O-N 3.1Å; E597-V601 WeakPolarHBondContact O-CB 3.39Å; E597-V601 VanDerWaalsContact O-CG2 3.25Å; E597-V601 WeakPolarHBondContact O-CG2 3.47Å; E597-V601 PolarHBondContact O-N 3.44Å; E597-R660 HydrophobicContact CB-CB 4.36Å; E597-R660 IonicContact OE2-CZ 3.38Å; E597-R660 IonicContact OE2-NH1 3.06Å; E597-R660 PolarHBondContact OE2-NH1 3.31Å; E597-K663 HydrophobicContact CG-CB 4.36Å
598	T	94.7	Very high	92.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.1	-45.6	177.4	-54.7	0	0	0	0	112	F548 S549 V552 F594 I595 Y596 G600 V601 L602	F548-T598 HydrophobicContact CD1-CG2 4.14Å; F548-T598 HydrophobicContact CE1-CG2 3.72Å; F548-T598 HydrophobicContact CZ-CG2 4.23Å; S549-T598 WeakPolarHBondContact CA-OG1 3.34Å; S549-T598 WeakPolarHBondContact CB-OG1 3.45Å; S549-T598 PolarHBondContact OG-OG1 3.49Å; V552-T598 HydrophobicContact CB-CG2 3.78Å; V552-T598 HydrophobicContact CG1-CG2 3.73Å; V552-T598 HydrophobicContact CG2-CG2 3.83Å; F594-T598 WeakPolarHBondContact O-CB 3.37Å; F594-T598 PolarHBondContact O-N 3.01Å; F594-T598 PolarHBondContact O-OG1 3.17Å; I595-T598 WeakPolarHBondContact O-CB 3.38Å; I595-T598 PolarHBondContact O-N 2.86Å; Y596-T598 VanDerWaalsContact C-N 3.28Å; Y596-T598 PolarHBondContact O-N 3.39Å; T598-G600 VanDerWaalsContact C-N 3.32Å; T598-G600 PolarHBondContact O-N 3.29Å; T598-V601 PolarHBondContact O-N 2.9Å; T598-L602 HydrophobicContact CG2-CD1 4.21Å; T598-L602 WeakPolarHBondContact O-CG 3.45Å; T598-L602 PolarHBondContact O-N 3.41Å
599	A	94.7	Very high	92.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.8	-44.6	174.8	0	0	0	0	0	111.3	L567 I570 I595 Y596 L602 I603 L620	L567-A599 HydrophobicContact CD2-CB 3.86Å; I570-A599 HydrophobicContact CD1-CB 4.06Å; I595-A599 PolarHBondContact O-N 3.38Å; Y596-A599 PolarHBondContact O-N 2.93Å; A599-L602 PolarHBondContact O-N 3.09Å; A599-I603 WeakPolarHBondContact O-CD1 3.46Å; A599-I603 VanDerWaalsContact O-CG1 3.27Å; A599-I603 WeakPolarHBondContact O-CG1 3.34Å; A599-I603 PolarHBondContact O-N 2.85Å; A599-L620 HydrophobicContact CB-CD1 4.27Å; A599-L620 HydrophobicContact CB-CD2 3.79Å
600	G	93.7	Very high	92.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-47.2	174.5	0	0	0	0	0	112.7	Y596 E597 T598 L602 I603 V604	Y596-G600 PolarHBondContact O-N 3.25Å; E597-G600 PolarHBondContact O-N 3.1Å; T598-G600 VanDerWaalsContact C-N 3.32Å; T598-G600 PolarHBondContact O-N 3.29Å; G600-L602 PolarHBondContact O-N 3.14Å; G600-I603 PolarHBondContact O-N 3.26Å; G600-V604 WeakPolarHBondContact O-CB 3.46Å; G600-V604 VanDerWaalsContact O-CG2 3.26Å; G600-V604 WeakPolarHBondContact O-CG2 3.4Å; G600-V604 PolarHBondContact O-N 3.36Å
601	V	93.2	Very high	92.8	Very high	11 Å²	11	35.4 Å²	35.4	7%	0.067	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-42.6	178.7	167.1	0	0	0	0	112	K553 E597 T598 N605 A664	K553-V601 HydrophobicContact CG-CB 4.43Å; K553-V601 HydrophobicContact CG-CG1 3.88Å; K553-V601 HydrophobicContact CG-CG2 4.03Å; E597-V601 WeakPolarHBondContact O-CB 3.39Å; E597-V601 VanDerWaalsContact O-CG2 3.25Å; E597-V601 WeakPolarHBondContact O-CG2 3.47Å; E597-V601 PolarHBondContact O-N 3.44Å; T598-V601 PolarHBondContact O-N 2.9Å; V601-N605 WeakPolarHBondContact CG1-ND2 3.45Å; V601-N605 WeakPolarHBondContact O-CB 3.24Å; V601-N605 PolarHBondContact O-N 3.29Å; V601-N605 PolarHBondContact O-ND2 3.16Å; V601-A664 HydrophobicContact CB-CB 4.47Å; V601-A664 HydrophobicContact CG2-CB 3.91Å
602	L	93.3	Very high	92.9	Very high	5 Å²	5	40 Å²	40	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-48.5	177.3	-72.8	167.2	0	0	0	111.3	V552 M559 I563 I566 T598 A599 G600 V604 S606	V552-L602 HydrophobicContact CG1-CD1 4.28Å; V552-L602 HydrophobicContact CG1-CD2 3.43Å; V552-L602 VanDerWaalsContact CG1-CD2 3.43Å; V552-L602 HydrophobicContact CG1-CG 3.67Å; M559-L602 HydrophobicContact CB-CD2 3.97Å; M559-L602 HydrophobicContact CG-CD2 4.44Å; I563-L602 HydrophobicContact CG1-CD2 4.23Å; I563-L602 HydrophobicContact CG2-CB 4.28Å; I566-L602 HydrophobicContact CB-CD1 4.25Å; I566-L602 HydrophobicContact CD1-CD1 4.4Å; I566-L602 HydrophobicContact CD1-CD2 4.41Å; I566-L602 HydrophobicContact CG2-CD1 3.62Å; T598-L602 HydrophobicContact CG2-CD1 4.21Å; T598-L602 WeakPolarHBondContact O-CG 3.45Å; T598-L602 PolarHBondContact O-N 3.41Å; A599-L602 PolarHBondContact O-N 3.09Å; G600-L602 PolarHBondContact O-N 3.14Å; L602-V604 PolarHBondContact O-N 2.9Å; L602-S606 WeakPolarHBondContact O-CB 3.35Å; L602-S606 PolarHBondContact O-N 3.47Å; L602-S606 VanDerWaalsContact O-N 3.08Å
603	I	92.9	Very high	92.9	Very high	2 Å²	2	41 Å²	41	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-62.4	-47.3	-179.2	-65.3	164.7	0	0	0	110.6	L567 A599 G600 S606 K613 L616 M617 L620	L567-I603 HydrophobicContact CD1-CG1 4.06Å; A599-I603 WeakPolarHBondContact O-CD1 3.46Å; A599-I603 VanDerWaalsContact O-CG1 3.27Å; A599-I603 WeakPolarHBondContact O-CG1 3.34Å; A599-I603 PolarHBondContact O-N 2.85Å; G600-I603 PolarHBondContact O-N 3.26Å; I603-S606 PolarHBondContact O-N 3.47Å; I603-S606 PolarHBondContact O-OG 2.99Å; I603-K613 HydrophobicContact CG2-CB 4.17Å; I603-K613 WeakPolarHBondContact CG2-O 3.19Å; I603-L616 HydrophobicContact CD1-CB 4Å; I603-L616 HydrophobicContact CG1-CB 4Å; I603-L616 HydrophobicContact CG2-CB 4.09Å; I603-M617 HydrophobicContact CB-CE 4.22Å; I603-M617 HydrophobicContact CD1-CE 4.22Å; I603-M617 HydrophobicContact CG2-CB 4.44Å; I603-M617 HydrophobicContact CG2-CE 4.12Å; I603-L620 HydrophobicContact CD1-CD2 4.11Å
604	V	91.5	Very high	92.9	Very high	13 Å²	13	41.8 Å²	41.8	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-43.3	-175.9	174.1	0	0	0	0	112.1	G600 L602 S606 K613 M617 A664 F665	G600-V604 WeakPolarHBondContact O-CB 3.46Å; G600-V604 VanDerWaalsContact O-CG2 3.26Å; G600-V604 WeakPolarHBondContact O-CG2 3.4Å; G600-V604 PolarHBondContact O-N 3.36Å; L602-V604 PolarHBondContact O-N 2.9Å; V604-S606 VanDerWaalsContact C-N 3.31Å; V604-S606 PolarHBondContact O-N 2.87Å; V604-K613 PolarHBondContact O-NZ 3.05Å; V604-M617 HydrophobicContact CG2-CE 4.34Å; V604-A664 HydrophobicContact CB-CB 3.98Å; V604-A664 HydrophobicContact CG1-CB 4.46Å; V604-A664 HydrophobicContact CG2-CB 3.73Å; V604-F665 HydrophobicContact CB-CE1 4.28Å; V604-F665 HydrophobicContact CG1-CD1 3.99Å; V604-F665 HydrophobicContact CG1-CE1 3.94Å; V604-F665 HydrophobicContact CG2-CD1 3.92Å; V604-F665 HydrophobicContact CG2-CD2 4.38Å; V604-F665 HydrophobicContact CG2-CE1 3.3Å; V604-F665 HydrophobicContact CG2-CE2 3.79Å; V604-F665 HydrophobicContact CG2-CG 4.44Å; V604-F665 HydrophobicContact CG2-CZ 3.22Å
605	N	89.8	Confident	92.8	Very high	68 Å²	68	40.9 Å²	40.9	36%	0.364	21%	0.208	S	C	.	.	H	α-helix	trans	-83.6	-3.1	-178.5	-68	-41.8	0	0	0	114.3	N556 V601	N556-N605 HydrophobicContact CB-CB 4.12Å; V601-N605 WeakPolarHBondContact CG1-ND2 3.45Å; V601-N605 WeakPolarHBondContact O-CB 3.24Å; V601-N605 PolarHBondContact O-N 3.29Å; V601-N605 PolarHBondContact O-ND2 3.16Å
606	S	90.1	Very high	92.7	Very high	4 Å²	4	42 Å²	42	3%	0.028	21%	0.214	C	C	.	.	S	Bend	trans	-60.5	153	176.3	67.2	0	0	0	0	112.7	N560 I563 L602 I603 V604 Y608 K613	N560-S606 WeakPolarHBondContact OD1-CA 3.48Å; I563-S606 VanDerWaalsContact CD1-CB 3.42Å; L602-S606 WeakPolarHBondContact O-CB 3.35Å; L602-S606 PolarHBondContact O-N 3.47Å; L602-S606 VanDerWaalsContact O-N 3.08Å; I603-S606 PolarHBondContact O-N 3.47Å; I603-S606 PolarHBondContact O-OG 2.99Å; V604-S606 VanDerWaalsContact C-N 3.31Å; V604-S606 PolarHBondContact O-N 2.87Å; S606-Y608 PolarHBondContact O-N 2.96Å; S606-Y608 WeakPolarHBondContact OG-CD2 3.42Å; S606-K613 WeakPolarHBondContact O-CE 3.46Å; S606-K613 PolarHBondContact O-NZ 3.34Å; S606-K613 VanDerWaalsContact OG-CE 3.29Å; S606-K613 WeakPolarHBondContact OG-CE 3.38Å
607	E	89.6	Confident	92.7	Very high	162 Å²	162	41.7 Å²	41.7	76%	0.757	21%	0.213	S	C	*	.	S	Bend	trans	-79.9	8.6	171.2	-73.3	175.2	-172	0	0	113.4	N560	N560-E607 VanDerWaalsContact ND2-CD 3.32Å; N560-E607 WeakPolarHBondContact ND2-CG 3.5Å; N560-E607 PolarHBondContact ND2-OE1 3.35Å; N560-E607 PolarHBondContact OD1-N 3.42Å
608	Y	91.3	Very high	92.7	Very high	64 Å²	64	44.3 Å²	44.3	25%	0.251	22%	0.222	S	C	.	.	S	Bend	trans	-69.6	155	179.9	-61.4	-34.9	0	0	0	113.2	I563 S606 R612 K613 L616	I563-Y608 HydrophobicContact CB-CE2 4.45Å; I563-Y608 HydrophobicContact CG2-CE2 4.15Å; S606-Y608 PolarHBondContact O-N 2.96Å; S606-Y608 WeakPolarHBondContact OG-CD2 3.42Å; Y608-R612 HydrophobicContact CD2-CG 4.22Å; Y608-R612 HydrophobicContact CG-CG 4.12Å; Y608-K613 WeakPolarHBondContact O-CE 3.31Å; Y608-L616 HydrophobicContact CD2-CD1 3.92Å; Y608-L616 HydrophobicContact CE2-CD1 4.07Å
609	P	92.1	Very high	92.6	Very high	86 Å²	86	49.6 Å²	49.6	56%	0.558	25%	0.25	S	S	*	.			trans	-65.1	156.2	172.2	27.9	-34.9	0	0	0	111.5	E611 R612 K613	P609-E611 VanDerWaalsContact C-N 3.26Å; P609-E611 PolarHBondContact O-N 3.14Å; P609-R612 HydrophobicContact CG-CB 3.97Å; P609-R612 PolarHBondContact O-N 3.43Å; P609-K613 PolarHBondContact O-N 3.44Å
610	A	91.5	Very high	92.5	Very high	39 Å²	39	50.6 Å²	50.6	32%	0.322	26%	0.255	S	S	.	.	H	α-helix	trans	-52.9	-41.4	-177.5	0	0	0	0	0	112.9	R612 K613 Q614 Q673 C674	A610-R612 VanDerWaalsContact C-N 3.32Å; A610-R612 PolarHBondContact O-N 3.44Å; A610-K613 PolarHBondContact O-N 3.48Å; A610-Q614 WeakPolarHBondContact O-CB 3.33Å; A610-Q614 PolarHBondContact O-N 3.49Å; A610-Q673 WeakPolarHBondContact CB-O 3.16Å; A610-C674 VanDerWaalsContact O-O 3.11Å
611	E	92.6	Very high	92.5	Very high	159 Å²	159	50.6 Å²	50.6	74%	0.743	26%	0.255	S	S	*	.	H	α-helix	trans	-58.3	-42.1	177.3	-64.1	171.5	-172.4	0	0	112.4	P609 A615	P609-E611 VanDerWaalsContact C-N 3.26Å; P609-E611 PolarHBondContact O-N 3.14Å; E611-A615 WeakPolarHBondContact O-CB 3.26Å; E611-A615 PolarHBondContact O-N 3.38Å
612	R	92.9	Very high	92.5	Very high	108 Å²	108	51.8 Å²	51.8	41%	0.408	26%	0.263	S	S	.	.	H	α-helix	trans	-72	-39.5	178.6	-177.3	61	171.8	-178.3	-0.5	111.1	E564 Y608 P609 A610 A615 L616	E564-R612 IonicContact OE1-CZ 3.04Å; E564-R612 IonicContact OE1-NE 2.8Å; E564-R612 IonicContact OE1-NH2 3.09Å; E564-R612 PolarHBondContact OE1-NH2 3.12Å; Y608-R612 HydrophobicContact CD2-CG 4.22Å; Y608-R612 HydrophobicContact CG-CG 4.12Å; P609-R612 HydrophobicContact CG-CB 3.97Å; P609-R612 PolarHBondContact O-N 3.43Å; A610-R612 VanDerWaalsContact C-N 3.32Å; A610-R612 PolarHBondContact O-N 3.44Å; R612-A615 PolarHBondContact O-N 2.86Å; R612-L616 HydrophobicContact CG-CD1 4.33Å; R612-L616 WeakPolarHBondContact O-CG 3.39Å; R612-L616 PolarHBondContact O-N 3.12Å
613	K	93.1	Very high	92.4	Very high	27 Å²	27	54.7 Å²	54.7	12%	0.117	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-44.6	174.3	-64.9	-171	-175.2	-167.7	0	111.5	I603 V604 S606 Y608 P609 A610 L616 M617 C674	I603-K613 HydrophobicContact CG2-CB 4.17Å; I603-K613 WeakPolarHBondContact CG2-O 3.19Å; V604-K613 PolarHBondContact O-NZ 3.05Å; S606-K613 WeakPolarHBondContact O-CE 3.46Å; S606-K613 PolarHBondContact O-NZ 3.34Å; S606-K613 VanDerWaalsContact OG-CE 3.29Å; S606-K613 WeakPolarHBondContact OG-CE 3.38Å; Y608-K613 WeakPolarHBondContact O-CE 3.31Å; P609-K613 PolarHBondContact O-N 3.44Å; A610-K613 PolarHBondContact O-N 3.48Å; K613-L616 PolarHBondContact O-N 2.92Å; K613-M617 WeakPolarHBondContact O-CB 3.35Å; K613-M617 PolarHBondContact O-N 2.63Å; K613-C674 HydrophobicContact CB-CB 4.43Å; K613-C674 HydrophobicContact CD-CB 4.13Å
614	Q	93.9	Very high	92.4	Very high	46 Å²	46	54.7 Å²	54.7	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-60	-46.7	175.3	-175.7	-174.9	14.3	0	0	111.2	A610 L616 M617 R618 G675 E678 V679	A610-Q614 WeakPolarHBondContact O-CB 3.33Å; A610-Q614 PolarHBondContact O-N 3.49Å; Q614-L616 PolarHBondContact O-N 2.87Å; Q614-M617 PolarHBondContact O-N 2.99Å; Q614-R618 VanDerWaalsContact O-CB 3.28Å; Q614-R618 WeakPolarHBondContact O-CB 3.24Å; Q614-R618 PolarHBondContact O-N 3.46Å; Q614-G675 VanDerWaalsContact CG-O 3.22Å; Q614-G675 WeakPolarHBondContact CG-O 3.49Å; Q614-G675 PolarHBondContact NE2-O 3.2Å; Q614-E678 PolarHBondContact NE2-OE2 3.28Å; Q614-E678 VanDerWaalsContact NE2-OE2 3.1Å; Q614-V679 HydrophobicContact CG-CG2 4Å
615	A	93.8	Very high	92.4	Very high	37 Å²	37	54.7 Å²	54.7	31%	0.306	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-44.9	178.1	0	0	0	0	0	112.3	E611 R612 R618 N619	E611-A615 WeakPolarHBondContact O-CB 3.26Å; E611-A615 PolarHBondContact O-N 3.38Å; R612-A615 PolarHBondContact O-N 2.86Å; A615-R618 PolarHBondContact O-N 3.25Å; A615-N619 WeakPolarHBondContact O-CB 3.41Å; A615-N619 PolarHBondContact O-N 3.04Å; A615-N619 PolarHBondContact O-OD1 2.98Å
616	L	92.9	Very high	92.6	Very high	23 Å²	23	57.1 Å²	57.1	12%	0.12	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-43.3	177	-69.4	172.3	0	0	0	112	L567 I603 Y608 R612 K613 Q614 N619 L620	L567-L616 HydrophobicContact CD1-CD2 4.41Å; I603-L616 HydrophobicContact CD1-CB 4Å; I603-L616 HydrophobicContact CG1-CB 4Å; I603-L616 HydrophobicContact CG2-CB 4.09Å; Y608-L616 HydrophobicContact CD2-CD1 3.92Å; Y608-L616 HydrophobicContact CE2-CD1 4.07Å; R612-L616 HydrophobicContact CG-CD1 4.33Å; R612-L616 WeakPolarHBondContact O-CG 3.39Å; R612-L616 PolarHBondContact O-N 3.12Å; K613-L616 PolarHBondContact O-N 2.92Å; Q614-L616 PolarHBondContact O-N 2.87Å; L616-N619 PolarHBondContact O-N 3.18Å; L616-L620 PolarHBondContact O-N 3.49Å
617	M	94.4	Very high	92.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-39.6	177.2	-172.7	62.5	63.5	0	0	111.8	I603 V604 K613 Q614 L620 L621 F665 V679	I603-M617 HydrophobicContact CB-CE 4.22Å; I603-M617 HydrophobicContact CD1-CE 4.22Å; I603-M617 HydrophobicContact CG2-CB 4.44Å; I603-M617 HydrophobicContact CG2-CE 4.12Å; V604-M617 HydrophobicContact CG2-CE 4.34Å; K613-M617 WeakPolarHBondContact O-CB 3.35Å; K613-M617 PolarHBondContact O-N 2.63Å; Q614-M617 PolarHBondContact O-N 2.99Å; M617-L620 PolarHBondContact O-N 3.05Å; M617-L620 HydrophobicContact SD-CD2 4.38Å; M617-L621 HydrophobicContact CG-CD1 4.14Å; M617-L621 PolarHBondContact O-N 3.17Å; M617-L621 VanDerWaalsContact O-N 3.09Å; M617-L621 HydrophobicContact SD-CD1 3.98Å; M617-L621 HydrophobicContact SD-CG 4.32Å; M617-F665 HydrophobicContact CE-CE2 4.34Å; M617-F665 HydrophobicContact CE-CZ 4.31Å; M617-V679 HydrophobicContact CG-CG1 4.32Å
618	R	94.6	Very high	92.7	Very high	76 Å²	76	52.3 Å²	52.3	29%	0.287	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-45.9	175.2	-171.3	176.4	-77.4	-85.4	1.7	110.6	Q614 A615 L620 L621 T622 V679 D682	Q614-R618 VanDerWaalsContact O-CB 3.28Å; Q614-R618 WeakPolarHBondContact O-CB 3.24Å; Q614-R618 PolarHBondContact O-N 3.46Å; A615-R618 PolarHBondContact O-N 3.25Å; R618-L620 PolarHBondContact O-N 2.89Å; R618-L621 PolarHBondContact O-N 3.27Å; R618-T622 VanDerWaalsContact O-CB 3.27Å; R618-T622 WeakPolarHBondContact O-CB 3.16Å; R618-T622 PolarHBondContact O-N 3.01Å; R618-T622 PolarHBondContact O-OG1 3.49Å; R618-V679 HydrophobicContact CB-CG1 4.43Å; R618-V679 HydrophobicContact CB-CG2 4.12Å; R618-D682 IonicContact CZ-OD2 2.73Å; R618-D682 IonicContact NH1-OD2 2.79Å; R618-D682 PolarHBondContact NH1-OD2 3.15Å; R618-D682 IonicContact NH2-OD2 2.82Å; R618-D682 PolarHBondContact NH2-OD2 3.45Å
619	N	92.3	Very high	92.7	Very high	111 Å²	111	54.6 Å²	54.6	59%	0.594	28%	0.278	S	S	*	.	H	α-helix	trans	-60.4	-31.6	176	-70.9	-10.2	0	0	0	113.1	A615 L616 P623	A615-N619 WeakPolarHBondContact O-CB 3.41Å; A615-N619 PolarHBondContact O-N 3.04Å; A615-N619 PolarHBondContact O-OD1 2.98Å; L616-N619 PolarHBondContact O-N 3.18Å; N619-P623 WeakPolarHBondContact O-CD 3.43Å
620	L	92.7	Very high	92.7	Very high	21 Å²	21	55 Å²	55	11%	0.11	27%	0.274	C	S	.	.	H	α-helix	trans	-72.8	-40.4	176.2	-178.5	63.5	0	0	0	112.8	L574 Y596 A599 I603 L616 M617 R618 T661	L574-L620 HydrophobicContact CD1-CD1 3.6Å; Y596-L620 HydrophobicContact CD1-CD1 4.07Å; Y596-L620 HydrophobicContact CD1-CD2 4.5Å; Y596-L620 HydrophobicContact CD1-CG 4.31Å; Y596-L620 HydrophobicContact CE1-CD1 3.85Å; Y596-L620 HydrophobicContact CE1-CG 4.25Å; A599-L620 HydrophobicContact CB-CD1 4.27Å; A599-L620 HydrophobicContact CB-CD2 3.79Å; I603-L620 HydrophobicContact CD1-CD2 4.11Å; L616-L620 PolarHBondContact O-N 3.49Å; M617-L620 PolarHBondContact O-N 3.05Å; M617-L620 HydrophobicContact SD-CD2 4.38Å; R618-L620 PolarHBondContact O-N 2.89Å; L620-T661 HydrophobicContact CD2-CG2 3.66Å; L620-T661 HydrophobicContact CG-CG2 4.47Å
621	L	94	Very high	92.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-96.3	-25.9	-171.6	-64.1	-179.5	0	0	0	114.2	M617 R618 L624 M625 A658 T661 V679 Y680	M617-L621 HydrophobicContact CG-CD1 4.14Å; M617-L621 PolarHBondContact O-N 3.17Å; M617-L621 VanDerWaalsContact O-N 3.09Å; M617-L621 HydrophobicContact SD-CD1 3.98Å; M617-L621 HydrophobicContact SD-CG 4.32Å; R618-L621 PolarHBondContact O-N 3.27Å; L621-L624 HydrophobicContact CD2-CD1 4.18Å; L621-L624 WeakPolarHBondContact O-CB 3.35Å; L621-L624 PolarHBondContact O-N 3.06Å; L621-M625 WeakPolarHBondContact O-CG 3.46Å; L621-M625 PolarHBondContact O-N 3.2Å; L621-A658 HydrophobicContact CD2-CB 3.95Å; L621-T661 HydrophobicContact CD2-CG2 4.05Å; L621-V679 HydrophobicContact CB-CG1 4.35Å; L621-V679 HydrophobicContact CD1-CG1 3.91Å; L621-Y680 HydrophobicContact CD1-CE1 4.02Å
622	T	92.9	Very high	92.5	Very high	37 Å²	37	47 Å²	47	23%	0.227	23%	0.231	C	C	.	.	H	α-helix	trans	-58.1	-47.1	179.3	-70.1	0	0	0	0	113.2	R618 L624 M625 E626	R618-T622 VanDerWaalsContact O-CB 3.27Å; R618-T622 WeakPolarHBondContact O-CB 3.16Å; R618-T622 PolarHBondContact O-N 3.01Å; R618-T622 PolarHBondContact O-OG1 3.49Å; T622-L624 PolarHBondContact O-N 2.85Å; T622-M625 PolarHBondContact O-N 3.2Å; T622-M625 VanDerWaalsContact O-N 3.11Å; T622-E626 HydrophobicContact CG2-CG 4.27Å; T622-E626 WeakPolarHBondContact CG2-OE1 3.37Å; T622-E626 WeakPolarHBondContact O-CG 3.46Å; T622-E626 PolarHBondContact O-N 3.49Å
623	P	91.9	Very high	92.4	Very high	65 Å²	65	48.2 Å²	48.2	42%	0.422	24%	0.241	S	C	.	.	H	α-helix	trans	-60	-34.6	177.5	-24.3	34.9	0	0	0	113.1	N619 K627	N619-P623 WeakPolarHBondContact O-CD 3.43Å; P623-K627 WeakPolarHBondContact O-CB 3.35Å; P623-K627 WeakPolarHBondContact O-CG 3.46Å; P623-K627 PolarHBondContact O-N 2.88Å
624	L	91.9	Very high	92.2	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-66.7	-45.8	174.5	-75.4	176.9	0	0	0	111.6	L576 Y596 L621 T622 K627 F628 A654 F657	L576-L624 HydrophobicContact CB-CD2 4.14Å; L576-L624 HydrophobicContact CD2-CD2 4.46Å; Y596-L624 HydrophobicContact CD1-CD1 4.35Å; Y596-L624 HydrophobicContact CE1-CD1 3.5Å; Y596-L624 HydrophobicContact CE1-CG 4.3Å; Y596-L624 WeakPolarHBondContact OH-CD2 3.39Å; Y596-L624 WeakPolarHBondContact OH-CG 3.27Å; L621-L624 HydrophobicContact CD2-CD1 4.18Å; L621-L624 WeakPolarHBondContact O-CB 3.35Å; L621-L624 PolarHBondContact O-N 3.06Å; T622-L624 PolarHBondContact O-N 2.85Å; L624-K627 PolarHBondContact O-N 2.86Å; L624-F628 VanDerWaalsContact O-CB 3.24Å; L624-F628 WeakPolarHBondContact O-CB 3.46Å; L624-F628 PolarHBondContact O-N 3.26Å; L624-A654 HydrophobicContact CD2-CB 4.35Å; L624-F657 HydrophobicContact CD1-CB 3.79Å; L624-F657 HydrophobicContact CD2-CD2 4.09Å
625	M	92.7	Very high	91.9	Very high	13 Å²	13	48.5 Å²	48.5	6%	0.064	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-41.5	178.8	-71.4	-172.9	-71	0	0	112.2	L621 T622 F628 K629 D682 C683 T686 F687	L621-M625 WeakPolarHBondContact O-CG 3.46Å; L621-M625 PolarHBondContact O-N 3.2Å; T622-M625 PolarHBondContact O-N 3.2Å; T622-M625 VanDerWaalsContact O-N 3.11Å; M625-F628 PolarHBondContact O-N 3.43Å; M625-K629 WeakPolarHBondContact O-CG 3.39Å; M625-K629 PolarHBondContact O-N 3.41Å; M625-D682 HydrophobicContact CE-CB 4.49Å; M625-D682 HydrophobicContact SD-CB 4.18Å; M625-C683 HydrophobicContact SD-CB 4.31Å; M625-T686 HydrophobicContact CB-CG2 4.09Å; M625-T686 HydrophobicContact CG-CG2 4.32Å; M625-F687 HydrophobicContact CG-CE1 4.49Å; M625-F687 HydrophobicContact CG-CZ 4.39Å
626	E	92.5	Very high	91.6	Very high	118 Å²	118	50.9 Å²	50.9	55%	0.551	25%	0.248	S	C	*	.	H	α-helix	trans	-65.8	-48.4	177.6	-71.4	175.1	175.7	0	0	111.5	T622 F628 K629 I630	T622-E626 HydrophobicContact CG2-CG 4.27Å; T622-E626 WeakPolarHBondContact CG2-OE1 3.37Å; T622-E626 WeakPolarHBondContact O-CG 3.46Å; T622-E626 PolarHBondContact O-N 3.49Å; E626-F628 VanDerWaalsContact C-N 3.3Å; E626-F628 PolarHBondContact O-N 2.8Å; E626-K629 PolarHBondContact O-N 3.23Å; E626-I630 WeakPolarHBondContact O-CG1 3.39Å; E626-I630 PolarHBondContact O-N 3.18Å
627	K	89.8	Confident	91.3	Very high	63 Å²	63	56.6 Å²	56.6	27%	0.274	28%	0.278	S	S	.	.	H	α-helix	trans	-61	-39.3	174.9	-76.9	-173.7	172.1	-174.2	0	111.7	E575 L576 P623 L624 K629 I630 L631	E575-K627 VanDerWaalsContact CG-NZ 3.34Å; E575-K627 IonicContact OE1-NZ 2.72Å; E575-K627 PolarHBondContact OE1-NZ 3.39Å; L576-K627 HydrophobicContact CB-CD 4.09Å; L576-K627 HydrophobicContact CD2-CB 4.18Å; L576-K627 HydrophobicContact CD2-CD 4.49Å; L576-K627 PolarHBondContact O-NZ 3.33Å; P623-K627 WeakPolarHBondContact O-CB 3.35Å; P623-K627 WeakPolarHBondContact O-CG 3.46Å; P623-K627 PolarHBondContact O-N 2.88Å; L624-K627 PolarHBondContact O-N 2.86Å; K627-K629 PolarHBondContact O-N 3.44Å; K627-I630 PolarHBondContact O-N 3.1Å; K627-L631 WeakPolarHBondContact O-CB 3.41Å; K627-L631 VanDerWaalsContact O-CG 3.28Å; K627-L631 WeakPolarHBondContact O-CG 3.08Å; K627-L631 PolarHBondContact O-N 3.44Å
628	F	92.8	Very high	90.8	Very high	2 Å²	2	57 Å²	57	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-58.9	-46.2	178.2	-176	-87.2	0	0	0	112.3	L624 M625 E626 I630 L631 L632 L651 A654 V655 T686 F687 A690	L624-F628 VanDerWaalsContact O-CB 3.24Å; L624-F628 WeakPolarHBondContact O-CB 3.46Å; L624-F628 PolarHBondContact O-N 3.26Å; M625-F628 PolarHBondContact O-N 3.43Å; E626-F628 VanDerWaalsContact C-N 3.3Å; E626-F628 PolarHBondContact O-N 2.8Å; F628-I630 VanDerWaalsContact C-N 3.34Å; F628-I630 PolarHBondContact O-N 2.89Å; F628-L631 PolarHBondContact O-N 3.15Å; F628-L632 HydrophobicContact CE1-CD2 4.21Å; F628-L632 WeakPolarHBondContact O-CB 3.47Å; F628-L632 PolarHBondContact O-N 3.36Å; F628-L651 HydrophobicContact CB-CD2 4.45Å; F628-L651 HydrophobicContact CD1-CD2 4.28Å; F628-L651 HydrophobicContact CD2-CB 4.27Å; F628-L651 HydrophobicContact CD2-CD2 3.34Å; F628-L651 HydrophobicContact CD2-CG 4.43Å; F628-L651 HydrophobicContact CE1-CD2 4.39Å; F628-L651 HydrophobicContact CE2-CB 3.87Å; F628-L651 HydrophobicContact CE2-CD2 3.48Å; F628-L651 VanDerWaalsContact CE2-CD2 3.48Å; F628-L651 HydrophobicContact CE2-CG 4.28Å; F628-L651 HydrophobicContact CG-CD2 3.78Å; F628-L651 HydrophobicContact CZ-CD2 4.03Å; F628-L651 WeakPolarHBondContact O-CD2 3.45Å; F628-A654 HydrophobicContact CD2-CB 4.08Å; F628-V655 HydrophobicContact CD2-CG2 4.23Å; F628-V655 HydrophobicContact CE2-CG2 3.55Å; F628-V655 HydrophobicContact CZ-CG2 4.18Å; F628-T686 HydrophobicContact CD1-CG2 3.97Å; F628-T686 WeakPolarHBondContact CE1-O 3.33Å; F628-F687 HydrophobicContact CB-CE1 4.12Å; F628-F687 AromaticContact CD1-CD1 3.78Å; F628-F687 HydrophobicContact CD1-CD1 3.78Å; F628-F687 HydrophobicContact CD1-CE1 4.19Å; F628-F687 AromaticContact CD2-CD1 3.87Å; F628-F687 HydrophobicContact CD2-CD1 3.87Å; F628-F687 AromaticContact CD2-CE1 3.91Å; F628-F687 HydrophobicContact CD2-CE1 3.91Å; F628-F687 AromaticContact CE1-CD1 3.81Å; F628-F687 HydrophobicContact CE1-CD1 3.81Å; F628-F687 AromaticContact CE2-CD1 3.91Å; F628-F687 HydrophobicContact CE2-CD1 3.91Å; F628-F687 HydrophobicContact CE2-CE1 4.36Å; F628-F687 AromaticContact CG-CD1 3.81Å; F628-F687 HydrophobicContact CG-CD1 3.81Å; F628-F687 AromaticContact CG-CE1 3.81Å; F628-F687 HydrophobicContact CG-CE1 3.81Å; F628-F687 HydrophobicContact CZ-CB 4.47Å; F628-F687 AromaticContact CZ-CD1 3.86Å; F628-F687 HydrophobicContact CZ-CD1 3.86Å; F628-A690 HydrophobicContact CE1-CB 4.33Å; F628-A690 HydrophobicContact CZ-CB 3.78Å
629	K	92.1	Very high	90.2	Very high	113 Å²	113	62.6 Å²	62.6	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-59.3	-46	178	-69.8	174.7	-176.1	178.3	0	111.5	M625 E626 K627 L632 E633 T686	M625-K629 WeakPolarHBondContact O-CG 3.39Å; M625-K629 PolarHBondContact O-N 3.41Å; E626-K629 PolarHBondContact O-N 3.23Å; K627-K629 PolarHBondContact O-N 3.44Å; K629-L632 PolarHBondContact O-N 2.82Å; K629-E633 WeakPolarHBondContact O-CG 3.34Å; K629-E633 PolarHBondContact O-N 2.85Å; K629-E633 VanDerWaalsContact O-N 3.11Å; K629-T686 HydrophobicContact CD-CG2 4.33Å; K629-T686 HydrophobicContact CG-CG2 3.88Å
630	I	91.3	Very high	89.9	Confident	94 Å²	94	61.4 Å²	61.4	48%	0.482	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-44.1	178.5	-63	166.9	0	0	0	111.1	E626 K627 F628 E633 K634	E626-I630 WeakPolarHBondContact O-CG1 3.39Å; E626-I630 PolarHBondContact O-N 3.18Å; K627-I630 PolarHBondContact O-N 3.1Å; F628-I630 VanDerWaalsContact C-N 3.34Å; F628-I630 PolarHBondContact O-N 2.89Å; I630-E633 PolarHBondContact O-N 3.03Å; I630-K634 WeakPolarHBondContact O-CG 3.5Å; I630-K634 PolarHBondContact O-N 3.4Å
631	L	90.1	Very high	89.5	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-68.1	-35.8	-179.9	-71.3	172.7	0	0	0	112.3	L576 P578 K627 F628 K634 L635 L647 C650 L651	L576-L631 HydrophobicContact CD2-CD1 3.74Å; P578-L631 HydrophobicContact CB-CD2 4.2Å; P578-L631 HydrophobicContact CG-CD2 4.15Å; K627-L631 WeakPolarHBondContact O-CB 3.41Å; K627-L631 VanDerWaalsContact O-CG 3.28Å; K627-L631 WeakPolarHBondContact O-CG 3.08Å; K627-L631 PolarHBondContact O-N 3.44Å; F628-L631 PolarHBondContact O-N 3.15Å; L631-K634 HydrophobicContact CD2-CD 4.46Å; L631-K634 PolarHBondContact O-N 3.09Å; L631-L635 WeakPolarHBondContact O-CB 2.98Å; L631-L635 PolarHBondContact O-N 2.96Å; L631-L647 HydrophobicContact CD2-CD2 3.84Å; L631-C650 HydrophobicContact CD1-CB 4.43Å; L631-L651 HydrophobicContact CB-CD2 3.61Å; L631-L651 HydrophobicContact CB-CG 4.05Å
632	L	90.3	Very high	89	Confident	23 Å²	23	74.8 Å²	74.8	12%	0.12	37%	0.365	C	S	.	.	H	α-helix	trans	-66.5	-42	176.7	-175.4	63.5	0	0	0	111.1	F628 K629 L635 M636 L651 P689 A690	F628-L632 HydrophobicContact CE1-CD2 4.21Å; F628-L632 WeakPolarHBondContact O-CB 3.47Å; F628-L632 PolarHBondContact O-N 3.36Å; K629-L632 PolarHBondContact O-N 2.82Å; L632-L635 PolarHBondContact O-N 2.89Å; L632-M636 HydrophobicContact CD1-CE 4.02Å; L632-M636 HydrophobicContact CG-CE 4.45Å; L632-M636 WeakPolarHBondContact O-CG 3.26Å; L632-M636 PolarHBondContact O-N 3.26Å; L632-L651 HydrophobicContact CB-CD1 4.45Å; L632-L651 HydrophobicContact CB-CD2 4.21Å; L632-L651 HydrophobicContact CD1-CD1 4.15Å; L632-P689 HydrophobicContact CD2-CB 4.48Å; L632-A690 HydrophobicContact CD1-CB 4.27Å; L632-A690 HydrophobicContact CD2-CB 4.49Å
633	E	90.6	Very high	88.6	Confident	134 Å²	134	78.4 Å²	78.4	63%	0.626	38%	0.375	S	S	*	.	H	α-helix	trans	-61.5	-43.6	172.7	-71.9	175.6	-172.5	0	0	111.7	K629 I630 L635 M636 L637	K629-E633 WeakPolarHBondContact O-CG 3.34Å; K629-E633 PolarHBondContact O-N 2.85Å; K629-E633 VanDerWaalsContact O-N 3.11Å; I630-E633 PolarHBondContact O-N 3.03Å; E633-L635 PolarHBondContact O-N 2.64Å; E633-M636 PolarHBondContact O-N 3.23Å; E633-L637 WeakPolarHBondContact O-CG 3.48Å; E633-L637 PolarHBondContact O-N 3.39Å
634	K	88.5	Confident	88.4	Confident	79 Å²	79	76.5 Å²	76.5	34%	0.343	36%	0.36	S	S	.	.	H	α-helix	trans	-61.9	-40.6	175.9	-77.6	-178	168.6	-162.5	0	112.9	E580 I630 L631 M636 L637 A638 L647	E580-K634 IonicContact OE2-NZ 3.73Å; E580-K634 PolarHBondContact OE2-NZ 3.03Å; I630-K634 WeakPolarHBondContact O-CG 3.5Å; I630-K634 PolarHBondContact O-N 3.4Å; L631-K634 HydrophobicContact CD2-CD 4.46Å; L631-K634 PolarHBondContact O-N 3.09Å; K634-M636 VanDerWaalsContact C-N 3.27Å; K634-M636 PolarHBondContact O-N 3.43Å; K634-L637 PolarHBondContact O-N 3.49Å; K634-L637 VanDerWaalsContact O-N 3.1Å; K634-A638 PolarHBondContact O-N 3.49Å; K634-L647 HydrophobicContact CB-CD1 4.37Å
635	L	88.5	Confident	88.2	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-58.9	-41.3	177.9	177.3	65	0	0	0	111.1	L631 L632 E633 L637 A638 Q644 L647 L651 L695 L700	L631-L635 WeakPolarHBondContact O-CB 2.98Å; L631-L635 PolarHBondContact O-N 2.96Å; L632-L635 PolarHBondContact O-N 2.89Å; E633-L635 PolarHBondContact O-N 2.64Å; L635-L637 PolarHBondContact O-N 3.17Å; L635-A638 PolarHBondContact O-N 3.39Å; L635-Q644 HydrophobicContact CD1-CB 3.84Å; L635-Q644 HydrophobicContact CD1-CG 3.97Å; L635-Q644 VanDerWaalsContact CD1-O 3.3Å; L635-Q644 WeakPolarHBondContact CD1-O 3.5Å; L635-L647 HydrophobicContact CB-CB 4.45Å; L635-L647 HydrophobicContact CD1-CB 4.04Å; L635-L651 HydrophobicContact CB-CD1 4.36Å; L635-L651 HydrophobicContact CD2-CD1 3.83Å; L635-L695 WeakPolarHBondContact O-CD1 3.48Å; L635-L700 HydrophobicContact CD2-CD1 3.87Å
636	M	85.9	Confident	87.9	Confident	88 Å²	88	78.6 Å²	78.6	43%	0.433	38%	0.378	S	S	.	.	H	α-helix	trans	-66.9	-23.3	178.2	-60.7	-66.3	174.3	0	0	113.5	L632 E633 K634 C693	L632-M636 HydrophobicContact CD1-CE 4.02Å; L632-M636 HydrophobicContact CG-CE 4.45Å; L632-M636 WeakPolarHBondContact O-CG 3.26Å; L632-M636 PolarHBondContact O-N 3.26Å; E633-M636 PolarHBondContact O-N 3.23Å; K634-M636 VanDerWaalsContact C-N 3.27Å; K634-M636 PolarHBondContact O-N 3.43Å; M636-C693 HydrophobicContact CE-CB 3.49Å; M636-C693 VanDerWaalsContact CE-CB 3.49Å; M636-C693 WeakPolarHBondContact CE-SG 3.33Å
637	L	87.1	Confident	87.7	Confident	143 Å²	143	73 Å²	73	75%	0.749	35%	0.352	S	S	*	.	H	α-helix	trans	-93.5	-12.7	178.4	-63.4	172.9	0	0	0	112.6	E633 K634 L635	E633-L637 WeakPolarHBondContact O-CG 3.48Å; E633-L637 PolarHBondContact O-N 3.39Å; K634-L637 PolarHBondContact O-N 3.49Å; K634-L637 VanDerWaalsContact O-N 3.1Å; L635-L637 PolarHBondContact O-N 3.17Å
638	A	85.1	Confident	87.7	Confident	7 Å²	7	70 Å²	70	6%	0.058	34%	0.339	C	S	.	.			trans	-74.6	129.4	-178.4	0	0	0	0	0	110.6	K634 L635 R643 Q644 L647	K634-A638 PolarHBondContact O-N 3.49Å; L635-A638 PolarHBondContact O-N 3.39Å; A638-R643 HydrophobicContact CB-CG 4.43Å; A638-Q644 HydrophobicContact CB-CG 3.86Å; A638-Q644 PolarHBondContact O-NE2 2.68Å; A638-L647 HydrophobicContact CB-CD1 4.24Å
639	Q	81.3	Confident	87.5	Confident	194 Å²	194	73 Å²	73	91%	0.907	36%	0.355	S	S	*	.			trans	-99.1	-17.3	179.1	-65.2	-175.4	-12.9	0	0	113.3
640	D	85.6	Confident	87.4	Confident	86 Å²	86	67.9 Å²	67.9	46%	0.46	33%	0.334	S	S	.	.			trans	-95.7	134.3	-176.6	173.1	50.5	0	0	0	111.2	R643 Q644	D640-R643 HydrophobicContact CB-CB 3.96Å; D640-R643 PolarHBondContact O-N 3.31Å; D640-R643 WeakPolarHBondContact OD2-CB 3.34Å; D640-R643 PolarHBondContact OD2-N 3.17Å; D640-Q644 WeakPolarHBondContact O-CB 3.36Å; D640-Q644 VanDerWaalsContact O-CG 3.23Å; D640-Q644 WeakPolarHBondContact O-CG 3.08Å; D640-Q644 PolarHBondContact O-N 3.35Å
641	E	84.6	Confident	87.4	Confident	144 Å²	144	63.4 Å²	63.4	67%	0.673	31%	0.311	S	S	*	.	H	α-helix	trans	-71	-39.5	-172.4	-169.8	172.1	-168.7	0	0	112.2	Q644 A645	E641-Q644 WeakPolarHBondContact O-CB 3.09Å; E641-Q644 PolarHBondContact O-N 3.01Å; E641-A645 PolarHBondContact O-N 3Å
642	E	84.1	Confident	87.5	Confident	158 Å²	158	65 Å²	65	74%	0.738	32%	0.32	S	S	*	.	H	α-helix	trans	-64.5	-44.8	175.8	-172.7	179.3	177.1	0	0	110.5	Q644 A645 S646	E642-Q644 PolarHBondContact O-N 3.05Å; E642-A645 PolarHBondContact O-N 3.33Å; E642-S646 WeakPolarHBondContact O-CB 3.39Å; E642-S646 PolarHBondContact O-N 3.36Å
643	R	83.9	Confident	87.5	Confident	114 Å²	114	66.8 Å²	66.8	43%	0.43	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-43.2	172.9	-171	175.6	-177.5	-173.8	0	112.4	E580 A638 D640 S646 L647	E580-R643 IonicContact OE1-CZ 3.22Å; E580-R643 IonicContact OE1-NE 2.69Å; E580-R643 PolarHBondContact OE1-NE 3.11Å; E580-R643 IonicContact OE1-NH2 2.75Å; E580-R643 PolarHBondContact OE1-NH2 3.44Å; A638-R643 HydrophobicContact CB-CG 4.43Å; D640-R643 HydrophobicContact CB-CB 3.96Å; D640-R643 PolarHBondContact O-N 3.31Å; D640-R643 WeakPolarHBondContact OD2-CB 3.34Å; D640-R643 PolarHBondContact OD2-N 3.17Å; R643-S646 PolarHBondContact O-N 3.2Å; R643-S646 PolarHBondContact O-OG 3.22Å; R643-L647 HydrophobicContact CG-CD1 4.17Å; R643-L647 WeakPolarHBondContact O-CG 3.47Å; R643-L647 PolarHBondContact O-N 3.21Å
644	Q	87.6	Confident	87.6	Confident	24 Å²	24	60.4 Å²	60.4	11%	0.112	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-46.8	176.7	-76.7	172.9	8.3	0	0	111.6	L635 A638 D640 E641 E642 S646 L647 A648 L695 Q696	L635-Q644 HydrophobicContact CD1-CB 3.84Å; L635-Q644 HydrophobicContact CD1-CG 3.97Å; L635-Q644 VanDerWaalsContact CD1-O 3.3Å; L635-Q644 WeakPolarHBondContact CD1-O 3.5Å; A638-Q644 HydrophobicContact CB-CG 3.86Å; A638-Q644 PolarHBondContact O-NE2 2.68Å; D640-Q644 WeakPolarHBondContact O-CB 3.36Å; D640-Q644 VanDerWaalsContact O-CG 3.23Å; D640-Q644 WeakPolarHBondContact O-CG 3.08Å; D640-Q644 PolarHBondContact O-N 3.35Å; E641-Q644 WeakPolarHBondContact O-CB 3.09Å; E641-Q644 PolarHBondContact O-N 3.01Å; E642-Q644 PolarHBondContact O-N 3.05Å; Q644-S646 PolarHBondContact O-N 3.35Å; Q644-L647 PolarHBondContact O-N 2.75Å; Q644-A648 WeakPolarHBondContact O-CB 3.44Å; Q644-A648 PolarHBondContact O-N 3.24Å; Q644-L695 HydrophobicContact CG-CD1 4.41Å; Q644-Q696 HydrophobicContact CB-CG 3.96Å
645	A	87.4	Confident	87.9	Confident	27 Å²	27	56.7 Å²	56.7	22%	0.223	28%	0.281	C	S	.	.	H	α-helix	trans	-59.2	-48	177.6	0	0	0	0	0	111.4	E641 E642 L647 A648 D649	E641-A645 PolarHBondContact O-N 3Å; E642-A645 PolarHBondContact O-N 3.33Å; A645-L647 VanDerWaalsContact C-N 3.34Å; A645-L647 PolarHBondContact O-N 2.69Å; A645-A648 WeakPolarHBondContact O-CB 3.49Å; A645-A648 PolarHBondContact O-N 3.15Å; A645-A648 VanDerWaalsContact O-N 3.14Å; A645-D649 PolarHBondContact O-N 3.38Å
646	S	86.6	Confident	88.1	Confident	33 Å²	33	57.7 Å²	57.7	23%	0.231	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-36.5	-179.4	81.1	0	0	0	0	113.6	P579 E642 R643 Q644 C650	P579-S646 WeakPolarHBondContact CG-OG 3.21Å; E642-S646 WeakPolarHBondContact O-CB 3.39Å; E642-S646 PolarHBondContact O-N 3.36Å; R643-S646 PolarHBondContact O-N 3.2Å; R643-S646 PolarHBondContact O-OG 3.22Å; Q644-S646 PolarHBondContact O-N 3.35Å; S646-C650 PolarHBondContact O-N 3.11Å; S646-C650 VanDerWaalsContact O-N 3.16Å
647	L	88.4	Confident	88.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-72.5	-39.3	174.5	-72.9	172.8	0	0	0	111.4	L631 K634 L635 A638 R643 Q644 A645 C650 L651	L631-L647 HydrophobicContact CD2-CD2 3.84Å; K634-L647 HydrophobicContact CB-CD1 4.37Å; L635-L647 HydrophobicContact CB-CB 4.45Å; L635-L647 HydrophobicContact CD1-CB 4.04Å; A638-L647 HydrophobicContact CB-CD1 4.24Å; R643-L647 HydrophobicContact CG-CD1 4.17Å; R643-L647 WeakPolarHBondContact O-CG 3.47Å; R643-L647 PolarHBondContact O-N 3.21Å; Q644-L647 PolarHBondContact O-N 2.75Å; A645-L647 VanDerWaalsContact C-N 3.34Å; A645-L647 PolarHBondContact O-N 2.69Å; L647-C650 PolarHBondContact O-N 2.69Å; L647-L651 VanDerWaalsContact O-CG 3.31Å; L647-L651 WeakPolarHBondContact O-CG 3.45Å; L647-L651 PolarHBondContact O-N 2.9Å
648	A	89.6	Confident	88.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-40.8	175.6	0	0	0	0	0	111.9	Q644 A645 L651 N652 Q696 I699 L700	Q644-A648 WeakPolarHBondContact O-CB 3.44Å; Q644-A648 PolarHBondContact O-N 3.24Å; A645-A648 WeakPolarHBondContact O-CB 3.49Å; A645-A648 PolarHBondContact O-N 3.15Å; A645-A648 VanDerWaalsContact O-N 3.14Å; A648-L651 WeakPolarHBondContact O-CB 3.48Å; A648-L651 PolarHBondContact O-N 3.43Å; A648-N652 WeakPolarHBondContact O-CB 3.48Å; A648-N652 PolarHBondContact O-N 3.47Å; A648-Q696 HydrophobicContact CB-CB 3.51Å; A648-Q696 HydrophobicContact CB-CG 4Å; A648-I699 HydrophobicContact CB-CB 4.3Å; A648-I699 HydrophobicContact CB-CD1 4.33Å; A648-I699 HydrophobicContact CB-CG2 4.11Å; A648-L700 HydrophobicContact CB-CD2 4.31Å; A648-L700 HydrophobicContact CB-CG 4.39Å
649	D	88.9	Confident	89.2	Confident	66 Å²	66	46.9 Å²	46.9	35%	0.353	24%	0.236	S	C	.	.	H	α-helix	trans	-62.3	-44.4	173.3	-78.1	-26.9	0	0	0	111.6	A645 L651 N652 H653 I699	A645-D649 PolarHBondContact O-N 3.38Å; D649-L651 VanDerWaalsContact C-N 3.31Å; D649-L651 PolarHBondContact O-N 3.11Å; D649-N652 WeakPolarHBondContact O-CB 3.31Å; D649-N652 PolarHBondContact O-N 3.1Å; D649-H653 PolarHBondContact O-N 2.88Å; D649-H653 PolarHBondContact O-ND1 3.45Å; D649-I699 WeakPolarHBondContact OD1-CG2 3.29Å
650	C	89.2	Confident	89.8	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.041	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-38.4	176.6	-168.8	0	0	0	0	112.4	L631 S646 L647 A654	L631-C650 HydrophobicContact CD1-CB 4.43Å; S646-C650 PolarHBondContact O-N 3.11Å; S646-C650 VanDerWaalsContact O-N 3.16Å; L647-C650 PolarHBondContact O-N 2.69Å; C650-A654 PolarHBondContact O-N 3.18Å; C650-A654 VanDerWaalsContact O-N 3.12Å
651	L	91.9	Very high	90.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-43.5	173.3	-73.8	165.9	0	0	0	111.2	F628 L631 L632 L635 L647 A648 D649 A654 V655 L700	F628-L651 HydrophobicContact CB-CD2 4.45Å; F628-L651 HydrophobicContact CD1-CD2 4.28Å; F628-L651 HydrophobicContact CD2-CB 4.27Å; F628-L651 HydrophobicContact CD2-CD2 3.34Å; F628-L651 HydrophobicContact CD2-CG 4.43Å; F628-L651 HydrophobicContact CE1-CD2 4.39Å; F628-L651 HydrophobicContact CE2-CB 3.87Å; F628-L651 HydrophobicContact CE2-CD2 3.48Å; F628-L651 VanDerWaalsContact CE2-CD2 3.48Å; F628-L651 HydrophobicContact CE2-CG 4.28Å; F628-L651 HydrophobicContact CG-CD2 3.78Å; F628-L651 HydrophobicContact CZ-CD2 4.03Å; F628-L651 WeakPolarHBondContact O-CD2 3.45Å; L631-L651 HydrophobicContact CB-CD2 3.61Å; L631-L651 HydrophobicContact CB-CG 4.05Å; L632-L651 HydrophobicContact CB-CD1 4.45Å; L632-L651 HydrophobicContact CB-CD2 4.21Å; L632-L651 HydrophobicContact CD1-CD1 4.15Å; L635-L651 HydrophobicContact CB-CD1 4.36Å; L635-L651 HydrophobicContact CD2-CD1 3.83Å; L647-L651 VanDerWaalsContact O-CG 3.31Å; L647-L651 WeakPolarHBondContact O-CG 3.45Å; L647-L651 PolarHBondContact O-N 2.9Å; A648-L651 WeakPolarHBondContact O-CB 3.48Å; A648-L651 PolarHBondContact O-N 3.43Å; D649-L651 VanDerWaalsContact C-N 3.31Å; D649-L651 PolarHBondContact O-N 3.11Å; L651-A654 PolarHBondContact O-N 3.04Å; L651-V655 WeakPolarHBondContact O-CG2 3.26Å; L651-V655 PolarHBondContact O-N 3.41Å; L651-V655 VanDerWaalsContact O-N 3.15Å; L651-L700 HydrophobicContact CB-CD2 3.73Å; L651-L700 HydrophobicContact CD1-CD2 3.94Å; L651-L700 HydrophobicContact CG-CD2 4.49Å
652	N	91.8	Very high	90.5	Very high	40 Å²	40	30 Å²	30	21%	0.214	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-43.3	175.9	-176	26.2	0	0	0	111.6	A648 D649 A654 V655 G656 I699 G703	A648-N652 WeakPolarHBondContact O-CB 3.48Å; A648-N652 PolarHBondContact O-N 3.47Å; D649-N652 WeakPolarHBondContact O-CB 3.31Å; D649-N652 PolarHBondContact O-N 3.1Å; N652-A654 PolarHBondContact O-N 3.44Å; N652-V655 PolarHBondContact O-N 3.3Å; N652-G656 PolarHBondContact O-N 2.88Å; N652-I699 HydrophobicContact CB-CG2 3.76Å; N652-G703 WeakPolarHBondContact OD1-CA 3.32Å; N652-G703 PolarHBondContact OD1-N 2.69Å
653	H	90.9	Very high	90.7	Very high	59 Å²	59	26.9 Å²	26.9	27%	0.273	14%	0.135	S	C	.	.	H	α-helix	trans	-59	-44.3	174.1	-65.3	153.2	0	0	0	112.3	L576 S589 D649 V655 G656 F657	L576-H653 HydrophobicContact CD1-CB 4.38Å; S589-H653 VanDerWaalsContact CB-CE1 3.42Å; S589-H653 WeakPolarHBondContact CB-CE1 2.76Å; S589-H653 PolarHBondContact OG-CE1 3.02Å; S589-H653 VanDerWaalsContact OG-CE1 3.23Å; S589-H653 PolarHBondContact OG-ND1 3.19Å; S589-H653 VanDerWaalsContact OG-ND1 3.17Å; D649-H653 PolarHBondContact O-N 2.88Å; D649-H653 PolarHBondContact O-ND1 3.45Å; H653-V655 VanDerWaalsContact C-N 3.33Å; H653-V655 PolarHBondContact O-N 3.45Å; H653-G656 CarbonylContact O-C 3.54Å; H653-G656 WeakPolarHBondContact O-CA 3.42Å; H653-G656 PolarHBondContact O-N 3.23Å; H653-G656 VanDerWaalsContact O-N 3.1Å; H653-F657 HydrophobicContact CB-CE2 3.97Å; H653-F657 HydrophobicContact CB-CZ 4Å; H653-F657 WeakPolarHBondContact O-CD2 3.39Å; H653-F657 WeakPolarHBondContact O-CG 3.27Å; H653-F657 PolarHBondContact O-N 3.43Å
654	A	92.6	Very high	90.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.5	-42.7	177.3	0	0	0	0	0	112.4	L576 L624 F628 C650 L651 N652 F657 A658	L576-A654 HydrophobicContact CD1-CB 4.39Å; L576-A654 HydrophobicContact CD2-CB 3.95Å; L624-A654 HydrophobicContact CD2-CB 4.35Å; F628-A654 HydrophobicContact CD2-CB 4.08Å; C650-A654 PolarHBondContact O-N 3.18Å; C650-A654 VanDerWaalsContact O-N 3.12Å; L651-A654 PolarHBondContact O-N 3.04Å; N652-A654 PolarHBondContact O-N 3.44Å; A654-F657 PolarHBondContact O-N 3.31Å; A654-A658 PolarHBondContact O-N 2.86Å
655	V	94.1	Very high	91	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.012	12%	0.118	C	C	.	.	H	α-helix	trans	-65.2	-41.6	173.7	177.9	0	0	0	0	110.8	F628 L651 N652 H653 A658 S659 F687 G703 F707	F628-V655 HydrophobicContact CD2-CG2 4.23Å; F628-V655 HydrophobicContact CE2-CG2 3.55Å; F628-V655 HydrophobicContact CZ-CG2 4.18Å; L651-V655 WeakPolarHBondContact O-CG2 3.26Å; L651-V655 PolarHBondContact O-N 3.41Å; L651-V655 VanDerWaalsContact O-N 3.15Å; N652-V655 PolarHBondContact O-N 3.3Å; H653-V655 VanDerWaalsContact C-N 3.33Å; H653-V655 PolarHBondContact O-N 3.45Å; V655-A658 PolarHBondContact O-N 2.89Å; V655-S659 WeakPolarHBondContact O-CB 3.48Å; V655-S659 PolarHBondContact O-N 3.38Å; V655-F687 HydrophobicContact CG1-CD2 4.31Å; V655-F687 HydrophobicContact CG2-CB 4.19Å; V655-F687 HydrophobicContact CG2-CD1 3.93Å; V655-F687 HydrophobicContact CG2-CD2 4.09Å; V655-F687 HydrophobicContact CG2-CE1 4.32Å; V655-F687 HydrophobicContact CG2-CE2 4.46Å; V655-F687 HydrophobicContact CG2-CG 3.82Å; V655-G703 WeakPolarHBondContact CG1-O 3.4Å; V655-F707 HydrophobicContact CG1-CB 3.55Å; V655-F707 HydrophobicContact CG1-CG 4.09Å
656	G	93.3	Very high	90.8	Very high	20 Å²	20	24 Å²	24	21%	0.206	13%	0.134	C	C	.	.	H	α-helix	trans	-58.8	-45.4	175.6	0	0	0	0	0	113	N652 H653 S659 R660	N652-G656 PolarHBondContact O-N 2.88Å; H653-G656 CarbonylContact O-C 3.54Å; H653-G656 WeakPolarHBondContact O-CA 3.42Å; H653-G656 PolarHBondContact O-N 3.23Å; H653-G656 VanDerWaalsContact O-N 3.1Å; G656-S659 WeakPolarHBondContact O-CB 3.14Å; G656-S659 PolarHBondContact O-N 3.09Å; G656-R660 VanDerWaalsContact O-CG 3.31Å; G656-R660 WeakPolarHBondContact O-CG 3.26Å; G656-R660 PolarHBondContact O-N 2.92Å
657	F	93.9	Very high	90.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-48.5	177.1	-62.8	-32.1	0	0	0	112	L576 S589 Q592 L593 Y596 L624 H653 A654 S659 R660 T661	L576-F657 HydrophobicContact CD1-CD2 4.22Å; L576-F657 HydrophobicContact CD1-CE2 3.72Å; S589-F657 WeakPolarHBondContact O-CE1 3.38Å; Q592-F657 HydrophobicContact CB-CD1 4.39Å; Q592-F657 HydrophobicContact CB-CE1 3.53Å; Q592-F657 HydrophobicContact CB-CZ 3.65Å; Q592-F657 HydrophobicContact CG-CZ 4.49Å; Q592-F657 VanDerWaalsContact OE1-CZ 3.22Å; L593-F657 HydrophobicContact CD2-CD1 3.58Å; L593-F657 HydrophobicContact CD2-CE1 3.82Å; L593-F657 HydrophobicContact CG-CD1 4.23Å; L593-F657 HydrophobicContact CG-CE1 4.05Å; Y596-F657 HydrophobicContact CD1-CB 4.04Å; Y596-F657 HydrophobicContact CD2-CB 3.56Å; Y596-F657 AromaticContact CD2-CD1 3.47Å; Y596-F657 HydrophobicContact CD2-CD1 3.47Å; Y596-F657 VanDerWaalsContact CD2-CD1 3.47Å; Y596-F657 HydrophobicContact CD2-CD2 4.04Å; Y596-F657 HydrophobicContact CD2-CE1 4.21Å; Y596-F657 AromaticContact CD2-CG 3.41Å; Y596-F657 HydrophobicContact CD2-CG 3.41Å; Y596-F657 VanDerWaalsContact CD2-CG 3.41Å; Y596-F657 HydrophobicContact CE1-CB 4.15Å; Y596-F657 HydrophobicContact CE2-CB 3.67Å; Y596-F657 AromaticContact CE2-CD1 3.85Å; Y596-F657 HydrophobicContact CE2-CD1 3.85Å; Y596-F657 AromaticContact CE2-CD2 3.53Å; Y596-F657 HydrophobicContact CE2-CD2 3.53Å; Y596-F657 HydrophobicContact CE2-CE1 4.43Å; Y596-F657 HydrophobicContact CE2-CE2 4.12Å; Y596-F657 AromaticContact CE2-CG 3.4Å; Y596-F657 HydrophobicContact CE2-CG 3.4Å; Y596-F657 HydrophobicContact CG-CB 3.74Å; Y596-F657 HydrophobicContact CG-CD1 4.27Å; Y596-F657 HydrophobicContact CG-CG 4.13Å; L624-F657 HydrophobicContact CD1-CB 3.79Å; L624-F657 HydrophobicContact CD2-CD2 4.09Å; H653-F657 HydrophobicContact CB-CE2 3.97Å; H653-F657 HydrophobicContact CB-CZ 4Å; H653-F657 WeakPolarHBondContact O-CD2 3.39Å; H653-F657 WeakPolarHBondContact O-CG 3.27Å; H653-F657 PolarHBondContact O-N 3.43Å; A654-F657 PolarHBondContact O-N 3.31Å; F657-S659 VanDerWaalsContact C-N 3.29Å; F657-S659 PolarHBondContact O-N 2.62Å; F657-R660 WeakPolarHBondContact O-CB 3.12Å; F657-R660 PolarHBondContact O-N 3.45Å; F657-R660 VanDerWaalsContact O-N 3.12Å; F657-T661 PolarHBondContact O-N 3.36Å; F657-T661 VanDerWaalsContact O-N 3.13Å
658	A	94.1	Very high	90.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-34.5	174.9	0	0	0	0	0	112.5	L621 A654 V655 T661 F687 F707	L621-A658 HydrophobicContact CD2-CB 3.95Å; A654-A658 PolarHBondContact O-N 2.86Å; V655-A658 PolarHBondContact O-N 2.89Å; A658-T661 PolarHBondContact O-OG1 2.81Å; A658-F687 HydrophobicContact CB-CE2 3.65Å; A658-F687 HydrophobicContact CB-CZ 3.93Å; A658-F707 HydrophobicContact CB-CE2 4.33Å
659	S	93.7	Very high	90.1	Very high	11 Å²	11	32.1 Å²	32.1	8%	0.077	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-41.4	172.5	-167.4	0	0	0	0	111.4	V655 G656 F657 S662	V655-S659 WeakPolarHBondContact O-CB 3.48Å; V655-S659 PolarHBondContact O-N 3.38Å; G656-S659 WeakPolarHBondContact O-CB 3.14Å; G656-S659 PolarHBondContact O-N 3.09Å; F657-S659 VanDerWaalsContact C-N 3.29Å; F657-S659 PolarHBondContact O-N 2.62Å; S659-S662 WeakPolarHBondContact O-CB 3.46Å; S659-S662 PolarHBondContact O-N 3.17Å; S659-S662 PolarHBondContact O-OG 3.21Å
660	R	92.9	Very high	89.9	Confident	69 Å²	69	30.4 Å²	30.4	26%	0.26	16%	0.162	S	C	.	.	H	α-helix	trans	-66.8	-38.9	-178.9	-76.3	-71.8	177.7	160.4	4.5	113.7	L593 E597 G656 F657 S662 K663	L593-R660 HydrophobicContact CB-CG 3.96Å; L593-R660 HydrophobicContact CD2-CG 3.53Å; L593-R660 HydrophobicContact CG-CG 4.29Å; E597-R660 HydrophobicContact CB-CB 4.36Å; E597-R660 IonicContact OE2-CZ 3.38Å; E597-R660 IonicContact OE2-NH1 3.06Å; E597-R660 PolarHBondContact OE2-NH1 3.31Å; G656-R660 VanDerWaalsContact O-CG 3.31Å; G656-R660 WeakPolarHBondContact O-CG 3.26Å; G656-R660 PolarHBondContact O-N 2.92Å; F657-R660 WeakPolarHBondContact O-CB 3.12Å; F657-R660 PolarHBondContact O-N 3.45Å; F657-R660 VanDerWaalsContact O-N 3.12Å; R660-S662 PolarHBondContact O-N 3.44Å; R660-K663 VanDerWaalsContact CZ-NZ 3.31Å; R660-K663 VanDerWaalsContact O-CB 3.3Å; R660-K663 WeakPolarHBondContact O-CB 3.38Å; R660-K663 PolarHBondContact O-N 2.96Å
661	T	93.8	Very high	89.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.1	-31.7	175.5	58.8	0	0	0	0	111.6	Y596 L620 L621 F657 A658 K663 A664 Y680	Y596-T661 HydrophobicContact CD1-CG2 3.89Å; L620-T661 HydrophobicContact CD2-CG2 3.66Å; L620-T661 HydrophobicContact CG-CG2 4.47Å; L621-T661 HydrophobicContact CD2-CG2 4.05Å; F657-T661 PolarHBondContact O-N 3.36Å; F657-T661 VanDerWaalsContact O-N 3.13Å; A658-T661 PolarHBondContact O-OG1 2.81Å; T661-K663 PolarHBondContact O-N 2.88Å; T661-A664 PolarHBondContact O-N 3.5Å; T661-Y680 PolarHBondContact OG1-OH 2.9Å
662	S	91.4	Very high	89.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-73.1	-13.2	179.2	82.1	0	0	0	0	113.8	S659 R660 A664 F665 Y680 R710	S659-S662 WeakPolarHBondContact O-CB 3.46Å; S659-S662 PolarHBondContact O-N 3.17Å; S659-S662 PolarHBondContact O-OG 3.21Å; R660-S662 PolarHBondContact O-N 3.44Å; S662-A664 PolarHBondContact O-N 3.26Å; S662-F665 PolarHBondContact O-N 3.04Å; S662-F665 VanDerWaalsContact O-N 3.14Å; S662-Y680 WeakPolarHBondContact CA-OH 3.49Å; S662-Y680 PolarHBondContact N-OH 2.96Å; S662-R710 PolarHBondContact O-NE 3.47Å; S662-R710 PolarHBondContact O-NH2 3.27Å; S662-R710 WeakPolarHBondContact OG-CG 3.5Å; S662-R710 PolarHBondContact OG-NE 3.37Å
663	K	90.1	Very high	89.3	Confident	93 Å²	93	40.1 Å²	40.1	40%	0.404	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-63	-22.2	175.1	-72.6	-165.6	175.2	-171.8	0	113.3	E597 R660 T661 F665 R710	E597-K663 HydrophobicContact CG-CB 4.36Å; R660-K663 VanDerWaalsContact CZ-NZ 3.31Å; R660-K663 VanDerWaalsContact O-CB 3.3Å; R660-K663 WeakPolarHBondContact O-CB 3.38Å; R660-K663 PolarHBondContact O-N 2.96Å; T661-K663 PolarHBondContact O-N 2.88Å; K663-F665 PolarHBondContact O-N 3.32Å; K663-R710 VanDerWaalsContact CA-NH2 3.31Å
664	A	87.1	Confident	89.1	Confident	20 Å²	20	37.7 Å²	37.7	17%	0.165	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-64.6	-22.5	174.6	0	0	0	0	0	113.6	V601 V604 T661 S662	V601-A664 HydrophobicContact CB-CB 4.47Å; V601-A664 HydrophobicContact CG2-CB 3.91Å; V604-A664 HydrophobicContact CB-CB 3.98Å; V604-A664 HydrophobicContact CG1-CB 4.46Å; V604-A664 HydrophobicContact CG2-CB 3.73Å; T661-A664 PolarHBondContact O-N 3.5Å; S662-A664 PolarHBondContact O-N 3.26Å
665	F	89.1	Confident	88.9	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	20%	0.204	C	C	.	.			trans	-90.9	137.1	178.5	-58.7	-75.8	0	0	0	111.3	V604 M617 S662 K663 T670 V671 C674 C676 Y680 R710	V604-F665 HydrophobicContact CB-CE1 4.28Å; V604-F665 HydrophobicContact CG1-CD1 3.99Å; V604-F665 HydrophobicContact CG1-CE1 3.94Å; V604-F665 HydrophobicContact CG2-CD1 3.92Å; V604-F665 HydrophobicContact CG2-CD2 4.38Å; V604-F665 HydrophobicContact CG2-CE1 3.3Å; V604-F665 HydrophobicContact CG2-CE2 3.79Å; V604-F665 HydrophobicContact CG2-CG 4.44Å; V604-F665 HydrophobicContact CG2-CZ 3.22Å; M617-F665 HydrophobicContact CE-CE2 4.34Å; M617-F665 HydrophobicContact CE-CZ 4.31Å; S662-F665 PolarHBondContact O-N 3.04Å; S662-F665 VanDerWaalsContact O-N 3.14Å; K663-F665 PolarHBondContact O-N 3.32Å; F665-T670 WeakPolarHBondContact CB-OG1 3.15Å; F665-V671 HydrophobicContact CB-CG2 3.7Å; F665-V671 HydrophobicContact CD1-CB 4.29Å; F665-V671 HydrophobicContact CD1-CG2 3.68Å; F665-V671 HydrophobicContact CD2-CG2 4Å; F665-V671 HydrophobicContact CE1-CG2 4.27Å; F665-V671 HydrophobicContact CG-CG2 3.51Å; F665-C674 HydrophobicContact CE1-CB 3.9Å; F665-C676 HydrophobicContact CZ-CB 3.91Å; F665-Y680 HydrophobicContact CD2-CE2 4.29Å; F665-Y680 AromaticContact CE2-CE2 3.6Å; F665-Y680 HydrophobicContact CE2-CE2 3.6Å; F665-Y680 AromaticContact CE2-CZ 4Å; F665-Y680 HydrophobicContact CZ-CE2 4.29Å; F665-R710 PolarHBondContact O-NH2 3.42Å
666	S	82.8	Confident	88.8	Confident	82 Å²	82	38.6 Å²	38.6	57%	0.573	20%	0.203	S	C	*	.	S	Bend	trans	-83.7	-36	174.9	58.7	0	0	0	0	112.1	T670	S666-T670 PolarHBondContact N-OG1 2.72Å; S666-T670 VanDerWaalsContact OG-CG2 3.26Å; S666-T670 WeakPolarHBondContact OG-CG2 3.43Å
667	N	82.4	Confident	88.6	Confident	52 Å²	52	38.3 Å²	38.3	28%	0.278	20%	0.198	S	C	.	.	S	Bend	trans	-160.6	-179.3	-176.1	63.6	30.2	0	0	0	111.7	Q669 T670 V671	N667-Q669 VanDerWaalsContact C-N 3.29Å; N667-Q669 PolarHBondContact O-N 2.88Å; N667-Q669 WeakPolarHBondContact OD1-CA 3.35Å; N667-Q669 WeakPolarHBondContact OD1-CB 3.44Å; N667-Q669 PolarHBondContact OD1-N 3.46Å; N667-T670 PolarHBondContact N-OG1 2.73Å; N667-T670 PolarHBondContact O-N 2.89Å; N667-T670 PolarHBondContact O-OG1 3.46Å; N667-T670 PolarHBondContact OD1-N 3.48Å; N667-T670 VanDerWaalsContact OD1-N 3.1Å; N667-V671 PolarHBondContact O-N 3.33Å
668	K	84.3	Confident	88.5	Confident	17 Å²	17	43.7 Å²	43.7	7%	0.074	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-34.2	177	178.4	174.2	-173	161.7	0	115.6	T670 V671 K672 C714 L715 E716 E718	K668-T670 VanDerWaalsContact C-N 3.31Å; K668-T670 PolarHBondContact O-N 2.78Å; K668-V671 PolarHBondContact O-N 3.42Å; K668-K672 VanDerWaalsContact CE-NZ 3.34Å; K668-K672 HydrophobicContact CG-CD 4.29Å; K668-K672 HydrophobicContact CG-CG 4.35Å; K668-K672 WeakPolarHBondContact O-CG 3.4Å; K668-K672 PolarHBondContact O-N 2.74Å; K668-C714 WeakPolarHBondContact CA-O 3.49Å; K668-C714 WeakPolarHBondContact CB-O 3.4Å; K668-L715 VanDerWaalsContact CD-O 3.28Å; K668-L715 WeakPolarHBondContact CD-O 3.38Å; K668-L715 VanDerWaalsContact CE-O 3.27Å; K668-L715 WeakPolarHBondContact CE-O 3.35Å; K668-L715 PolarHBondContact NZ-O 3.34Å; K668-E716 HydrophobicContact CB-CG 3.76Å; K668-E716 HydrophobicContact CD-CB 3.73Å; K668-E716 HydrophobicContact CD-CG 3.82Å; K668-E716 WeakPolarHBondContact CD-OE2 3.38Å; K668-E716 HydrophobicContact CG-CG 4.44Å; K668-E718 WeakPolarHBondContact CE-OE1 3.49Å; K668-E718 IonicContact NZ-OE1 3.79Å; K668-E718 PolarHBondContact NZ-OE1 3.25Å; K668-E718 VanDerWaalsContact NZ-OE1 3.09Å
669	Q	84.3	Confident	88.4	Confident	135 Å²	135	43.7 Å²	43.7	63%	0.631	22%	0.223	S	C	*	.	H	α-helix	trans	-62.7	-43.1	178.7	-62.8	179.5	-18.4	0	0	110.6	N667 V671 K672 Q673	N667-Q669 VanDerWaalsContact C-N 3.29Å; N667-Q669 PolarHBondContact O-N 2.88Å; N667-Q669 WeakPolarHBondContact OD1-CA 3.35Å; N667-Q669 WeakPolarHBondContact OD1-CB 3.44Å; N667-Q669 PolarHBondContact OD1-N 3.46Å; Q669-V671 VanDerWaalsContact C-N 3.32Å; Q669-V671 PolarHBondContact O-N 3.33Å; Q669-K672 PolarHBondContact O-N 3.21Å; Q669-Q673 WeakPolarHBondContact O-CB 3.24Å; Q669-Q673 WeakPolarHBondContact O-CG 3.27Å; Q669-Q673 PolarHBondContact O-N 3.1Å
670	T	85.2	Confident	88.4	Confident	30 Å²	30	43.2 Å²	43.2	18%	0.184	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-35.8	177.3	60.4	0	0	0	0	112.9	F665 S666 N667 K668 C674	F665-T670 WeakPolarHBondContact CB-OG1 3.15Å; S666-T670 PolarHBondContact N-OG1 2.72Å; S666-T670 VanDerWaalsContact OG-CG2 3.26Å; S666-T670 WeakPolarHBondContact OG-CG2 3.43Å; N667-T670 PolarHBondContact N-OG1 2.73Å; N667-T670 PolarHBondContact O-N 2.89Å; N667-T670 PolarHBondContact O-OG1 3.46Å; N667-T670 PolarHBondContact OD1-N 3.48Å; N667-T670 VanDerWaalsContact OD1-N 3.1Å; K668-T670 VanDerWaalsContact C-N 3.31Å; K668-T670 PolarHBondContact O-N 2.78Å; T670-C674 PolarHBondContact O-N 3.26Å; T670-C674 PolarHBondContact O-SG 3.21Å
671	V	86.6	Confident	88.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-46.1	176	-178.8	0	0	0	0	110.9	F665 N667 K668 Q669 C674 G675 C676 C714 L715	F665-V671 HydrophobicContact CB-CG2 3.7Å; F665-V671 HydrophobicContact CD1-CB 4.29Å; F665-V671 HydrophobicContact CD1-CG2 3.68Å; F665-V671 HydrophobicContact CD2-CG2 4Å; F665-V671 HydrophobicContact CE1-CG2 4.27Å; F665-V671 HydrophobicContact CG-CG2 3.51Å; N667-V671 PolarHBondContact O-N 3.33Å; K668-V671 PolarHBondContact O-N 3.42Å; Q669-V671 VanDerWaalsContact C-N 3.32Å; Q669-V671 PolarHBondContact O-N 3.33Å; V671-C674 PolarHBondContact O-N 3.12Å; V671-G675 PolarHBondContact O-N 3.33Å; V671-C676 HydrophobicContact CG1-CB 4.2Å; V671-C676 PolarHBondContact O-N 2.94Å; V671-C676 VanDerWaalsContact O-N 3.1Å; V671-C714 HydrophobicContact CG2-CB 4.02Å; V671-L715 HydrophobicContact CG1-CD2 4.33Å
672	K	86.4	Confident	88.4	Confident	111 Å²	111	44 Å²	44	48%	0.483	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-43.6	177.5	-75.3	-168.8	172.6	-169	0	112.5	K668 Q669 C674 G675 E718	K668-K672 VanDerWaalsContact CE-NZ 3.34Å; K668-K672 HydrophobicContact CG-CD 4.29Å; K668-K672 HydrophobicContact CG-CG 4.35Å; K668-K672 WeakPolarHBondContact O-CG 3.4Å; K668-K672 PolarHBondContact O-N 2.74Å; Q669-K672 PolarHBondContact O-N 3.21Å; K672-C674 PolarHBondContact O-N 2.86Å; K672-G675 PolarHBondContact O-N 3.43Å; K672-E718 WeakPolarHBondContact CE-OE1 3.2Å; K672-E718 IonicContact NZ-OE1 2.67Å; K672-E718 PolarHBondContact NZ-OE1 3.36Å
673	Q	86.4	Confident	88.6	Confident	140 Å²	140	44 Å²	44	65%	0.654	23%	0.229	S	C	*	.	H	α-helix	trans	-60.7	-29.7	176.6	-75	169.7	-3.8	0	0	112.6	A610 Q669	A610-Q673 WeakPolarHBondContact CB-O 3.16Å; Q669-Q673 WeakPolarHBondContact O-CB 3.24Å; Q669-Q673 WeakPolarHBondContact O-CG 3.27Å; Q669-Q673 PolarHBondContact O-N 3.1Å
674	C	86.8	Confident	88.7	Confident	7 Å²	7	39.7 Å²	39.7	5%	0.047	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.1	176.1	-61.9	0	0	0	0	113.8	A610 K613 F665 T670 V671 K672 C676	A610-C674 VanDerWaalsContact O-O 3.11Å; K613-C674 HydrophobicContact CB-CB 4.43Å; K613-C674 HydrophobicContact CD-CB 4.13Å; F665-C674 HydrophobicContact CE1-CB 3.9Å; T670-C674 PolarHBondContact O-N 3.26Å; T670-C674 PolarHBondContact O-SG 3.21Å; V671-C674 PolarHBondContact O-N 3.12Å; K672-C674 PolarHBondContact O-N 2.86Å; C674-C676 PolarHBondContact O-N 3.01Å; C674-C676 PolarHBondContact O-SG 3.32Å
675	G	88.1	Confident	89	Confident	22 Å²	22	44.2 Å²	44.2	23%	0.227	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	13.8	-176.2	0	0	0	0	0	114.6	Q614 V671 K672	Q614-G675 VanDerWaalsContact CG-O 3.22Å; Q614-G675 WeakPolarHBondContact CG-O 3.49Å; Q614-G675 PolarHBondContact NE2-O 3.2Å; V671-G675 PolarHBondContact O-N 3.33Å; K672-G675 PolarHBondContact O-N 3.43Å
676	C	91.4	Very high	89.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.			trans	-89.6	-1.9	-170	-65.7	0	0	0	0	114.5	F665 V671 C674 E678 V679 Y680	F665-C676 HydrophobicContact CZ-CB 3.91Å; V671-C676 HydrophobicContact CG1-CB 4.2Å; V671-C676 PolarHBondContact O-N 2.94Å; V671-C676 VanDerWaalsContact O-N 3.1Å; C674-C676 PolarHBondContact O-N 3.01Å; C674-C676 PolarHBondContact O-SG 3.32Å; C676-E678 VanDerWaalsContact C-N 3.34Å; C676-E678 PolarHBondContact O-N 3.39Å; C676-V679 PolarHBondContact O-N 3.08Å; C676-Y680 HydrophobicContact CB-CD2 4.34Å; C676-Y680 HydrophobicContact CB-CE2 4.2Å; C676-Y680 WeakPolarHBondContact O-CD2 3.21Å; C676-Y680 PolarHBondContact O-N 2.9Å
677	S	90.5	Very high	89.7	Confident	14 Å²	14	41 Å²	41	10%	0.098	21%	0.205	C	C	.	.	H	α-helix	trans	-54.9	-47.8	-177.5	-73.8	0	0	0	0	112.3	V679 Y680 L681	S677-V679 VanDerWaalsContact C-N 3.31Å; S677-V679 PolarHBondContact O-N 3.12Å; S677-Y680 PolarHBondContact O-N 3.27Å; S677-L681 WeakPolarHBondContact O-CG 3.44Å; S677-L681 PolarHBondContact O-N 3.22Å
678	E	90.4	Very high	90.1	Very high	113 Å²	113	39.7 Å²	39.7	53%	0.528	20%	0.198	S	C	.	.	H	α-helix	trans	-61	-39.3	-179.3	-65.8	179.7	167.5	0	0	112.4	Q614 C676 Y680 L681 D682	Q614-E678 PolarHBondContact NE2-OE2 3.28Å; Q614-E678 VanDerWaalsContact NE2-OE2 3.1Å; C676-E678 VanDerWaalsContact C-N 3.34Å; C676-E678 PolarHBondContact O-N 3.39Å; E678-Y680 VanDerWaalsContact C-N 3.29Å; E678-Y680 PolarHBondContact O-N 3.41Å; E678-L681 PolarHBondContact O-N 3.06Å; E678-D682 VanDerWaalsContact O-CG 3.27Å; E678-D682 PolarHBondContact O-N 3.15Å
679	V	93.3	Very high	90.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-39.2	-179.2	-172.8	0	0	0	0	110.9	Q614 M617 R618 L621 C676 S677 C683	Q614-V679 HydrophobicContact CG-CG2 4Å; M617-V679 HydrophobicContact CG-CG1 4.32Å; R618-V679 HydrophobicContact CB-CG1 4.43Å; R618-V679 HydrophobicContact CB-CG2 4.12Å; L621-V679 HydrophobicContact CB-CG1 4.35Å; L621-V679 HydrophobicContact CD1-CG1 3.91Å; C676-V679 PolarHBondContact O-N 3.08Å; S677-V679 VanDerWaalsContact C-N 3.31Å; S677-V679 PolarHBondContact O-N 3.12Å; V679-C683 PolarHBondContact O-N 3.37Å; V679-C683 VanDerWaalsContact O-N 3.11Å; V679-C683 PolarHBondContact O-SG 2.94Å
680	Y	94.1	Very high	90.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-78.1	-27.1	177.5	-74.2	-72.9	0	0	0	113.2	L621 T661 S662 F665 C676 S677 E678 C683 L684 F707 M711	L621-Y680 HydrophobicContact CD1-CE1 4.02Å; T661-Y680 PolarHBondContact OG1-OH 2.9Å; S662-Y680 WeakPolarHBondContact CA-OH 3.49Å; S662-Y680 PolarHBondContact N-OH 2.96Å; F665-Y680 HydrophobicContact CD2-CE2 4.29Å; F665-Y680 AromaticContact CE2-CE2 3.6Å; F665-Y680 HydrophobicContact CE2-CE2 3.6Å; F665-Y680 AromaticContact CE2-CZ 4Å; F665-Y680 HydrophobicContact CZ-CE2 4.29Å; C676-Y680 HydrophobicContact CB-CD2 4.34Å; C676-Y680 HydrophobicContact CB-CE2 4.2Å; C676-Y680 WeakPolarHBondContact O-CD2 3.21Å; C676-Y680 PolarHBondContact O-N 2.9Å; S677-Y680 PolarHBondContact O-N 3.27Å; E678-Y680 VanDerWaalsContact C-N 3.29Å; E678-Y680 PolarHBondContact O-N 3.41Å; Y680-C683 WeakPolarHBondContact O-CB 3.03Å; Y680-C683 PolarHBondContact O-N 3.45Å; Y680-L684 PolarHBondContact O-N 3.44Å; Y680-F707 HydrophobicContact CD1-CE2 4.39Å; Y680-F707 HydrophobicContact CD1-CZ 4.37Å; Y680-M711 HydrophobicContact CD1-CE 3.75Å; Y680-M711 HydrophobicContact CD1-SD 3.77Å; Y680-M711 HydrophobicContact CE1-CE 4.17Å; Y680-M711 HydrophobicContact CG-CE 4.37Å; Y680-M711 HydrophobicContact CG-SD 4.02Å
681	L	92.9	Very high	90.8	Very high	40 Å²	40	34.5 Å²	34.5	21%	0.209	18%	0.178	C	C	.	.	H	α-helix	trans	-66.4	-41.6	168.8	-68.6	171.3	0	0	0	111.2	S677 E678 C683 L684 Q685 L715 E718 F722	S677-L681 WeakPolarHBondContact O-CG 3.44Å; S677-L681 PolarHBondContact O-N 3.22Å; E678-L681 PolarHBondContact O-N 3.06Å; L681-C683 VanDerWaalsContact C-N 3.28Å; L681-C683 PolarHBondContact O-N 2.99Å; L681-L684 HydrophobicContact CD2-CD1 4.34Å; L681-L684 WeakPolarHBondContact O-CB 3.29Å; L681-L684 PolarHBondContact O-N 3.23Å; L681-Q685 WeakPolarHBondContact O-CG 3.26Å; L681-Q685 PolarHBondContact O-N 3.35Å; L681-L715 HydrophobicContact CD2-CD1 3.93Å; L681-L715 HydrophobicContact CG-CD1 4.33Å; L681-E718 HydrophobicContact CD2-CB 4.46Å; L681-F722 HydrophobicContact CD2-CE2 3.92Å
682	D	93.4	Very high	90.8	Very high	47 Å²	47	37.7 Å²	37.7	25%	0.251	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-39.5	173.3	-66.4	-16.8	0	0	0	111.1	R618 M625 E678 Q685 T686	R618-D682 IonicContact CZ-OD2 2.73Å; R618-D682 IonicContact NH1-OD2 2.79Å; R618-D682 PolarHBondContact NH1-OD2 3.15Å; R618-D682 IonicContact NH2-OD2 2.82Å; R618-D682 PolarHBondContact NH2-OD2 3.45Å; M625-D682 HydrophobicContact CE-CB 4.49Å; M625-D682 HydrophobicContact SD-CB 4.18Å; E678-D682 VanDerWaalsContact O-CG 3.27Å; E678-D682 PolarHBondContact O-N 3.15Å; D682-Q685 PolarHBondContact O-N 2.9Å; D682-T686 WeakPolarHBondContact O-CB 3.34Å; D682-T686 PolarHBondContact O-N 3.36Å; D682-T686 PolarHBondContact O-OG1 3.08Å
683	C	94.5	Very high	90.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.6	-45.9	174.2	-67.2	0	0	0	0	111.9	M625 V679 Y680 L681 Q685 T686 F687 F707	M625-C683 HydrophobicContact SD-CB 4.31Å; V679-C683 PolarHBondContact O-N 3.37Å; V679-C683 VanDerWaalsContact O-N 3.11Å; V679-C683 PolarHBondContact O-SG 2.94Å; Y680-C683 WeakPolarHBondContact O-CB 3.03Å; Y680-C683 PolarHBondContact O-N 3.45Å; L681-C683 VanDerWaalsContact C-N 3.28Å; L681-C683 PolarHBondContact O-N 2.99Å; C683-Q685 VanDerWaalsContact C-N 3.35Å; C683-Q685 PolarHBondContact O-N 3.4Å; C683-T686 PolarHBondContact O-N 3.21Å; C683-T686 VanDerWaalsContact O-N 3.13Å; C683-F687 HydrophobicContact CB-CD2 4.19Å; C683-F687 HydrophobicContact CB-CE2 3.83Å; C683-F687 HydrophobicContact CB-CZ 4.47Å; C683-F687 VanDerWaalsContact O-CD2 3.29Å; C683-F687 WeakPolarHBondContact O-CD2 3.27Å; C683-F687 VanDerWaalsContact O-CG 3.27Å; C683-F687 WeakPolarHBondContact O-CG 3.48Å; C683-F687 PolarHBondContact O-N 2.59Å; C683-F707 HydrophobicContact CB-CE1 4.25Å; C683-F707 HydrophobicContact CB-CZ 3.72Å
684	L	92.9	Very high	90.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-58.2	-46.4	176.3	-81.2	167.5	0	0	0	111.7	Y680 L681 T686 F687 L688 F707 L708 M711 L715 V719 F722	Y680-L684 PolarHBondContact O-N 3.44Å; L681-L684 HydrophobicContact CD2-CD1 4.34Å; L681-L684 WeakPolarHBondContact O-CB 3.29Å; L681-L684 PolarHBondContact O-N 3.23Å; L684-T686 PolarHBondContact O-N 3.45Å; L684-F687 PolarHBondContact O-N 3.29Å; L684-L688 HydrophobicContact CB-CD1 4.44Å; L684-L688 WeakPolarHBondContact O-CB 3.25Å; L684-L688 WeakPolarHBondContact O-CD1 3.41Å; L684-L688 WeakPolarHBondContact O-CG 3.44Å; L684-L688 PolarHBondContact O-N 3.41Å; L684-F707 HydrophobicContact CD2-CD1 4.01Å; L684-F707 HydrophobicContact CD2-CE1 3.67Å; L684-F707 HydrophobicContact CG-CE1 3.84Å; L684-L708 HydrophobicContact CD2-CD2 3.74Å; L684-M711 HydrophobicContact CD1-CB 4.25Å; L684-M711 HydrophobicContact CD1-CG 4.2Å; L684-M711 HydrophobicContact CD2-CB 4.26Å; L684-M711 HydrophobicContact CD2-CG 3.96Å; L684-M711 HydrophobicContact CG-CG 4.08Å; L684-L715 HydrophobicContact CD1-CD1 3.59Å; L684-V719 HydrophobicContact CD1-CG2 3.91Å; L684-F722 HydrophobicContact CD1-CD2 4.43Å
685	Q	92.4	Very high	90.5	Very high	116 Å²	116	32 Å²	32	54%	0.542	18%	0.184	S	C	.	.	H	α-helix	trans	-61.8	-32.4	177.1	-70.9	178.8	1.7	0	0	112.6	L681 D682 C683 P689 F722	L681-Q685 WeakPolarHBondContact O-CG 3.26Å; L681-Q685 PolarHBondContact O-N 3.35Å; D682-Q685 PolarHBondContact O-N 2.9Å; C683-Q685 VanDerWaalsContact C-N 3.35Å; C683-Q685 PolarHBondContact O-N 3.4Å; Q685-P689 VanDerWaalsContact O-CD 3.3Å; Q685-P689 WeakPolarHBondContact O-CD 3.15Å; Q685-F722 HydrophobicContact CG-CE1 3.89Å; Q685-F722 HydrophobicContact CG-CZ 4.16Å
686	T	93.8	Very high	90.5	Very high	14 Å²	14	33.3 Å²	33.3	9%	0.086	18%	0.184	C	C	.	.	H	α-helix	trans	-79.6	-37.3	179.9	-60.1	0	0	0	0	112.9	M625 F628 K629 D682 C683 L684 P689	M625-T686 HydrophobicContact CB-CG2 4.09Å; M625-T686 HydrophobicContact CG-CG2 4.32Å; F628-T686 HydrophobicContact CD1-CG2 3.97Å; F628-T686 WeakPolarHBondContact CE1-O 3.33Å; K629-T686 HydrophobicContact CD-CG2 4.33Å; K629-T686 HydrophobicContact CG-CG2 3.88Å; D682-T686 WeakPolarHBondContact O-CB 3.34Å; D682-T686 PolarHBondContact O-N 3.36Å; D682-T686 PolarHBondContact O-OG1 3.08Å; C683-T686 PolarHBondContact O-N 3.21Å; C683-T686 VanDerWaalsContact O-N 3.13Å; L684-T686 PolarHBondContact O-N 3.45Å; T686-P689 WeakPolarHBondContact O-CD 3.43Å
687	F	94.3	Very high	90.2	Very high	1 Å²	1	36 Å²	36	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-90.4	-30.6	-173.2	-58.2	-30.4	0	0	0	114.3	M625 F628 V655 A658 C683 L684 P689 A690 F707	M625-F687 HydrophobicContact CG-CE1 4.49Å; M625-F687 HydrophobicContact CG-CZ 4.39Å; F628-F687 HydrophobicContact CB-CE1 4.12Å; F628-F687 AromaticContact CD1-CD1 3.78Å; F628-F687 HydrophobicContact CD1-CD1 3.78Å; F628-F687 HydrophobicContact CD1-CE1 4.19Å; F628-F687 AromaticContact CD2-CD1 3.87Å; F628-F687 HydrophobicContact CD2-CD1 3.87Å; F628-F687 AromaticContact CD2-CE1 3.91Å; F628-F687 HydrophobicContact CD2-CE1 3.91Å; F628-F687 AromaticContact CE1-CD1 3.81Å; F628-F687 HydrophobicContact CE1-CD1 3.81Å; F628-F687 AromaticContact CE2-CD1 3.91Å; F628-F687 HydrophobicContact CE2-CD1 3.91Å; F628-F687 HydrophobicContact CE2-CE1 4.36Å; F628-F687 AromaticContact CG-CD1 3.81Å; F628-F687 HydrophobicContact CG-CD1 3.81Å; F628-F687 AromaticContact CG-CE1 3.81Å; F628-F687 HydrophobicContact CG-CE1 3.81Å; F628-F687 HydrophobicContact CZ-CB 4.47Å; F628-F687 AromaticContact CZ-CD1 3.86Å; F628-F687 HydrophobicContact CZ-CD1 3.86Å; V655-F687 HydrophobicContact CG1-CD2 4.31Å; V655-F687 HydrophobicContact CG2-CB 4.19Å; V655-F687 HydrophobicContact CG2-CD1 3.93Å; V655-F687 HydrophobicContact CG2-CD2 4.09Å; V655-F687 HydrophobicContact CG2-CE1 4.32Å; V655-F687 HydrophobicContact CG2-CE2 4.46Å; V655-F687 HydrophobicContact CG2-CG 3.82Å; A658-F687 HydrophobicContact CB-CE2 3.65Å; A658-F687 HydrophobicContact CB-CZ 3.93Å; C683-F687 HydrophobicContact CB-CD2 4.19Å; C683-F687 HydrophobicContact CB-CE2 3.83Å; C683-F687 HydrophobicContact CB-CZ 4.47Å; C683-F687 VanDerWaalsContact O-CD2 3.29Å; C683-F687 WeakPolarHBondContact O-CD2 3.27Å; C683-F687 VanDerWaalsContact O-CG 3.27Å; C683-F687 WeakPolarHBondContact O-CG 3.48Å; C683-F687 PolarHBondContact O-N 2.59Å; L684-F687 PolarHBondContact O-N 3.29Å; F687-P689 VanDerWaalsContact C-CD 3.42Å; F687-A690 WeakPolarHBondContact O-CB 3.27Å; F687-A690 PolarHBondContact O-N 2.95Å; F687-A690 VanDerWaalsContact O-N 3.11Å; F687-F707 AromaticContact CD2-CD1 3.97Å; F687-F707 HydrophobicContact CD2-CD1 3.97Å; F687-F707 AromaticContact CD2-CE1 3.77Å; F687-F707 HydrophobicContact CD2-CE1 3.77Å; F687-F707 HydrophobicContact CD2-CG 4.47Å; F687-F707 HydrophobicContact CD2-CZ 4.11Å; F687-F707 HydrophobicContact CE2-CE1 4.34Å; F687-F707 HydrophobicContact CE2-CE2 4.46Å; F687-F707 HydrophobicContact CE2-CZ 4.21Å
688	L	90.8	Very high	89.9	Confident	25 Å²	25	38.8 Å²	38.8	13%	0.131	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-56.8	-37.7	-179.8	-76.6	169.5	0	0	0	115.1	L684 A690 L691 V704 L708 F722 A726	L684-L688 HydrophobicContact CB-CD1 4.44Å; L684-L688 WeakPolarHBondContact O-CB 3.25Å; L684-L688 WeakPolarHBondContact O-CD1 3.41Å; L684-L688 WeakPolarHBondContact O-CG 3.44Å; L684-L688 PolarHBondContact O-N 3.41Å; L688-A690 PolarHBondContact O-N 3.38Å; L688-L691 HydrophobicContact CD2-CD1 3.87Å; L688-L691 WeakPolarHBondContact O-CB 3.5Å; L688-L691 PolarHBondContact O-N 3.41Å; L688-V704 HydrophobicContact CD2-CG1 4.22Å; L688-L708 HydrophobicContact CD2-CD1 4.38Å; L688-L708 HydrophobicContact CD2-CD2 4.3Å; L688-F722 HydrophobicContact CD1-CB 3.72Å; L688-F722 HydrophobicContact CD1-CD1 3.45Å; L688-F722 VanDerWaalsContact CD1-CD1 3.45Å; L688-F722 HydrophobicContact CD1-CE1 4.39Å; L688-F722 HydrophobicContact CD1-CG 3.89Å; L688-A726 HydrophobicContact CD2-CB 3.85Å
689	P	90.6	Very high	89.8	Confident	66 Å²	66	35.1 Å²	35.1	43%	0.429	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-56.2	-22.1	176	-27.9	36.5	0	0	0	114.7	L632 Q685 T686 F687 L691 S692	L632-P689 HydrophobicContact CD2-CB 4.48Å; Q685-P689 VanDerWaalsContact O-CD 3.3Å; Q685-P689 WeakPolarHBondContact O-CD 3.15Å; T686-P689 WeakPolarHBondContact O-CD 3.43Å; F687-P689 VanDerWaalsContact C-CD 3.42Å; P689-L691 PolarHBondContact O-N 2.94Å; P689-S692 PolarHBondContact O-N 2.64Å
690	A	90.3	Very high	89.6	Confident	2 Å²	2	35.4 Å²	35.4	2%	0.017	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-67.4	-23	176.6	0	0	0	0	0	113.3	F628 L632 F687 L688 S692 C693 V704	F628-A690 HydrophobicContact CE1-CB 4.33Å; F628-A690 HydrophobicContact CZ-CB 3.78Å; L632-A690 HydrophobicContact CD1-CB 4.27Å; L632-A690 HydrophobicContact CD2-CB 4.49Å; F687-A690 WeakPolarHBondContact O-CB 3.27Å; F687-A690 PolarHBondContact O-N 2.95Å; F687-A690 VanDerWaalsContact O-N 3.11Å; L688-A690 PolarHBondContact O-N 3.38Å; A690-S692 PolarHBondContact O-N 2.83Å; A690-C693 VanDerWaalsContact O-CB 3.26Å; A690-C693 WeakPolarHBondContact O-CB 3.3Å; A690-C693 PolarHBondContact O-N 3.25Å; A690-C693 VanDerWaalsContact O-N 3.17Å; A690-V704 HydrophobicContact CB-CG2 4.35Å
691	L	87.8	Confident	89.3	Confident	6 Å²	6	35.9 Å²	35.9	3%	0.031	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-65.9	-23.7	174.5	-66.2	175.1	0	0	0	112.8	L688 P689 C693 R701 V704 A726 H729 M730	L688-L691 HydrophobicContact CD2-CD1 3.87Å; L688-L691 WeakPolarHBondContact O-CB 3.5Å; L688-L691 PolarHBondContact O-N 3.41Å; P689-L691 PolarHBondContact O-N 2.94Å; L691-C693 VanDerWaalsContact C-N 3.31Å; L691-R701 HydrophobicContact CD2-CB 4.43Å; L691-R701 HydrophobicContact CD2-CG 4.02Å; L691-V704 HydrophobicContact CD1-CG1 3.86Å; L691-V704 HydrophobicContact CD2-CB 3.86Å; L691-V704 HydrophobicContact CD2-CG1 3.93Å; L691-V704 HydrophobicContact CD2-CG2 4.42Å; L691-V704 HydrophobicContact CG-CB 4.2Å; L691-V704 HydrophobicContact CG-CG1 3.81Å; L691-A726 HydrophobicContact CD1-CB 3.92Å; L691-H729 HydrophobicContact CB-CB 3.8Å; L691-M730 HydrophobicContact CD1-CG 4.29Å; L691-M730 HydrophobicContact CD2-CG 4.04Å
692	S	86.2	Confident	89.1	Confident	66 Å²	66	35.7 Å²	35.7	46%	0.462	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-85.4	-3.9	178	-45.1	0	0	0	0	112.8	P689 A690 H729	P689-S692 PolarHBondContact O-N 2.64Å; A690-S692 PolarHBondContact O-N 2.83Å; S692-H729 PolarHBondContact OG-CD2 3.11Å; S692-H729 PolarHBondContact OG-NE2 2.97Å
693	C	85.6	Confident	88.9	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.034	19%	0.189	C	C	.	.			trans	-70.7	129.5	179.9	-177.4	0	0	0	0	111	M636 A690 L691 L695 L700	M636-C693 HydrophobicContact CE-CB 3.49Å; M636-C693 VanDerWaalsContact CE-CB 3.49Å; M636-C693 WeakPolarHBondContact CE-SG 3.33Å; A690-C693 VanDerWaalsContact O-CB 3.26Å; A690-C693 WeakPolarHBondContact O-CB 3.3Å; A690-C693 PolarHBondContact O-N 3.25Å; A690-C693 VanDerWaalsContact O-N 3.17Å; L691-C693 VanDerWaalsContact C-N 3.31Å; C693-L695 VanDerWaalsContact C-N 3.35Å; C693-L695 PolarHBondContact SG-N 3.3Å; C693-L695 VanDerWaalsContact SG-N 3.44Å; C693-L695 PolarHBondContact SG-O 3.09Å; C693-L695 VanDerWaalsContact SG-O 3.42Å; C693-L700 HydrophobicContact CB-CD1 3.78Å
694	P	82.7	Confident	88.8	Confident	87 Å²	87	33.8 Å²	33.8	57%	0.565	19%	0.189	S	C	*	.	S	Bend	trans	-80.2	-13.9	177.7	31.4	-34.1	0	0	0	114	K697	P694-K697 VanDerWaalsContact O-CE 3.27Å; P694-K697 WeakPolarHBondContact O-CE 3.46Å
695	L	85.6	Confident	88.7	Confident	46 Å²	46	34.4 Å²	34.4	24%	0.241	19%	0.192	C	C	.	.	S	Bend	trans	-97.1	142.4	-176.6	-57	172.4	0	0	0	110.4	L635 Q644 C693 K697	L635-L695 WeakPolarHBondContact O-CD1 3.48Å; Q644-L695 HydrophobicContact CG-CD1 4.41Å; C693-L695 VanDerWaalsContact C-N 3.35Å; C693-L695 PolarHBondContact SG-N 3.3Å; C693-L695 VanDerWaalsContact SG-N 3.44Å; C693-L695 PolarHBondContact SG-O 3.09Å; C693-L695 VanDerWaalsContact SG-O 3.42Å; L695-K697 PolarHBondContact O-N 3.19Å; L695-K697 VanDerWaalsContact O-N 3.11Å
696	Q	86.6	Confident	88.7	Confident	50 Å²	50	32.4 Å²	32.4	23%	0.234	19%	0.188	C	C	.	.	S	Bend	trans	46.2	44.9	175	-62	-64.7	-19.2	0	0	113.2	Q644 A648 D698 I699 L700	Q644-Q696 HydrophobicContact CB-CG 3.96Å; A648-Q696 HydrophobicContact CB-CB 3.51Å; A648-Q696 HydrophobicContact CB-CG 4Å; Q696-D698 VanDerWaalsContact C-N 3.32Å; Q696-D698 PolarHBondContact O-N 3.13Å; Q696-I699 PolarHBondContact O-N 3.41Å; Q696-L700 PolarHBondContact O-N 2.94Å
697	K	84.9	Confident	88.7	Confident	56 Å²	56	31.8 Å²	31.8	24%	0.243	18%	0.184	C	C	.	.	H	α-helix	trans	-55.6	-44.1	-169.6	-66.5	179.5	179.7	177.8	0	112.3	P694 L695 I699 L700 R701 D733	P694-K697 VanDerWaalsContact O-CE 3.27Å; P694-K697 WeakPolarHBondContact O-CE 3.46Å; L695-K697 PolarHBondContact O-N 3.19Å; L695-K697 VanDerWaalsContact O-N 3.11Å; K697-I699 PolarHBondContact O-N 3.12Å; K697-L700 PolarHBondContact O-N 3.11Å; K697-R701 WeakPolarHBondContact O-CB 3.47Å; K697-R701 WeakPolarHBondContact O-CG 3.46Å; K697-R701 PolarHBondContact O-N 2.92Å; K697-D733 IonicContact NZ-OD2 3.14Å; K697-D733 PolarHBondContact NZ-OD2 2.87Å
698	D	83.9	Confident	88.6	Confident	73 Å²	73	31.8 Å²	31.8	39%	0.39	18%	0.184	S	C	.	.	H	α-helix	trans	-60.5	-47	-173.8	-60.7	0.9	0	0	0	112.3	Q696 S702	Q696-D698 VanDerWaalsContact C-N 3.32Å; Q696-D698 PolarHBondContact O-N 3.13Å; D698-S702 WeakPolarHBondContact O-CB 3.27Å; D698-S702 PolarHBondContact O-N 3.36Å
699	I	88.4	Confident	88.7	Confident	37 Å²	37	32.8 Å²	32.8	19%	0.19	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-48.4	-178.4	-63	170.2	0	0	0	109.9	A648 D649 N652 Q696 K697 S702 G703	A648-I699 HydrophobicContact CB-CB 4.3Å; A648-I699 HydrophobicContact CB-CD1 4.33Å; A648-I699 HydrophobicContact CB-CG2 4.11Å; D649-I699 WeakPolarHBondContact OD1-CG2 3.29Å; N652-I699 HydrophobicContact CB-CG2 3.76Å; Q696-I699 PolarHBondContact O-N 3.41Å; K697-I699 PolarHBondContact O-N 3.12Å; I699-S702 PolarHBondContact O-N 3Å; I699-G703 PolarHBondContact O-N 3.19Å
700	L	89.5	Confident	88.7	Confident	5 Å²	5	31.9 Å²	31.9	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-67.8	-43.8	-178.6	-64.8	178.6	0	0	0	112.2	L635 A648 L651 C693 Q696 K697 S702 G703 V704	L635-L700 HydrophobicContact CD2-CD1 3.87Å; A648-L700 HydrophobicContact CB-CD2 4.31Å; A648-L700 HydrophobicContact CB-CG 4.39Å; L651-L700 HydrophobicContact CB-CD2 3.73Å; L651-L700 HydrophobicContact CD1-CD2 3.94Å; L651-L700 HydrophobicContact CG-CD2 4.49Å; C693-L700 HydrophobicContact CB-CD1 3.78Å; Q696-L700 PolarHBondContact O-N 2.94Å; K697-L700 PolarHBondContact O-N 3.11Å; L700-S702 VanDerWaalsContact C-N 3.34Å; L700-S702 PolarHBondContact O-N 3Å; L700-G703 PolarHBondContact O-N 2.61Å; L700-V704 WeakPolarHBondContact O-CG2 3.5Å; L700-V704 PolarHBondContact O-N 3.14Å; L700-V704 VanDerWaalsContact O-N 3.09Å
701	R	88.6	Confident	88.9	Confident	10 Å²	10	31.8 Å²	31.8	4%	0.038	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-43.6	176.8	-75.9	173.2	173.4	179.9	-4.8	111.1	L691 K697 G703 R705 H729 K732 D733 D738	L691-R701 HydrophobicContact CD2-CB 4.43Å; L691-R701 HydrophobicContact CD2-CG 4.02Å; K697-R701 WeakPolarHBondContact O-CB 3.47Å; K697-R701 WeakPolarHBondContact O-CG 3.46Å; K697-R701 PolarHBondContact O-N 2.92Å; R701-G703 PolarHBondContact O-N 3.04Å; R701-R705 WeakPolarHBondContact O-CB 3.29Å; R701-R705 PolarHBondContact O-N 2.91Å; R701-H729 PolarHBondContact NH2-O 2.9Å; R701-H729 VanDerWaalsContact NH2-O 3.1Å; R701-K732 PolarHBondContact NH2-O 3.13Å; R701-D733 PolarHBondContact NH1-O 3.45Å; R701-D738 IonicContact NH1-OD2 3.86Å; R701-D738 PolarHBondContact NH1-OD2 3.34Å
702	S	88.6	Confident	89	Confident	36 Å²	36	31.5 Å²	31.5	25%	0.252	17%	0.174	S	C	.	.	H	α-helix	trans	-60.6	-45.7	179.6	-175.9	0	0	0	0	112.5	D698 I699 L700 R705 T706	D698-S702 WeakPolarHBondContact O-CB 3.27Å; D698-S702 PolarHBondContact O-N 3.36Å; I699-S702 PolarHBondContact O-N 3Å; L700-S702 VanDerWaalsContact C-N 3.34Å; L700-S702 PolarHBondContact O-N 3Å; S702-R705 PolarHBondContact OG-NH2 3.49Å; S702-T706 WeakPolarHBondContact O-CB 3.39Å; S702-T706 PolarHBondContact O-N 3.26Å; S702-T706 PolarHBondContact O-OG1 2.95Å
703	G	89.3	Confident	89.2	Confident	4 Å²	4	30.9 Å²	30.9	4%	0.041	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-55	176.4	0	0	0	0	0	113.4	N652 V655 I699 L700 R701 R705 T706 F707	N652-G703 WeakPolarHBondContact OD1-CA 3.32Å; N652-G703 PolarHBondContact OD1-N 2.69Å; V655-G703 WeakPolarHBondContact CG1-O 3.4Å; I699-G703 PolarHBondContact O-N 3.19Å; L700-G703 PolarHBondContact O-N 2.61Å; R701-G703 PolarHBondContact O-N 3.04Å; G703-R705 VanDerWaalsContact C-N 3.32Å; G703-R705 PolarHBondContact O-N 3.11Å; G703-T706 PolarHBondContact O-N 3.4Å; G703-F707 PolarHBondContact O-N 2.85Å
704	V	92.6	Very high	89.3	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.018	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-38.7	-178.3	177.6	0	0	0	0	111.3	L688 A690 L691 L700 F707 L708	L688-V704 HydrophobicContact CD2-CG1 4.22Å; A690-V704 HydrophobicContact CB-CG2 4.35Å; L691-V704 HydrophobicContact CD1-CG1 3.86Å; L691-V704 HydrophobicContact CD2-CB 3.86Å; L691-V704 HydrophobicContact CD2-CG1 3.93Å; L691-V704 HydrophobicContact CD2-CG2 4.42Å; L691-V704 HydrophobicContact CG-CB 4.2Å; L691-V704 HydrophobicContact CG-CG1 3.81Å; L700-V704 WeakPolarHBondContact O-CG2 3.5Å; L700-V704 PolarHBondContact O-N 3.14Å; L700-V704 VanDerWaalsContact O-N 3.09Å; V704-F707 WeakPolarHBondContact O-CB 3.24Å; V704-F707 PolarHBondContact O-N 3.26Å; V704-L708 HydrophobicContact CG1-CD1 4.21Å; V704-L708 HydrophobicContact CG1-CG 4.4Å; V704-L708 WeakPolarHBondContact O-CG 3.45Å; V704-L708 PolarHBondContact O-N 2.95Å
705	R	91.4	Very high	89.5	Confident	14 Å²	14	26.5 Å²	26.5	5%	0.053	14%	0.136	C	C	.	.	H	α-helix	trans	-61.6	-45.9	175	-179.7	-173.9	60.1	-128.1	-2.3	112	R701 S702 G703 F707 L708 H709 M730 E741 L745	R701-R705 WeakPolarHBondContact O-CB 3.29Å; R701-R705 PolarHBondContact O-N 2.91Å; S702-R705 PolarHBondContact OG-NH2 3.49Å; G703-R705 VanDerWaalsContact C-N 3.32Å; G703-R705 PolarHBondContact O-N 3.11Å; R705-F707 PolarHBondContact O-N 3.02Å; R705-L708 PolarHBondContact O-N 3.31Å; R705-L708 VanDerWaalsContact O-N 3.14Å; R705-H709 PolarHBondContact O-CD2 3.3Å; R705-H709 VanDerWaalsContact O-CD2 3.29Å; R705-H709 PolarHBondContact O-N 3.29Å; R705-M730 HydrophobicContact CB-CE 3.83Å; R705-M730 HydrophobicContact CG-CE 3.83Å; R705-E741 VanDerWaalsContact CD-O 3.27Å; R705-E741 WeakPolarHBondContact CD-O 3.3Å; R705-E741 IonicContact CZ-OE2 3.05Å; R705-E741 IonicContact NH1-OE2 2.97Å; R705-E741 PolarHBondContact NH1-OE2 2.72Å; R705-E741 IonicContact NH2-OE1 2.66Å; R705-E741 IonicContact NH2-OE2 2.64Å; R705-E741 PolarHBondContact NH2-OE2 3.24Å; R705-L745 HydrophobicContact CG-CB 4.48Å; R705-L745 HydrophobicContact CG-CD2 4.2Å
706	T	91	Very high	89.6	Confident	75 Å²	75	27.2 Å²	27.2	46%	0.46	14%	0.138	S	C	.	.	H	α-helix	trans	-61	-37.2	177.4	-58.9	0	0	0	0	111.2	S702 G703 R710	S702-T706 WeakPolarHBondContact O-CB 3.39Å; S702-T706 PolarHBondContact O-N 3.26Å; S702-T706 PolarHBondContact O-OG1 2.95Å; G703-T706 PolarHBondContact O-N 3.4Å; T706-R710 PolarHBondContact O-N 3.49Å
707	F	93.9	Very high	89.6	Confident	1 Å²	1	30 Å²	30	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-66.6	-44.1	172.5	-176.6	-112.8	0	0	0	112.5	V655 A658 Y680 C683 L684 F687 G703 V704 R705 H709 R710 M711	V655-F707 HydrophobicContact CG1-CB 3.55Å; V655-F707 HydrophobicContact CG1-CG 4.09Å; A658-F707 HydrophobicContact CB-CE2 4.33Å; Y680-F707 HydrophobicContact CD1-CE2 4.39Å; Y680-F707 HydrophobicContact CD1-CZ 4.37Å; C683-F707 HydrophobicContact CB-CE1 4.25Å; C683-F707 HydrophobicContact CB-CZ 3.72Å; L684-F707 HydrophobicContact CD2-CD1 4.01Å; L684-F707 HydrophobicContact CD2-CE1 3.67Å; L684-F707 HydrophobicContact CG-CE1 3.84Å; F687-F707 AromaticContact CD2-CD1 3.97Å; F687-F707 HydrophobicContact CD2-CD1 3.97Å; F687-F707 AromaticContact CD2-CE1 3.77Å; F687-F707 HydrophobicContact CD2-CE1 3.77Å; F687-F707 HydrophobicContact CD2-CG 4.47Å; F687-F707 HydrophobicContact CD2-CZ 4.11Å; F687-F707 HydrophobicContact CE2-CE1 4.34Å; F687-F707 HydrophobicContact CE2-CE2 4.46Å; F687-F707 HydrophobicContact CE2-CZ 4.21Å; G703-F707 PolarHBondContact O-N 2.85Å; V704-F707 WeakPolarHBondContact O-CB 3.24Å; V704-F707 PolarHBondContact O-N 3.26Å; R705-F707 PolarHBondContact O-N 3.02Å; F707-H709 PolarHBondContact O-N 3.2Å; F707-R710 WeakPolarHBondContact O-CB 3.4Å; F707-R710 PolarHBondContact O-N 3Å; F707-M711 HydrophobicContact CD1-CG 3.94Å; F707-M711 HydrophobicContact CD2-CE 4.22Å; F707-M711 HydrophobicContact CD2-CG 4.29Å; F707-M711 HydrophobicContact CE1-CG 3.6Å; F707-M711 HydrophobicContact CE1-SD 4.26Å; F707-M711 HydrophobicContact CE2-CE 3.67Å; F707-M711 HydrophobicContact CE2-CG 3.99Å; F707-M711 HydrophobicContact CE2-SD 3.96Å; F707-M711 HydrophobicContact CG-CG 4.27Å; F707-M711 HydrophobicContact CZ-CE 4.05Å; F707-M711 HydrophobicContact CZ-CG 3.63Å; F707-M711 HydrophobicContact CZ-SD 3.69Å; F707-M711 WeakPolarHBondContact O-CG 3.2Å; F707-M711 PolarHBondContact O-N 3.49Å
708	L	93.3	Very high	89.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-44.3	176.9	-76.2	171.3	0	0	0	112.5	L684 L688 V704 R705 R710 M711 I712 A726 L745	L684-L708 HydrophobicContact CD2-CD2 3.74Å; L688-L708 HydrophobicContact CD2-CD1 4.38Å; L688-L708 HydrophobicContact CD2-CD2 4.3Å; V704-L708 HydrophobicContact CG1-CD1 4.21Å; V704-L708 HydrophobicContact CG1-CG 4.4Å; V704-L708 WeakPolarHBondContact O-CG 3.45Å; V704-L708 PolarHBondContact O-N 2.95Å; R705-L708 PolarHBondContact O-N 3.31Å; R705-L708 VanDerWaalsContact O-N 3.14Å; L708-R710 PolarHBondContact O-N 3.1Å; L708-R710 VanDerWaalsContact O-N 3.15Å; L708-M711 PolarHBondContact O-N 2.88Å; L708-M711 VanDerWaalsContact O-N 3.12Å; L708-I712 WeakPolarHBondContact O-CD1 3.41Å; L708-I712 VanDerWaalsContact O-CG1 3.3Å; L708-I712 WeakPolarHBondContact O-CG1 3.27Å; L708-I712 PolarHBondContact O-N 2.99Å; L708-A726 HydrophobicContact CD1-CB 3.9Å; L708-L745 HydrophobicContact CB-CD1 4.1Å; L708-L745 HydrophobicContact CB-CD2 4.26Å; L708-L745 HydrophobicContact CD1-CD2 4.19Å
709	H	92.3	Very high	90	Very high	47 Å²	47	26.3 Å²	26.3	22%	0.218	13%	0.132	C	C	.	.	H	α-helix	trans	-51	-39.8	173.7	-86.8	-68.4	0	0	0	112.4	R705 F707 L745 Q748	R705-H709 PolarHBondContact O-CD2 3.3Å; R705-H709 VanDerWaalsContact O-CD2 3.29Å; R705-H709 PolarHBondContact O-N 3.29Å; F707-H709 PolarHBondContact O-N 3.2Å; H709-L745 HydrophobicContact CB-CD1 4.4Å; H709-L745 WeakPolarHBondContact CE1-CA 3.44Å; H709-L745 PolarHBondContact CE1-N 3.1Å; H709-L745 VanDerWaalsContact CE1-N 3.3Å; H709-Q748 VanDerWaalsContact CA-OE1 3.31Å; H709-Q748 PolarHBondContact ND1-OE1 3.2Å; H709-Q748 PolarHBondContact O-NE2 3.06Å; H709-Q748 PolarHBondContact O-OE1 2.85Å
710	R	90.8	Very high	90	Very high	47 Å²	47	26.6 Å²	26.6	18%	0.177	13%	0.134	C	C	.	.	H	α-helix	trans	-80	-38.7	-179.1	-167.9	60.9	-171.6	162.7	10.5	112.2	S662 K663 F665 T706 F707 L708 I712 I713 C714	S662-R710 PolarHBondContact O-NE 3.47Å; S662-R710 PolarHBondContact O-NH2 3.27Å; S662-R710 WeakPolarHBondContact OG-CG 3.5Å; S662-R710 PolarHBondContact OG-NE 3.37Å; K663-R710 VanDerWaalsContact CA-NH2 3.31Å; F665-R710 PolarHBondContact O-NH2 3.42Å; T706-R710 PolarHBondContact O-N 3.49Å; F707-R710 WeakPolarHBondContact O-CB 3.4Å; F707-R710 PolarHBondContact O-N 3Å; L708-R710 PolarHBondContact O-N 3.1Å; L708-R710 VanDerWaalsContact O-N 3.15Å; R710-I712 VanDerWaalsContact C-N 3.3Å; R710-I712 PolarHBondContact O-N 3.17Å; R710-I713 WeakPolarHBondContact O-CA 3.26Å; R710-I713 WeakPolarHBondContact O-CB 3.3Å; R710-I713 PolarHBondContact O-N 3.11Å; R710-C714 PolarHBondContact O-N 2.76Å; R710-C714 PolarHBondContact O-SG 3Å
711	M	93.8	Very high	90	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.8	-31.2	176.3	-68.5	-54.3	101.7	0	0	112.7	Y680 L684 F707 L708 I713 C714 L715 V719	Y680-M711 HydrophobicContact CD1-CE 3.75Å; Y680-M711 HydrophobicContact CD1-SD 3.77Å; Y680-M711 HydrophobicContact CE1-CE 4.17Å; Y680-M711 HydrophobicContact CG-CE 4.37Å; Y680-M711 HydrophobicContact CG-SD 4.02Å; L684-M711 HydrophobicContact CD1-CB 4.25Å; L684-M711 HydrophobicContact CD1-CG 4.2Å; L684-M711 HydrophobicContact CD2-CB 4.26Å; L684-M711 HydrophobicContact CD2-CG 3.96Å; L684-M711 HydrophobicContact CG-CG 4.08Å; F707-M711 HydrophobicContact CD1-CG 3.94Å; F707-M711 HydrophobicContact CD2-CE 4.22Å; F707-M711 HydrophobicContact CD2-CG 4.29Å; F707-M711 HydrophobicContact CE1-CG 3.6Å; F707-M711 HydrophobicContact CE1-SD 4.26Å; F707-M711 HydrophobicContact CE2-CE 3.67Å; F707-M711 HydrophobicContact CE2-CG 3.99Å; F707-M711 HydrophobicContact CE2-SD 3.96Å; F707-M711 HydrophobicContact CG-CG 4.27Å; F707-M711 HydrophobicContact CZ-CE 4.05Å; F707-M711 HydrophobicContact CZ-CG 3.63Å; F707-M711 HydrophobicContact CZ-SD 3.69Å; F707-M711 WeakPolarHBondContact O-CG 3.2Å; F707-M711 PolarHBondContact O-N 3.49Å; L708-M711 PolarHBondContact O-N 2.88Å; L708-M711 VanDerWaalsContact O-N 3.12Å; M711-I713 PolarHBondContact O-N 2.93Å; M711-C714 HydrophobicContact CE-CB 4.3Å; M711-C714 PolarHBondContact O-N 3.02Å; M711-L715 HydrophobicContact CB-CD1 4.39Å; M711-L715 WeakPolarHBondContact O-CB 3.28Å; M711-L715 PolarHBondContact O-N 3.4Å; M711-L715 HydrophobicContact SD-CD1 3.96Å; M711-L715 HydrophobicContact SD-CG 4.28Å; M711-V719 HydrophobicContact CB-CG2 4.15Å
712	I	90.8	Very high	90	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.7	-36.2	169.7	-70.4	158.2	0	0	0	111.5	L708 R710 V719 L745 Q748 I749 K752 F753	L708-I712 WeakPolarHBondContact O-CD1 3.41Å; L708-I712 VanDerWaalsContact O-CG1 3.3Å; L708-I712 WeakPolarHBondContact O-CG1 3.27Å; L708-I712 PolarHBondContact O-N 2.99Å; R710-I712 VanDerWaalsContact C-N 3.3Å; R710-I712 PolarHBondContact O-N 3.17Å; I712-V719 HydrophobicContact CG1-CG1 4.03Å; I712-L745 HydrophobicContact CD1-CD1 3.41Å; I712-L745 VanDerWaalsContact CD1-CD1 3.41Å; I712-L745 HydrophobicContact CD1-CG 4.41Å; I712-Q748 HydrophobicContact CG2-CG 4.25Å; I712-I749 HydrophobicContact CD1-CD1 4.02Å; I712-I749 HydrophobicContact CD1-CG1 3.46Å; I712-I749 VanDerWaalsContact CD1-CG1 3.46Å; I712-I749 HydrophobicContact CG1-CG1 4.26Å; I712-K752 HydrophobicContact CG2-CD 3.69Å; I712-K752 WeakPolarHBondContact O-CE 3.38Å; I712-K752 PolarHBondContact O-NZ 3.5Å; I712-F753 HydrophobicContact CG2-CE2 3.84Å; I712-F753 HydrophobicContact CG2-CZ 4.24Å
713	I	89	Confident	90.1	Very high	52 Å²	52	31 Å²	31	27%	0.267	16%	0.159	S	C	.	.	H	α-helix	trans	-73.6	-45.5	176.6	-59.7	171.5	0	0	0	110.7	R710 M711 K752	R710-I713 WeakPolarHBondContact O-CA 3.26Å; R710-I713 WeakPolarHBondContact O-CB 3.3Å; R710-I713 PolarHBondContact O-N 3.11Å; M711-I713 PolarHBondContact O-N 2.93Å; I713-K752 PolarHBondContact O-NZ 2.89Å
714	C	88.1	Confident	90	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-81.5	-34.2	-171.2	-68.9	0	0	0	0	115	K668 V671 R710 M711	K668-C714 WeakPolarHBondContact CA-O 3.49Å; K668-C714 WeakPolarHBondContact CB-O 3.4Å; V671-C714 HydrophobicContact CG2-CB 4.02Å; R710-C714 PolarHBondContact O-N 2.76Å; R710-C714 PolarHBondContact O-SG 3Å; M711-C714 HydrophobicContact CE-CB 4.3Å; M711-C714 PolarHBondContact O-N 3.02Å
715	L	87.8	Confident	89.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-111.5	-19.7	-172.5	-60.3	179.7	0	0	0	113.7	K668 V671 L681 L684 M711 E717 E718 V719	K668-L715 VanDerWaalsContact CD-O 3.28Å; K668-L715 WeakPolarHBondContact CD-O 3.38Å; K668-L715 VanDerWaalsContact CE-O 3.27Å; K668-L715 WeakPolarHBondContact CE-O 3.35Å; K668-L715 PolarHBondContact NZ-O 3.34Å; V671-L715 HydrophobicContact CG1-CD2 4.33Å; L681-L715 HydrophobicContact CD2-CD1 3.93Å; L681-L715 HydrophobicContact CG-CD1 4.33Å; L684-L715 HydrophobicContact CD1-CD1 3.59Å; M711-L715 HydrophobicContact CB-CD1 4.39Å; M711-L715 WeakPolarHBondContact O-CB 3.28Å; M711-L715 PolarHBondContact O-N 3.4Å; M711-L715 HydrophobicContact SD-CD1 3.96Å; M711-L715 HydrophobicContact SD-CG 4.28Å; L715-E717 PolarHBondContact O-N 3.3Å; L715-E718 HydrophobicContact CB-CB 4.22Å; L715-E718 PolarHBondContact O-N 2.97Å; L715-V719 HydrophobicContact CB-CB 4.44Å
716	E	87.7	Confident	89.6	Confident	62 Å²	62	36 Å²	36	29%	0.29	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	48.6	-122.6	-178.6	-48	-174.3	147.6	0	0	111.2	K668 E718 V719 K752 F753	K668-E716 HydrophobicContact CB-CG 3.76Å; K668-E716 HydrophobicContact CD-CB 3.73Å; K668-E716 HydrophobicContact CD-CG 3.82Å; K668-E716 WeakPolarHBondContact CD-OE2 3.38Å; K668-E716 HydrophobicContact CG-CG 4.44Å; E716-E718 PolarHBondContact O-N 3.45Å; E716-V719 WeakPolarHBondContact O-CG1 3.34Å; E716-V719 PolarHBondContact O-N 2.89Å; E716-K752 VanDerWaalsContact CG-NZ 3.34Å; E716-K752 WeakPolarHBondContact OE1-CE 3.41Å; E716-K752 IonicContact OE1-NZ 3.55Å; E716-K752 PolarHBondContact OE1-NZ 2.76Å; E716-F753 VanDerWaalsContact C-CE1 3.45Å; E716-F753 HydrophobicContact CB-CE1 4.19Å; E716-F753 WeakPolarHBondContact O-CZ 3.25Å
717	E	85.9	Confident	89.4	Confident	108 Å²	108	32.6 Å²	32.6	51%	0.505	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-55.8	-24.6	-175.3	-61.1	176.1	161.4	0	0	114.1	L715 V719 L720 Q756	L715-E717 PolarHBondContact O-N 3.3Å; E717-V719 PolarHBondContact O-N 3.48Å; E717-L720 HydrophobicContact CB-CD1 4.33Å; E717-L720 WeakPolarHBondContact O-CB 3.47Å; E717-L720 PolarHBondContact O-N 3.36Å; E717-Q756 PolarHBondContact OE1-NE2 3.46Å
718	E	87.1	Confident	89	Confident	51 Å²	51	39.2 Å²	39.2	24%	0.238	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-70.7	-17.4	179.2	-72	161.6	-140.4	0	0	112.5	K668 K672 L681 L715 E716	K668-E718 WeakPolarHBondContact CE-OE1 3.49Å; K668-E718 IonicContact NZ-OE1 3.79Å; K668-E718 PolarHBondContact NZ-OE1 3.25Å; K668-E718 VanDerWaalsContact NZ-OE1 3.09Å; K672-E718 WeakPolarHBondContact CE-OE1 3.2Å; K672-E718 IonicContact NZ-OE1 2.67Å; K672-E718 PolarHBondContact NZ-OE1 3.36Å; L681-E718 HydrophobicContact CD2-CB 4.46Å; L715-E718 HydrophobicContact CB-CB 4.22Å; L715-E718 PolarHBondContact O-N 2.97Å; E716-E718 PolarHBondContact O-N 3.45Å
719	V	90.3	Very high	88.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-84.5	-21.8	175.8	87.7	0	0	0	0	112.9	L684 M711 I712 L715 E716 E717 F722 I723 F753	L684-V719 HydrophobicContact CD1-CG2 3.91Å; M711-V719 HydrophobicContact CB-CG2 4.15Å; I712-V719 HydrophobicContact CG1-CG1 4.03Å; L715-V719 HydrophobicContact CB-CB 4.44Å; E716-V719 WeakPolarHBondContact O-CG1 3.34Å; E716-V719 PolarHBondContact O-N 2.89Å; E717-V719 PolarHBondContact O-N 3.48Å; V719-F722 WeakPolarHBondContact O-CB 3.39Å; V719-F722 PolarHBondContact O-N 3.5Å; V719-I723 HydrophobicContact CG1-CD1 4.23Å; V719-I723 HydrophobicContact CG1-CG1 4.24Å; V719-I723 HydrophobicContact CG2-CD1 4.37Å; V719-F753 HydrophobicContact CG1-CE2 4.44Å; V719-F753 HydrophobicContact CG1-CZ 4.13Å
720	L	87.9	Confident	88.2	Confident	43 Å²	43	39.8 Å²	39.8	23%	0.225	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-54.7	-39.1	-171.3	-68.8	176	0	0	0	114.4	E717 F722 I723 P724 F753 V757	E717-L720 HydrophobicContact CB-CD1 4.33Å; E717-L720 WeakPolarHBondContact O-CB 3.47Å; E717-L720 PolarHBondContact O-N 3.36Å; L720-F722 PolarHBondContact O-N 3.03Å; L720-F722 VanDerWaalsContact O-N 3.13Å; L720-I723 PolarHBondContact O-N 3.3Å; L720-P724 VanDerWaalsContact O-CD 3.26Å; L720-P724 WeakPolarHBondContact O-CD 3.05Å; L720-F753 HydrophobicContact CD1-CD1 4.26Å; L720-F753 HydrophobicContact CD1-CE1 4.43Å; L720-F753 HydrophobicContact CD2-CD1 4.06Å; L720-F753 HydrophobicContact CD2-CD2 3.81Å; L720-F753 HydrophobicContact CD2-CE1 4.13Å; L720-F753 HydrophobicContact CD2-CE2 3.86Å; L720-F753 HydrophobicContact CD2-CG 3.9Å; L720-F753 HydrophobicContact CD2-CZ 4.02Å; L720-F753 HydrophobicContact CG-CD1 4.41Å; L720-F753 HydrophobicContact CG-CE1 4.25Å; L720-F753 HydrophobicContact CG-CZ 4.39Å; L720-V757 HydrophobicContact CD2-CG1 3.74Å
721	P	89.9	Confident	87.8	Confident	100 Å²	100	39.1 Å²	39.1	65%	0.649	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-59.9	-24.3	178.3	-25.3	36	0	0	0	114.3
722	F	89.3	Confident	87.2	Confident	41 Å²	41	45.5 Å²	45.5	18%	0.18	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-90.3	-20.6	-177.1	-59	-82.4	0	0	0	113.4	L681 L684 Q685 L688 V719 L720 A726	L681-F722 HydrophobicContact CD2-CE2 3.92Å; L684-F722 HydrophobicContact CD1-CD2 4.43Å; Q685-F722 HydrophobicContact CG-CE1 3.89Å; Q685-F722 HydrophobicContact CG-CZ 4.16Å; L688-F722 HydrophobicContact CD1-CB 3.72Å; L688-F722 HydrophobicContact CD1-CD1 3.45Å; L688-F722 VanDerWaalsContact CD1-CD1 3.45Å; L688-F722 HydrophobicContact CD1-CE1 4.39Å; L688-F722 HydrophobicContact CD1-CG 3.89Å; V719-F722 WeakPolarHBondContact O-CB 3.39Å; V719-F722 PolarHBondContact O-N 3.5Å; L720-F722 PolarHBondContact O-N 3.03Å; L720-F722 VanDerWaalsContact O-N 3.13Å; F722-A726 WeakPolarHBondContact O-CB 3.46Å; F722-A726 PolarHBondContact O-N 3.45Å
723	I	89	Confident	86.5	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-43	-173.8	-62.5	-57	0	0	0	113.6	V719 L720 A726 S727 I749 F760	V719-I723 HydrophobicContact CG1-CD1 4.23Å; V719-I723 HydrophobicContact CG1-CG1 4.24Å; V719-I723 HydrophobicContact CG2-CD1 4.37Å; L720-I723 PolarHBondContact O-N 3.3Å; I723-A726 PolarHBondContact O-N 3.22Å; I723-S727 VanDerWaalsContact O-CB 3.31Å; I723-S727 WeakPolarHBondContact O-CB 3.47Å; I723-S727 PolarHBondContact O-N 2.89Å; I723-S727 PolarHBondContact O-OG 3.48Å; I723-I749 HydrophobicContact CD1-CD1 4.02Å; I723-I749 HydrophobicContact CG1-CD1 4.47Å; I723-I749 HydrophobicContact CG2-CD1 3.78Å; I723-F760 HydrophobicContact CG2-CD1 4.46Å; I723-F760 HydrophobicContact CG2-CE1 3.9Å; I723-F760 HydrophobicContact CG2-CZ 4.04Å
724	P	87.6	Confident	85.8	Confident	62 Å²	62	49.3 Å²	49.3	40%	0.403	26%	0.257	S	S	.	.	H	α-helix	trans	-61.1	-47	179.1	-25.8	35.6	0	0	0	112.5	L720 S727 E728 F760	L720-P724 VanDerWaalsContact O-CD 3.26Å; L720-P724 WeakPolarHBondContact O-CD 3.05Å; P724-S727 PolarHBondContact O-N 2.98Å; P724-E728 PolarHBondContact O-N 3.21Å; P724-F760 HydrophobicContact CB-CD2 4.13Å; P724-F760 HydrophobicContact CB-CE2 4.15Å; P724-F760 HydrophobicContact CG-CD2 4.03Å; P724-F760 HydrophobicContact CG-CE2 4.37Å
725	S	88.1	Confident	85.2	Confident	59 Å²	59	55.2 Å²	55.2	41%	0.413	29%	0.285	S	S	.	.	H	α-helix	trans	-65.3	-41.9	179.1	-175.2	0	0	0	0	111.9	E728 H729	S725-E728 PolarHBondContact O-N 2.86Å; S725-H729 PolarHBondContact O-N 3.16Å; S725-H729 PolarHBondContact O-ND1 3.47Å
726	A	87.8	Confident	84.5	Confident	3 Å²	3	56 Å²	56	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-45.9	176.4	0	0	0	0	0	111.9	L688 L691 L708 F722 I723 E728 H729 M730	L688-A726 HydrophobicContact CD2-CB 3.85Å; L691-A726 HydrophobicContact CD1-CB 3.92Å; L708-A726 HydrophobicContact CD1-CB 3.9Å; F722-A726 WeakPolarHBondContact O-CB 3.46Å; F722-A726 PolarHBondContact O-N 3.45Å; I723-A726 PolarHBondContact O-N 3.22Å; A726-E728 PolarHBondContact O-N 3.49Å; A726-H729 PolarHBondContact O-N 3.44Å; A726-M730 VanDerWaalsContact O-CG 3.26Å; A726-M730 WeakPolarHBondContact O-CG 3.37Å; A726-M730 PolarHBondContact O-N 3.07Å
727	S	87.2	Confident	84	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.028	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-39.9	-180	-59.5	0	0	0	0	112.8	I723 P724 M730 L731 F760	I723-S727 VanDerWaalsContact O-CB 3.31Å; I723-S727 WeakPolarHBondContact O-CB 3.47Å; I723-S727 PolarHBondContact O-N 2.89Å; I723-S727 PolarHBondContact O-OG 3.48Å; P724-S727 PolarHBondContact O-N 2.98Å; S727-M730 PolarHBondContact O-N 3.41Å; S727-L731 WeakPolarHBondContact O-CB 3.43Å; S727-L731 WeakPolarHBondContact O-CG 3.2Å; S727-L731 PolarHBondContact O-N 3.38Å; S727-F760 WeakPolarHBondContact OG-CZ 3.45Å
728	E	85.6	Confident	83.8	Confident	141 Å²	141	53.4 Å²	53.4	66%	0.659	28%	0.278	S	S	*	.	H	α-helix	trans	-61.2	-46	176.8	-174.9	-179.9	-175.8	0	0	111.9	P724 S725 A726 L731 K732	P724-E728 PolarHBondContact O-N 3.21Å; S725-E728 PolarHBondContact O-N 2.86Å; A726-E728 PolarHBondContact O-N 3.49Å; E728-L731 PolarHBondContact O-N 3.09Å; E728-K732 PolarHBondContact O-N 3.26Å
729	H	84.6	Confident	83.6	Confident	52 Å²	52	51 Å²	51	24%	0.241	27%	0.267	C	S	.	.	H	α-helix	trans	-70	-33.2	179	-70.3	97	0	0	0	113.3	L691 S692 R701 S725 A726	L691-H729 HydrophobicContact CB-CB 3.8Å; S692-H729 PolarHBondContact OG-CD2 3.11Å; S692-H729 PolarHBondContact OG-NE2 2.97Å; R701-H729 PolarHBondContact NH2-O 2.9Å; R701-H729 VanDerWaalsContact NH2-O 3.1Å; S725-H729 PolarHBondContact O-N 3.16Å; S725-H729 PolarHBondContact O-ND1 3.47Å; A726-H729 PolarHBondContact O-N 3.44Å
730	M	84.2	Confident	83.2	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.03	28%	0.277	C	S	.	.	H	α-helix	trans	-69.6	-40.7	175.8	-71.3	-178.6	77.1	0	0	111.3	L691 R705 A726 S727 K732 C734 F742 L745	L691-M730 HydrophobicContact CD1-CG 4.29Å; L691-M730 HydrophobicContact CD2-CG 4.04Å; R705-M730 HydrophobicContact CB-CE 3.83Å; R705-M730 HydrophobicContact CG-CE 3.83Å; A726-M730 VanDerWaalsContact O-CG 3.26Å; A726-M730 WeakPolarHBondContact O-CG 3.37Å; A726-M730 PolarHBondContact O-N 3.07Å; S727-M730 PolarHBondContact O-N 3.41Å; M730-K732 VanDerWaalsContact C-N 3.33Å; M730-K732 PolarHBondContact O-N 3.32Å; M730-C734 PolarHBondContact O-SG 3.49Å; M730-F742 HydrophobicContact CB-CD2 4.15Å; M730-F742 HydrophobicContact CB-CE2 4.11Å; M730-F742 HydrophobicContact CE-CB 4.24Å; M730-F742 HydrophobicContact CE-CD2 3.44Å; M730-F742 VanDerWaalsContact CE-CD2 3.44Å; M730-F742 HydrophobicContact CE-CE2 4.16Å; M730-F742 HydrophobicContact CE-CG 4.2Å; M730-F742 HydrophobicContact SD-CD2 3.7Å; M730-F742 HydrophobicContact SD-CE2 3.78Å; M730-L745 HydrophobicContact SD-CD2 4.2Å
731	L	82.8	Confident	83	Confident	34 Å²	34	53.9 Å²	53.9	18%	0.178	28%	0.28	C	S	.	.	H	α-helix	trans	-73.3	-19	-179.5	-75.4	173.6	0	0	0	114.7	S727 E728 C734 L739 F742 M764 L768	S727-L731 WeakPolarHBondContact O-CB 3.43Å; S727-L731 WeakPolarHBondContact O-CG 3.2Å; S727-L731 PolarHBondContact O-N 3.38Å; E728-L731 PolarHBondContact O-N 3.09Å; L731-C734 VanDerWaalsContact CA-SG 3.6Å; L731-L739 HydrophobicContact CD2-CD2 4.18Å; L731-F742 HydrophobicContact CD1-CE1 4.18Å; L731-F742 HydrophobicContact CD2-CD1 3.94Å; L731-F742 HydrophobicContact CD2-CE1 3.68Å; L731-F742 HydrophobicContact CG-CD1 4.39Å; L731-F742 HydrophobicContact CG-CE1 3.75Å; L731-F742 HydrophobicContact CG-CZ 4.35Å; L731-M764 HydrophobicContact CD1-CG 3.74Å; L731-M764 HydrophobicContact CD1-SD 4.2Å; L731-L768 HydrophobicContact CD2-CD1 3.8Å
732	K	81.4	Confident	82.9	Confident	133 Å²	133	49.2 Å²	49.2	58%	0.578	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	128.9	178.9	-173	178.2	179.5	-178.7	0	110.7	R701 E728 M730 C734	R701-K732 PolarHBondContact NH2-O 3.13Å; E728-K732 PolarHBondContact O-N 3.26Å; M730-K732 VanDerWaalsContact C-N 3.33Å; M730-K732 PolarHBondContact O-N 3.32Å; K732-C734 PolarHBondContact O-N 3.01Å
733	D	75.7	Confident	82.9	Confident	106 Å²	106	47.2 Å²	47.2	57%	0.567	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	53.6	-179.4	-46.9	-33.5	0	0	0	112.4	K697 R701	K697-D733 IonicContact NZ-OD2 3.14Å; K697-D733 PolarHBondContact NZ-OD2 2.87Å; R701-D733 PolarHBondContact NH1-O 3.45Å
734	C	74.5	Confident	83	Confident	26 Å²	26	49.7 Å²	49.7	18%	0.176	26%	0.257	C	S	.	.			trans	-83.7	138.8	179.2	-95.3	0	0	0	0	112.7	M730 L731 K732 D738 L739	M730-C734 PolarHBondContact O-SG 3.49Å; L731-C734 VanDerWaalsContact CA-SG 3.6Å; K732-C734 PolarHBondContact O-N 3.01Å; C734-D738 HydrophobicContact CB-CB 4.39Å; C734-L739 HydrophobicContact CB-CD2 3.92Å; C734-L739 HydrophobicContact CB-CG 3.97Å
735	E	74.3	Confident	83.2	Confident	124 Å²	124	46.9 Å²	46.9	58%	0.579	24%	0.238	S	C	*	.			trans	-97.2	176.2	164	-60.4	-168.8	173.5	0	0	112.2	K737 D738 L739	E735-K737 VanDerWaalsContact C-N 3.28Å; E735-K737 PolarHBondContact O-N 3.36Å; E735-D738 PolarHBondContact N-OD2 3.43Å; E735-D738 PolarHBondContact O-N 2.91Å; E735-L739 WeakPolarHBondContact O-CG 3.35Å; E735-L739 PolarHBondContact O-N 3.33Å
736	A	74.6	Confident	83.2	Confident	18 Å²	18	44 Å²	44	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-56.2	-43.6	-179.8	0	0	0	0	0	112.7	L739 Q740 V775 L794	A736-L739 PolarHBondContact O-N 2.99Å; A736-Q740 PolarHBondContact O-N 2.97Å; A736-V775 HydrophobicContact CB-CG1 3.4Å; A736-V775 VanDerWaalsContact CB-CG1 3.4Å; A736-L794 HydrophobicContact CB-CD2 4.48Å
737	K	77.1	Confident	83.4	Confident	105 Å²	105	45 Å²	45	46%	0.457	22%	0.223	S	C	.	.	H	α-helix	trans	-65.5	-45.2	-179.8	-172.4	-179.5	177.7	-174.6	0	112	E735 L739 Q740 E741	E735-K737 VanDerWaalsContact C-N 3.28Å; E735-K737 PolarHBondContact O-N 3.36Å; K737-L739 VanDerWaalsContact C-N 3.31Å; K737-L739 PolarHBondContact O-N 3.3Å; K737-Q740 WeakPolarHBondContact O-CB 3.33Å; K737-Q740 PolarHBondContact O-N 3.47Å; K737-E741 WeakPolarHBondContact O-CG 3.48Å; K737-E741 PolarHBondContact O-N 3.4Å
738	D	80.4	Confident	83.5	Confident	10 Å²	10	47 Å²	47	5%	0.053	23%	0.232	C	C	.	.	H	α-helix	trans	-56.6	-45.5	176.2	-80	-28.6	0	0	0	111.8	R701 C734 E735 E741 F742	R701-D738 IonicContact NH1-OD2 3.86Å; R701-D738 PolarHBondContact NH1-OD2 3.34Å; C734-D738 HydrophobicContact CB-CB 4.39Å; E735-D738 PolarHBondContact N-OD2 3.43Å; E735-D738 PolarHBondContact O-N 2.91Å; D738-E741 PolarHBondContact O-N 3.13Å; D738-F742 WeakPolarHBondContact O-CB 3.49Å; D738-F742 PolarHBondContact O-N 3.49Å
739	L	83.3	Confident	83.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-43.7	178.1	-67.3	174.8	0	0	0	111.7	L731 C734 E735 A736 K737 E741 F742 I743 L768 A771 I772 V775 L794	L731-L739 HydrophobicContact CD2-CD2 4.18Å; C734-L739 HydrophobicContact CB-CD2 3.92Å; C734-L739 HydrophobicContact CB-CG 3.97Å; E735-L739 WeakPolarHBondContact O-CG 3.35Å; E735-L739 PolarHBondContact O-N 3.33Å; A736-L739 PolarHBondContact O-N 2.99Å; K737-L739 VanDerWaalsContact C-N 3.31Å; K737-L739 PolarHBondContact O-N 3.3Å; L739-E741 PolarHBondContact O-N 3.26Å; L739-F742 PolarHBondContact O-N 3.14Å; L739-I743 WeakPolarHBondContact O-CD1 3.44Å; L739-I743 WeakPolarHBondContact O-CG1 3.15Å; L739-I743 PolarHBondContact O-N 3.12Å; L739-L768 HydrophobicContact CD2-CD1 4.07Å; L739-A771 HydrophobicContact CD1-CB 4.05Å; L739-A771 HydrophobicContact CD2-CB 4Å; L739-I772 HydrophobicContact CD1-CG1 4.2Å; L739-V775 HydrophobicContact CD1-CG2 3.91Å; L739-L794 HydrophobicContact CB-CD1 3.85Å
740	Q	82.9	Confident	83.8	Confident	46 Å²	46	37.9 Å²	37.9	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-58.5	-39.6	177.9	-177.3	-176.2	-8.6	0	0	111.4	A736 K737 P744 M793 L794	A736-Q740 PolarHBondContact O-N 2.97Å; K737-Q740 WeakPolarHBondContact O-CB 3.33Å; K737-Q740 PolarHBondContact O-N 3.47Å; Q740-P744 WeakPolarHBondContact O-CD 3.42Å; Q740-M793 PolarHBondContact NE2-SD 3.37Å; Q740-L794 HydrophobicContact CB-CD1 4.42Å
741	E	83.1	Confident	84	Confident	58 Å²	58	39.9 Å²	39.9	27%	0.271	21%	0.207	S	C	.	.	H	α-helix	trans	-83.2	-28.4	-179	-61.9	176.9	156.7	0	0	112.9	R705 K737 D738 L739 P744	R705-E741 VanDerWaalsContact CD-O 3.27Å; R705-E741 WeakPolarHBondContact CD-O 3.3Å; R705-E741 IonicContact CZ-OE2 3.05Å; R705-E741 IonicContact NH1-OE2 2.97Å; R705-E741 PolarHBondContact NH1-OE2 2.72Å; R705-E741 IonicContact NH2-OE1 2.66Å; R705-E741 IonicContact NH2-OE2 2.64Å; R705-E741 PolarHBondContact NH2-OE2 3.24Å; K737-E741 WeakPolarHBondContact O-CG 3.48Å; K737-E741 PolarHBondContact O-N 3.4Å; D738-E741 PolarHBondContact O-N 3.13Å; L739-E741 PolarHBondContact O-N 3.26Å; E741-P744 WeakPolarHBondContact O-CD 3.45Å
742	F	87.9	Confident	84.2	Confident	1 Å²	1	41.7 Å²	41.7	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-73.6	-37.4	176.5	179.4	-124.4	0	0	0	113.3	M730 L731 D738 L739 L745 I746 M764 L768	M730-F742 HydrophobicContact CB-CD2 4.15Å; M730-F742 HydrophobicContact CB-CE2 4.11Å; M730-F742 HydrophobicContact CE-CB 4.24Å; M730-F742 HydrophobicContact CE-CD2 3.44Å; M730-F742 VanDerWaalsContact CE-CD2 3.44Å; M730-F742 HydrophobicContact CE-CE2 4.16Å; M730-F742 HydrophobicContact CE-CG 4.2Å; M730-F742 HydrophobicContact SD-CD2 3.7Å; M730-F742 HydrophobicContact SD-CE2 3.78Å; L731-F742 HydrophobicContact CD1-CE1 4.18Å; L731-F742 HydrophobicContact CD2-CD1 3.94Å; L731-F742 HydrophobicContact CD2-CE1 3.68Å; L731-F742 HydrophobicContact CG-CD1 4.39Å; L731-F742 HydrophobicContact CG-CE1 3.75Å; L731-F742 HydrophobicContact CG-CZ 4.35Å; D738-F742 WeakPolarHBondContact O-CB 3.49Å; D738-F742 PolarHBondContact O-N 3.49Å; L739-F742 PolarHBondContact O-N 3.14Å; F742-L745 HydrophobicContact CD2-CB 4.48Å; F742-L745 HydrophobicContact CD2-CD2 4.26Å; F742-L745 HydrophobicContact CE2-CD2 4.22Å; F742-L745 WeakPolarHBondContact O-CA 3.28Å; F742-L745 VanDerWaalsContact O-CB 3.3Å; F742-L745 WeakPolarHBondContact O-CB 3.45Å; F742-L745 PolarHBondContact O-N 2.88Å; F742-I746 HydrophobicContact CD1-CG1 4.19Å; F742-I746 HydrophobicContact CD2-CG1 4.41Å; F742-I746 HydrophobicContact CE1-CD1 4.05Å; F742-I746 HydrophobicContact CE1-CG1 3.68Å; F742-I746 HydrophobicContact CE2-CD1 3.82Å; F742-I746 HydrophobicContact CE2-CG1 3.96Å; F742-I746 HydrophobicContact CZ-CD1 3.46Å; F742-I746 VanDerWaalsContact CZ-CD1 3.46Å; F742-I746 HydrophobicContact CZ-CG1 3.58Å; F742-I746 PolarHBondContact O-N 3.21Å; F742-M764 HydrophobicContact CE1-SD 4.28Å; F742-M764 HydrophobicContact CZ-SD 4.19Å; F742-L768 HydrophobicContact CD1-CD1 4.21Å; F742-L768 HydrophobicContact CE1-CD1 4.39Å
743	I	89.6	Confident	84.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-53.2	-46.5	179.7	-74.3	162.4	0	0	0	112.8	L739 L745 I746 N747 I772 L794 S797 F801	L739-I743 WeakPolarHBondContact O-CD1 3.44Å; L739-I743 WeakPolarHBondContact O-CG1 3.15Å; L739-I743 PolarHBondContact O-N 3.12Å; I743-L745 VanDerWaalsContact C-N 3.25Å; I743-L745 PolarHBondContact O-N 3.47Å; I743-I746 PolarHBondContact O-N 3.1Å; I743-N747 PolarHBondContact O-N 2.88Å; I743-I772 HydrophobicContact CD1-CD1 3.88Å; I743-I772 HydrophobicContact CD1-CG1 4.45Å; I743-L794 HydrophobicContact CD1-CD1 4.06Å; I743-S797 WeakPolarHBondContact CG2-O 3.22Å; I743-F801 HydrophobicContact CG2-CB 3.87Å
744	P	90.8	Very high	85	Confident	56 Å²	56	36.5 Å²	36.5	36%	0.364	19%	0.186	S	C	.	.	H	α-helix	trans	-52.5	-38.1	172.6	-30.3	34	0	0	0	114.6	Q740 E741 N747 Q748	Q740-P744 WeakPolarHBondContact O-CD 3.42Å; E741-P744 WeakPolarHBondContact O-CD 3.45Å; P744-N747 PolarHBondContact O-N 3.18Å; P744-Q748 PolarHBondContact O-N 3.3Å
745	L	90.6	Very high	85.4	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-65.9	-47.5	178.3	-177.5	66.9	0	0	0	110.4	R705 L708 H709 I712 M730 F742 I743 N747 Q748 I749	R705-L745 HydrophobicContact CG-CB 4.48Å; R705-L745 HydrophobicContact CG-CD2 4.2Å; L708-L745 HydrophobicContact CB-CD1 4.1Å; L708-L745 HydrophobicContact CB-CD2 4.26Å; L708-L745 HydrophobicContact CD1-CD2 4.19Å; H709-L745 HydrophobicContact CB-CD1 4.4Å; H709-L745 WeakPolarHBondContact CE1-CA 3.44Å; H709-L745 PolarHBondContact CE1-N 3.1Å; H709-L745 VanDerWaalsContact CE1-N 3.3Å; I712-L745 HydrophobicContact CD1-CD1 3.41Å; I712-L745 VanDerWaalsContact CD1-CD1 3.41Å; I712-L745 HydrophobicContact CD1-CG 4.41Å; M730-L745 HydrophobicContact SD-CD2 4.2Å; F742-L745 HydrophobicContact CD2-CB 4.48Å; F742-L745 HydrophobicContact CD2-CD2 4.26Å; F742-L745 HydrophobicContact CE2-CD2 4.22Å; F742-L745 WeakPolarHBondContact O-CA 3.28Å; F742-L745 VanDerWaalsContact O-CB 3.3Å; F742-L745 WeakPolarHBondContact O-CB 3.45Å; F742-L745 PolarHBondContact O-N 2.88Å; I743-L745 VanDerWaalsContact C-N 3.25Å; I743-L745 PolarHBondContact O-N 3.47Å; L745-N747 VanDerWaalsContact C-N 3.31Å; L745-N747 PolarHBondContact O-N 3.29Å; L745-Q748 WeakPolarHBondContact O-CB 3.35Å; L745-Q748 PolarHBondContact O-N 2.95Å; L745-I749 HydrophobicContact CD1-CD1 4.5Å; L745-I749 HydrophobicContact CG-CD1 4.02Å; L745-I749 VanDerWaalsContact O-CG1 3.28Å; L745-I749 WeakPolarHBondContact O-CG1 3.31Å; L745-I749 PolarHBondContact O-N 3.17Å
746	I	89.8	Confident	85.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-41.3	175.6	-64.2	-51.5	0	0	0	111.2	F742 I743 Q748 I749 T750 F760 L761 M764 F801	F742-I746 HydrophobicContact CD1-CG1 4.19Å; F742-I746 HydrophobicContact CD2-CG1 4.41Å; F742-I746 HydrophobicContact CE1-CD1 4.05Å; F742-I746 HydrophobicContact CE1-CG1 3.68Å; F742-I746 HydrophobicContact CE2-CD1 3.82Å; F742-I746 HydrophobicContact CE2-CG1 3.96Å; F742-I746 HydrophobicContact CZ-CD1 3.46Å; F742-I746 VanDerWaalsContact CZ-CD1 3.46Å; F742-I746 HydrophobicContact CZ-CG1 3.58Å; F742-I746 PolarHBondContact O-N 3.21Å; I743-I746 PolarHBondContact O-N 3.1Å; I746-Q748 VanDerWaalsContact C-N 3.32Å; I746-Q748 PolarHBondContact O-N 2.6Å; I746-I749 HydrophobicContact CD1-CD1 4.13Å; I746-I749 PolarHBondContact O-N 2.75Å; I746-T750 WeakPolarHBondContact O-CB 3.46Å; I746-T750 PolarHBondContact O-N 3.23Å; I746-T750 PolarHBondContact O-OG1 2.96Å; I746-F760 HydrophobicContact CD1-CE1 4.47Å; I746-L761 HydrophobicContact CG2-CD2 3.87Å; I746-M764 HydrophobicContact CB-CE 4.41Å; I746-M764 HydrophobicContact CD1-CE 3.67Å; I746-M764 HydrophobicContact CD1-SD 3.8Å; I746-M764 HydrophobicContact CG1-CE 3.79Å; I746-M764 HydrophobicContact CG1-SD 4.32Å; I746-M764 HydrophobicContact CG2-CE 3.71Å; I746-F801 HydrophobicContact CG2-CD2 3.93Å; I746-F801 HydrophobicContact CG2-CE2 3.47Å; I746-F801 VanDerWaalsContact CG2-CE2 3.47Å; I746-F801 HydrophobicContact CG2-CZ 4.42Å
747	N	89.9	Confident	86.5	Confident	24 Å²	24	40.1 Å²	40.1	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-43.1	175.6	-74.3	-15.5	0	0	0	111.8	I743 P744 L745 T750 A751 F801 T804	I743-N747 PolarHBondContact O-N 2.88Å; P744-N747 PolarHBondContact O-N 3.18Å; L745-N747 VanDerWaalsContact C-N 3.31Å; L745-N747 PolarHBondContact O-N 3.29Å; N747-T750 PolarHBondContact O-N 2.93Å; N747-A751 VanDerWaalsContact O-CB 3.27Å; N747-A751 WeakPolarHBondContact O-CB 3.33Å; N747-A751 PolarHBondContact O-N 2.95Å; N747-F801 VanDerWaalsContact OD1-CA 3.24Å; N747-F801 WeakPolarHBondContact OD1-CA 3.45Å; N747-F801 WeakPolarHBondContact OD1-CD2 3.49Å; N747-T804 HydrophobicContact CB-CG2 4.21Å
748	Q	90.5	Very high	86.9	Confident	46 Å²	46	36 Å²	36	22%	0.215	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-43.5	176.8	-168	-170.6	17.4	0	0	111.9	H709 I712 P744 L745 I746 K752	H709-Q748 VanDerWaalsContact CA-OE1 3.31Å; H709-Q748 PolarHBondContact ND1-OE1 3.2Å; H709-Q748 PolarHBondContact O-NE2 3.06Å; H709-Q748 PolarHBondContact O-OE1 2.85Å; I712-Q748 HydrophobicContact CG2-CG 4.25Å; P744-Q748 PolarHBondContact O-N 3.3Å; L745-Q748 WeakPolarHBondContact O-CB 3.35Å; L745-Q748 PolarHBondContact O-N 2.95Å; I746-Q748 VanDerWaalsContact C-N 3.32Å; I746-Q748 PolarHBondContact O-N 2.6Å; Q748-K752 WeakPolarHBondContact O-CB 3.16Å; Q748-K752 PolarHBondContact O-N 3.35Å
749	I	88.9	Confident	87.2	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-49.2	177.1	-67	163	0	0	0	110	I712 I723 L745 I746 K752 F753 V757	I712-I749 HydrophobicContact CD1-CD1 4.02Å; I712-I749 HydrophobicContact CD1-CG1 3.46Å; I712-I749 VanDerWaalsContact CD1-CG1 3.46Å; I712-I749 HydrophobicContact CG1-CG1 4.26Å; I723-I749 HydrophobicContact CD1-CD1 4.02Å; I723-I749 HydrophobicContact CG1-CD1 4.47Å; I723-I749 HydrophobicContact CG2-CD1 3.78Å; L745-I749 HydrophobicContact CD1-CD1 4.5Å; L745-I749 HydrophobicContact CG-CD1 4.02Å; L745-I749 VanDerWaalsContact O-CG1 3.28Å; L745-I749 WeakPolarHBondContact O-CG1 3.31Å; L745-I749 PolarHBondContact O-N 3.17Å; I746-I749 HydrophobicContact CD1-CD1 4.13Å; I746-I749 PolarHBondContact O-N 2.75Å; I749-K752 PolarHBondContact O-N 3.25Å; I749-F753 HydrophobicContact CB-CD2 4.48Å; I749-F753 HydrophobicContact CG2-CD2 3.96Å; I749-F753 WeakPolarHBondContact O-CD2 3.42Å; I749-F753 PolarHBondContact O-N 3.16Å; I749-V757 HydrophobicContact CG2-CB 4.3Å; I749-V757 HydrophobicContact CG2-CG1 3.84Å; I749-V757 HydrophobicContact CG2-CG2 4.24Å
750	T	88.1	Confident	87.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.2	-51.4	179.8	-59.9	0	0	0	0	110.7	I746 N747 K752 K754 L761 T804 V805 M810	I746-T750 WeakPolarHBondContact O-CB 3.46Å; I746-T750 PolarHBondContact O-N 3.23Å; I746-T750 PolarHBondContact O-OG1 2.96Å; N747-T750 PolarHBondContact O-N 2.93Å; T750-K752 PolarHBondContact O-N 3.19Å; T750-K754 WeakPolarHBondContact O-CA 3.34Å; T750-K754 PolarHBondContact O-N 3.25Å; T750-L761 HydrophobicContact CG2-CD1 3.94Å; T750-L761 WeakPolarHBondContact OG1-CD1 3.49Å; T750-T804 HydrophobicContact CG2-CG2 3.84Å; T750-V805 HydrophobicContact CG2-CG2 4.19Å; T750-M810 HydrophobicContact CG2-CE 3.1Å; T750-M810 HydrophobicContact CG2-SD 4.29Å; T750-M810 VanDerWaalsContact O-CE 3.31Å; T750-M810 WeakPolarHBondContact O-CE 3.35Å
751	A	87.6	Confident	87.7	Confident	48 Å²	48	38.6 Å²	38.6	40%	0.397	20%	0.203	S	C	.	.	H	α-helix	trans	-66.9	-36.5	-179.6	0	0	0	0	0	112.9	N747 T804	N747-A751 VanDerWaalsContact O-CB 3.27Å; N747-A751 WeakPolarHBondContact O-CB 3.33Å; N747-A751 PolarHBondContact O-N 2.95Å; A751-T804 HydrophobicContact CB-CG2 4.23Å
752	K	87.1	Confident	87.9	Confident	72 Å²	72	39.2 Å²	39.2	31%	0.313	21%	0.206	S	C	.	.	H	α-helix	trans	-78.7	-47.6	-176.1	-171.8	165.3	-172.9	170	0	113.1	I712 I713 E716 Q748 I749 T750	I712-K752 HydrophobicContact CG2-CD 3.69Å; I712-K752 WeakPolarHBondContact O-CE 3.38Å; I712-K752 PolarHBondContact O-NZ 3.5Å; I713-K752 PolarHBondContact O-NZ 2.89Å; E716-K752 VanDerWaalsContact CG-NZ 3.34Å; E716-K752 WeakPolarHBondContact OE1-CE 3.41Å; E716-K752 IonicContact OE1-NZ 3.55Å; E716-K752 PolarHBondContact OE1-NZ 2.76Å; Q748-K752 WeakPolarHBondContact O-CB 3.16Å; Q748-K752 PolarHBondContact O-N 3.35Å; I749-K752 PolarHBondContact O-N 3.25Å; T750-K752 PolarHBondContact O-N 3.19Å
753	F	87.8	Confident	87.9	Confident	14 Å²	14	46.4 Å²	46.4	6%	0.061	24%	0.239	C	C	.	.	H	α-helix	trans	-98	-14.7	-172.6	-60.1	-71.4	0	0	0	113.8	I712 E716 V719 L720 I749 I755 Q756 V757	I712-F753 HydrophobicContact CG2-CE2 3.84Å; I712-F753 HydrophobicContact CG2-CZ 4.24Å; E716-F753 VanDerWaalsContact C-CE1 3.45Å; E716-F753 HydrophobicContact CB-CE1 4.19Å; E716-F753 WeakPolarHBondContact O-CZ 3.25Å; V719-F753 HydrophobicContact CG1-CE2 4.44Å; V719-F753 HydrophobicContact CG1-CZ 4.13Å; L720-F753 HydrophobicContact CD1-CD1 4.26Å; L720-F753 HydrophobicContact CD1-CE1 4.43Å; L720-F753 HydrophobicContact CD2-CD1 4.06Å; L720-F753 HydrophobicContact CD2-CD2 3.81Å; L720-F753 HydrophobicContact CD2-CE1 4.13Å; L720-F753 HydrophobicContact CD2-CE2 3.86Å; L720-F753 HydrophobicContact CD2-CG 3.9Å; L720-F753 HydrophobicContact CD2-CZ 4.02Å; L720-F753 HydrophobicContact CG-CD1 4.41Å; L720-F753 HydrophobicContact CG-CE1 4.25Å; L720-F753 HydrophobicContact CG-CZ 4.39Å; I749-F753 HydrophobicContact CB-CD2 4.48Å; I749-F753 HydrophobicContact CG2-CD2 3.96Å; I749-F753 WeakPolarHBondContact O-CD2 3.42Å; I749-F753 PolarHBondContact O-N 3.16Å; F753-I755 PolarHBondContact O-N 3.02Å; F753-Q756 HydrophobicContact CB-CB 4.4Å; F753-Q756 WeakPolarHBondContact O-CB 3.44Å; F753-Q756 PolarHBondContact O-N 3.45Å; F753-V757 HydrophobicContact CB-CB 4.46Å; F753-V757 HydrophobicContact CB-CG1 3.63Å; F753-V757 HydrophobicContact CB-CG2 4.07Å; F753-V757 HydrophobicContact CD2-CG1 4.27Å; F753-V757 HydrophobicContact CG-CG1 4.2Å
754	K	87.2	Confident	87.8	Confident	116 Å²	116	47 Å²	47	50%	0.504	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	48.7	-126.8	175.3	-55.9	-179.6	-179.4	179	0	111.4	T750 Q756 V757 M810	T750-K754 WeakPolarHBondContact O-CA 3.34Å; T750-K754 PolarHBondContact O-N 3.25Å; K754-Q756 PolarHBondContact O-N 3.37Å; K754-V757 WeakPolarHBondContact O-CG2 3.12Å; K754-V757 PolarHBondContact O-N 3.07Å; K754-V757 VanDerWaalsContact O-N 3.13Å; K754-M810 VanDerWaalsContact C-SD 3.56Å
755	I	82.5	Confident	87.7	Confident	129 Å²	129	44.4 Å²	44.4	66%	0.662	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-56.6	-28.6	-173.8	-57.6	170.9	0	0	0	112.8	F753 V757 S758	F753-I755 PolarHBondContact O-N 3.02Å; I755-V757 PolarHBondContact O-N 3.08Å; I755-S758 WeakPolarHBondContact O-CB 3.34Å; I755-S758 PolarHBondContact O-N 3.49Å
756	Q	83.9	Confident	87.7	Confident	109 Å²	109	45.1 Å²	45.1	51%	0.509	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-60.2	-31.7	-179.3	-63.2	-178.4	-4.8	0	0	113	E717 F753 K754	E717-Q756 PolarHBondContact OE1-NE2 3.46Å; F753-Q756 HydrophobicContact CB-CB 4.4Å; F753-Q756 WeakPolarHBondContact O-CB 3.44Å; F753-Q756 PolarHBondContact O-N 3.45Å; K754-Q756 PolarHBondContact O-N 3.37Å
757	V	86.9	Confident	87.6	Confident	6 Å²	6	48.4 Å²	48.4	4%	0.036	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-96.5	2.9	179.2	-66.6	0	0	0	0	113	L720 I749 F753 K754 I755 F760 L761 M810	L720-V757 HydrophobicContact CD2-CG1 3.74Å; I749-V757 HydrophobicContact CG2-CB 4.3Å; I749-V757 HydrophobicContact CG2-CG1 3.84Å; I749-V757 HydrophobicContact CG2-CG2 4.24Å; F753-V757 HydrophobicContact CB-CB 4.46Å; F753-V757 HydrophobicContact CB-CG1 3.63Å; F753-V757 HydrophobicContact CB-CG2 4.07Å; F753-V757 HydrophobicContact CD2-CG1 4.27Å; F753-V757 HydrophobicContact CG-CG1 4.2Å; K754-V757 WeakPolarHBondContact O-CG2 3.12Å; K754-V757 PolarHBondContact O-N 3.07Å; K754-V757 VanDerWaalsContact O-N 3.13Å; I755-V757 PolarHBondContact O-N 3.08Å; V757-F760 PolarHBondContact O-N 3.4Å; V757-L761 HydrophobicContact CG2-CD1 3.96Å; V757-L761 HydrophobicContact CG2-CG 4.36Å; V757-L761 WeakPolarHBondContact O-CG 3.45Å; V757-L761 PolarHBondContact O-N 3.45Å; V757-M810 HydrophobicContact CG2-SD 4.41Å
758	S	86.1	Confident	87.5	Confident	18 Å²	18	47.2 Å²	47.2	13%	0.126	24%	0.244	C	C	.	.	H	α-helix	trans	-54	-46.1	179.7	-174.9	0	0	0	0	113.2	I755 F760 L761 Q762	I755-S758 WeakPolarHBondContact O-CB 3.34Å; I755-S758 PolarHBondContact O-N 3.49Å; S758-F760 VanDerWaalsContact C-N 3.33Å; S758-F760 PolarHBondContact O-N 3.24Å; S758-L761 PolarHBondContact O-N 3.49Å; S758-Q762 WeakPolarHBondContact O-CB 3.35Å; S758-Q762 PolarHBondContact O-N 3.47Å
759	P	87.6	Confident	87.4	Confident	80 Å²	80	45 Å²	45	52%	0.519	23%	0.234	S	C	.	.	H	α-helix	trans	-62.6	-38.5	178.9	-21.9	34	0	0	0	113.2	Q763	P759-Q763 WeakPolarHBondContact O-CG 3.34Å; P759-Q763 PolarHBondContact O-N 2.98Å
760	F	88.1	Confident	87.3	Confident	31 Å²	31	49.3 Å²	49.3	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-68.2	-48.4	176.7	163.7	-105.2	0	0	0	111.3	I723 P724 S727 I746 V757 S758 Q762 Q763 M764	I723-F760 HydrophobicContact CG2-CD1 4.46Å; I723-F760 HydrophobicContact CG2-CE1 3.9Å; I723-F760 HydrophobicContact CG2-CZ 4.04Å; P724-F760 HydrophobicContact CB-CD2 4.13Å; P724-F760 HydrophobicContact CB-CE2 4.15Å; P724-F760 HydrophobicContact CG-CD2 4.03Å; P724-F760 HydrophobicContact CG-CE2 4.37Å; S727-F760 WeakPolarHBondContact OG-CZ 3.45Å; I746-F760 HydrophobicContact CD1-CE1 4.47Å; V757-F760 PolarHBondContact O-N 3.4Å; S758-F760 VanDerWaalsContact C-N 3.33Å; S758-F760 PolarHBondContact O-N 3.24Å; F760-Q762 VanDerWaalsContact C-N 3.28Å; F760-Q762 PolarHBondContact O-N 3.03Å; F760-Q763 PolarHBondContact O-N 2.91Å; F760-Q763 VanDerWaalsContact O-N 3.16Å; F760-M764 HydrophobicContact CE1-CE 4.31Å; F760-M764 HydrophobicContact CE1-SD 3.95Å; F760-M764 HydrophobicContact CE2-CB 4.4Å; F760-M764 HydrophobicContact CE2-SD 4.32Å; F760-M764 HydrophobicContact CZ-CB 4.32Å; F760-M764 HydrophobicContact CZ-CE 4.42Å; F760-M764 HydrophobicContact CZ-CG 4.39Å; F760-M764 HydrophobicContact CZ-SD 3.48Å; F760-M764 WeakPolarHBondContact CZ-SD 3.26Å; F760-M764 PolarHBondContact O-N 2.93Å
761	L	87.6	Confident	87.2	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-39	177.6	-72.8	176.9	0	0	0	111.4	I746 T750 V757 S758 Q763 M764 F765 M810 V813	I746-L761 HydrophobicContact CG2-CD2 3.87Å; T750-L761 HydrophobicContact CG2-CD1 3.94Å; T750-L761 WeakPolarHBondContact OG1-CD1 3.49Å; V757-L761 HydrophobicContact CG2-CD1 3.96Å; V757-L761 HydrophobicContact CG2-CG 4.36Å; V757-L761 WeakPolarHBondContact O-CG 3.45Å; V757-L761 PolarHBondContact O-N 3.45Å; S758-L761 PolarHBondContact O-N 3.49Å; L761-Q763 VanDerWaalsContact C-N 3.28Å; L761-Q763 PolarHBondContact O-N 3.4Å; L761-M764 HydrophobicContact CD2-CE 3.79Å; L761-M764 PolarHBondContact O-N 3.35Å; L761-F765 WeakPolarHBondContact O-CA 3.47Å; L761-F765 VanDerWaalsContact O-CB 3.23Å; L761-F765 WeakPolarHBondContact O-CB 3.28Å; L761-F765 PolarHBondContact O-N 3.06Å; L761-M810 HydrophobicContact CD1-CE 4.29Å; L761-M810 HydrophobicContact CD1-SD 3.69Å; L761-V813 HydrophobicContact CB-CG1 4.13Å; L761-V813 HydrophobicContact CB-CG2 4.21Å
762	Q	87.8	Confident	87.2	Confident	70 Å²	70	48 Å²	48	33%	0.327	24%	0.243	S	C	.	.	H	α-helix	trans	-60.6	-37.1	177.4	-171	178	-8.2	0	0	112.5	S758 F760 Q817	S758-Q762 WeakPolarHBondContact O-CB 3.35Å; S758-Q762 PolarHBondContact O-N 3.47Å; F760-Q762 VanDerWaalsContact C-N 3.28Å; F760-Q762 PolarHBondContact O-N 3.03Å; Q762-Q817 PolarHBondContact O-NE2 3.4Å
763	Q	87.3	Confident	87.2	Confident	153 Å²	153	45.6 Å²	45.6	72%	0.715	23%	0.232	S	C	*	.	H	α-helix	trans	-73.4	-37.2	175.5	-68.1	174.9	3.3	0	0	112.5	P759 F760 L761 P767	P759-Q763 WeakPolarHBondContact O-CG 3.34Å; P759-Q763 PolarHBondContact O-N 2.98Å; F760-Q763 PolarHBondContact O-N 2.91Å; F760-Q763 VanDerWaalsContact O-N 3.16Å; L761-Q763 VanDerWaalsContact C-N 3.28Å; L761-Q763 PolarHBondContact O-N 3.4Å; Q763-P767 WeakPolarHBondContact O-CD 3.48Å
764	M	88.1	Confident	87.1	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.059	26%	0.255	C	S	.	.	H	α-helix	trans	-86.4	-20.7	-175.4	-171	-165	68.9	0	0	114	L731 F742 I746 F760 L761 M766 P767 L768	L731-M764 HydrophobicContact CD1-CG 3.74Å; L731-M764 HydrophobicContact CD1-SD 4.2Å; F742-M764 HydrophobicContact CE1-SD 4.28Å; F742-M764 HydrophobicContact CZ-SD 4.19Å; I746-M764 HydrophobicContact CB-CE 4.41Å; I746-M764 HydrophobicContact CD1-CE 3.67Å; I746-M764 HydrophobicContact CD1-SD 3.8Å; I746-M764 HydrophobicContact CG1-CE 3.79Å; I746-M764 HydrophobicContact CG1-SD 4.32Å; I746-M764 HydrophobicContact CG2-CE 3.71Å; F760-M764 HydrophobicContact CE1-CE 4.31Å; F760-M764 HydrophobicContact CE1-SD 3.95Å; F760-M764 HydrophobicContact CE2-CB 4.4Å; F760-M764 HydrophobicContact CE2-SD 4.32Å; F760-M764 HydrophobicContact CZ-CB 4.32Å; F760-M764 HydrophobicContact CZ-CE 4.42Å; F760-M764 HydrophobicContact CZ-CG 4.39Å; F760-M764 HydrophobicContact CZ-SD 3.48Å; F760-M764 WeakPolarHBondContact CZ-SD 3.26Å; F760-M764 PolarHBondContact O-N 2.93Å; L761-M764 HydrophobicContact CD2-CE 3.79Å; L761-M764 PolarHBondContact O-N 3.35Å; M764-M766 PolarHBondContact O-N 3.38Å; M764-P767 VanDerWaalsContact O-CD 3.29Å; M764-P767 WeakPolarHBondContact O-CD 3.41Å; M764-L768 HydrophobicContact CE-CD2 4.22Å; M764-L768 WeakPolarHBondContact O-CB 3.46Å; M764-L768 PolarHBondContact O-N 3.01Å
765	F	89.5	Confident	86.9	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-54.9	-57.6	-170	-172.8	-97.3	0	0	0	112.8	L761 L768 L769 F801 L802 V813 I814 Q817 V825	L761-F765 WeakPolarHBondContact O-CA 3.47Å; L761-F765 VanDerWaalsContact O-CB 3.23Å; L761-F765 WeakPolarHBondContact O-CB 3.28Å; L761-F765 PolarHBondContact O-N 3.06Å; F765-L768 PolarHBondContact O-N 3.01Å; F765-L769 HydrophobicContact CD1-CD1 4.34Å; F765-L769 HydrophobicContact CD1-CD2 3.99Å; F765-L769 HydrophobicContact CD2-CD1 4.32Å; F765-L769 HydrophobicContact CE1-CD1 4.2Å; F765-L769 HydrophobicContact CE1-CD2 3.41Å; F765-L769 VanDerWaalsContact CE1-CD2 3.41Å; F765-L769 HydrophobicContact CE1-CG 4.46Å; F765-L769 HydrophobicContact CE2-CD1 4.15Å; F765-L769 HydrophobicContact CG-CD1 4.41Å; F765-L769 HydrophobicContact CZ-CD1 4.09Å; F765-L769 HydrophobicContact CZ-CD2 3.77Å; F765-L769 VanDerWaalsContact O-CD1 3.23Å; F765-L769 WeakPolarHBondContact O-CD1 3.42Å; F765-L769 PolarHBondContact O-N 3.45Å; F765-F801 AromaticContact CD2-CE1 3.79Å; F765-F801 HydrophobicContact CD2-CE1 3.79Å; F765-F801 AromaticContact CD2-CZ 3.83Å; F765-F801 HydrophobicContact CD2-CZ 3.83Å; F765-F801 AromaticContact CE2-CE1 3.66Å; F765-F801 HydrophobicContact CE2-CE1 3.66Å; F765-F801 HydrophobicContact CE2-CZ 4.06Å; F765-L802 HydrophobicContact CE2-CD2 4.01Å; F765-L802 HydrophobicContact CZ-CD2 3.87Å; F765-V813 HydrophobicContact CB-CG1 4.1Å; F765-V813 HydrophobicContact CD2-CG1 3.86Å; F765-V813 HydrophobicContact CG-CG1 4.11Å; F765-I814 HydrophobicContact CE2-CG1 4.05Å; F765-I814 HydrophobicContact CZ-CG1 3.82Å; F765-Q817 HydrophobicContact CD1-CG 3.66Å; F765-Q817 HydrophobicContact CE1-CG 4.11Å; F765-Q817 HydrophobicContact CG-CG 4.49Å; F765-V825 HydrophobicContact CE1-CG2 4.24Å
766	M	88.7	Confident	86.8	Confident	16 Å²	16	40.6 Å²	40.6	8%	0.079	21%	0.21	C	C	.	.	H	α-helix	trans	-67.3	-42.4	-179.8	-74.6	-60	-58.8	0	0	113.9	M764 L768 L769 H770 Q817 N821	M764-M766 PolarHBondContact O-N 3.38Å; M766-L768 VanDerWaalsContact C-N 3.31Å; M766-L768 PolarHBondContact O-N 2.84Å; M766-L769 PolarHBondContact O-N 3.31Å; M766-L769 HydrophobicContact SD-CD2 4.25Å; M766-H770 VanDerWaalsContact CE-CE1 3.41Å; M766-H770 WeakPolarHBondContact CE-CE1 3.35Å; M766-H770 WeakPolarHBondContact CE-NE2 2.91Å; M766-H770 WeakPolarHBondContact O-CB 3.39Å; M766-H770 PolarHBondContact O-N 3.14Å; M766-H770 PolarHBondContact O-ND1 3.31Å; M766-H770 VanDerWaalsContact O-ND1 3.13Å; M766-Q817 HydrophobicContact CG-CB 4.34Å; M766-Q817 HydrophobicContact CG-CG 4.33Å; M766-N821 HydrophobicContact CE-CB 4.07Å; M766-N821 VanDerWaalsContact CE-CG 3.49Å; M766-N821 VanDerWaalsContact CE-OD1 3.26Å; M766-N821 WeakPolarHBondContact CE-OD1 3.49Å; M766-N821 HydrophobicContact SD-CB 3.83Å
767	P	87.9	Confident	86.7	Confident	69 Å²	69	41.8 Å²	41.8	45%	0.448	22%	0.219	S	C	.	.	H	α-helix	trans	-51.8	-45.4	171.2	-30.4	34.8	0	0	0	113.9	Q763 M764 A771	Q763-P767 WeakPolarHBondContact O-CD 3.48Å; M764-P767 VanDerWaalsContact O-CD 3.29Å; M764-P767 WeakPolarHBondContact O-CD 3.41Å; P767-A771 PolarHBondContact O-N 3.25Å
768	L	87.9	Confident	86.2	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65	-45.1	177	175.1	64	0	0	0	111.7	L731 L739 F742 M764 F765 M766 H770 A771 I772 F801	L731-L768 HydrophobicContact CD2-CD1 3.8Å; L739-L768 HydrophobicContact CD2-CD1 4.07Å; F742-L768 HydrophobicContact CD1-CD1 4.21Å; F742-L768 HydrophobicContact CE1-CD1 4.39Å; M764-L768 HydrophobicContact CE-CD2 4.22Å; M764-L768 WeakPolarHBondContact O-CB 3.46Å; M764-L768 PolarHBondContact O-N 3.01Å; F765-L768 PolarHBondContact O-N 3.01Å; M766-L768 VanDerWaalsContact C-N 3.31Å; M766-L768 PolarHBondContact O-N 2.84Å; L768-H770 VanDerWaalsContact C-N 3.35Å; L768-H770 PolarHBondContact O-N 3.25Å; L768-A771 PolarHBondContact O-N 3.22Å; L768-I772 HydrophobicContact CD1-CD1 4.08Å; L768-I772 HydrophobicContact CD1-CG1 4.37Å; L768-I772 HydrophobicContact CG-CD1 3.96Å; L768-I772 WeakPolarHBondContact O-CG1 3.44Å; L768-I772 PolarHBondContact O-N 2.64Å; L768-F801 HydrophobicContact CD2-CD1 4.36Å; L768-F801 HydrophobicContact CD2-CE1 4Å; L768-F801 HydrophobicContact CD2-CE2 4.42Å; L768-F801 HydrophobicContact CD2-CZ 4.04Å
769	L	88.4	Confident	85.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-40.3	179.1	-94.6	61.9	0	0	0	112.3	F765 M766 I772 F773 Y798 F801 V825	F765-L769 HydrophobicContact CD1-CD1 4.34Å; F765-L769 HydrophobicContact CD1-CD2 3.99Å; F765-L769 HydrophobicContact CD2-CD1 4.32Å; F765-L769 HydrophobicContact CE1-CD1 4.2Å; F765-L769 HydrophobicContact CE1-CD2 3.41Å; F765-L769 VanDerWaalsContact CE1-CD2 3.41Å; F765-L769 HydrophobicContact CE1-CG 4.46Å; F765-L769 HydrophobicContact CE2-CD1 4.15Å; F765-L769 HydrophobicContact CG-CD1 4.41Å; F765-L769 HydrophobicContact CZ-CD1 4.09Å; F765-L769 HydrophobicContact CZ-CD2 3.77Å; F765-L769 VanDerWaalsContact O-CD1 3.23Å; F765-L769 WeakPolarHBondContact O-CD1 3.42Å; F765-L769 PolarHBondContact O-N 3.45Å; M766-L769 PolarHBondContact O-N 3.31Å; M766-L769 HydrophobicContact SD-CD2 4.25Å; L769-I772 PolarHBondContact O-N 3.16Å; L769-F773 HydrophobicContact CB-CE2 4.23Å; L769-F773 WeakPolarHBondContact O-CB 3.45Å; L769-F773 VanDerWaalsContact O-CD2 3.28Å; L769-F773 WeakPolarHBondContact O-CD2 3.3Å; L769-F773 VanDerWaalsContact O-CG 3.22Å; L769-F773 WeakPolarHBondContact O-CG 3.44Å; L769-F773 PolarHBondContact O-N 3.06Å; L769-Y798 HydrophobicContact CD1-CE2 4.25Å; L769-Y798 HydrophobicContact CG-CE2 4.04Å; L769-F801 HydrophobicContact CD1-CD1 4.45Å; L769-F801 HydrophobicContact CD1-CE1 3.93Å; L769-V825 HydrophobicContact CD2-CG2 3.4Å
770	H	87.5	Confident	84.3	Confident	89 Å²	89	51.3 Å²	51.3	41%	0.412	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-44.3	175.5	-71.8	138.6	0	0	0	111.8	M766 L768 I772 F773 E774	M766-H770 VanDerWaalsContact CE-CE1 3.41Å; M766-H770 WeakPolarHBondContact CE-CE1 3.35Å; M766-H770 WeakPolarHBondContact CE-NE2 2.91Å; M766-H770 WeakPolarHBondContact O-CB 3.39Å; M766-H770 PolarHBondContact O-N 3.14Å; M766-H770 PolarHBondContact O-ND1 3.31Å; M766-H770 VanDerWaalsContact O-ND1 3.13Å; L768-H770 VanDerWaalsContact C-N 3.35Å; L768-H770 PolarHBondContact O-N 3.25Å; H770-I772 PolarHBondContact O-N 3.11Å; H770-F773 PolarHBondContact O-N 3.47Å; H770-E774 WeakPolarHBondContact O-CB 3.49Å; H770-E774 PolarHBondContact O-N 3.21Å
771	A	86.5	Confident	83.6	Confident	22 Å²	22	57.4 Å²	57.4	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-44.1	175.9	0	0	0	0	0	111.9	L739 P767 L768 E774 V775	L739-A771 HydrophobicContact CD1-CB 4.05Å; L739-A771 HydrophobicContact CD2-CB 4Å; P767-A771 PolarHBondContact O-N 3.25Å; L768-A771 PolarHBondContact O-N 3.22Å; A771-E774 PolarHBondContact O-N 3.46Å; A771-V775 WeakPolarHBondContact O-CG2 3.44Å; A771-V775 PolarHBondContact O-N 2.8Å
772	I	87.8	Confident	82.3	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-47.9	176.3	-67	167.4	0	0	0	110.9	L739 I743 L768 L769 H770 V775 L776 L794 Y798	L739-I772 HydrophobicContact CD1-CG1 4.2Å; I743-I772 HydrophobicContact CD1-CD1 3.88Å; I743-I772 HydrophobicContact CD1-CG1 4.45Å; L768-I772 HydrophobicContact CD1-CD1 4.08Å; L768-I772 HydrophobicContact CD1-CG1 4.37Å; L768-I772 HydrophobicContact CG-CD1 3.96Å; L768-I772 WeakPolarHBondContact O-CG1 3.44Å; L768-I772 PolarHBondContact O-N 2.64Å; L769-I772 PolarHBondContact O-N 3.16Å; H770-I772 PolarHBondContact O-N 3.11Å; I772-V775 PolarHBondContact O-N 3.5Å; I772-L776 HydrophobicContact CG2-CD1 3.74Å; I772-L776 HydrophobicContact CG2-CG 4.26Å; I772-L776 WeakPolarHBondContact O-CB 3.39Å; I772-L776 VanDerWaalsContact O-CG 3.31Å; I772-L776 WeakPolarHBondContact O-CG 3.47Å; I772-L776 PolarHBondContact O-N 3.42Å; I772-L794 HydrophobicContact CG2-CG 4.42Å; I772-Y798 HydrophobicContact CD1-CD2 4.01Å; I772-Y798 HydrophobicContact CG2-CD2 4.38Å; I772-Y798 HydrophobicContact CG2-CG 4.37Å
773	F	86.6	Confident	81.4	Confident	20 Å²	20	71 Å²	71	9%	0.088	36%	0.364	C	S	.	.	H	α-helix	trans	-66.8	-37.7	-178.9	-65.4	-27.7	0	0	0	112.3	L769 H770 V775 L776 L777 Y798 T828	L769-F773 HydrophobicContact CB-CE2 4.23Å; L769-F773 WeakPolarHBondContact O-CB 3.45Å; L769-F773 VanDerWaalsContact O-CD2 3.28Å; L769-F773 WeakPolarHBondContact O-CD2 3.3Å; L769-F773 VanDerWaalsContact O-CG 3.22Å; L769-F773 WeakPolarHBondContact O-CG 3.44Å; L769-F773 PolarHBondContact O-N 3.06Å; H770-F773 PolarHBondContact O-N 3.47Å; F773-V775 VanDerWaalsContact C-N 3.3Å; F773-V775 PolarHBondContact O-N 2.97Å; F773-L776 PolarHBondContact O-N 3.41Å; F773-L777 VanDerWaalsContact O-CB 3.27Å; F773-L777 WeakPolarHBondContact O-CB 3.38Å; F773-L777 WeakPolarHBondContact O-CD1 3.32Å; F773-L777 WeakPolarHBondContact O-CG 3.15Å; F773-L777 PolarHBondContact O-N 3.4Å; F773-Y798 HydrophobicContact CE1-CE1 4.36Å; F773-Y798 HydrophobicContact CE1-CE2 4.39Å; F773-Y798 AromaticContact CE1-CZ 4Å; F773-Y798 HydrophobicContact CZ-CE2 4.47Å; F773-T828 HydrophobicContact CE1-CG2 3.91Å; F773-T828 HydrophobicContact CZ-CG2 3.76Å
774	E	85.2	Confident	80.9	Confident	113 Å²	113	67 Å²	67	53%	0.528	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-44.4	175.8	-165.3	-167.3	140	0	0	111.3	H770 A771 R778	H770-E774 WeakPolarHBondContact O-CB 3.49Å; H770-E774 PolarHBondContact O-N 3.21Å; A771-E774 PolarHBondContact O-N 3.46Å; E774-R778 PolarHBondContact O-N 2.86Å; E774-R778 IonicContact OE1-CZ 3.29Å; E774-R778 IonicContact OE1-NH2 3.75Å; E774-R778 PolarHBondContact OE1-NH2 3.01Å
775	V	82.8	Confident	80.4	Confident	11 Å²	11	74.2 Å²	74.2	7%	0.067	38%	0.381	C	S	.	.	H	α-helix	trans	-67.2	-44.1	177.1	171.4	0	0	0	0	112	A736 L739 A771 I772 F773 L777 R778 L794	A736-V775 HydrophobicContact CB-CG1 3.4Å; A736-V775 VanDerWaalsContact CB-CG1 3.4Å; L739-V775 HydrophobicContact CD1-CG2 3.91Å; A771-V775 WeakPolarHBondContact O-CG2 3.44Å; A771-V775 PolarHBondContact O-N 2.8Å; I772-V775 PolarHBondContact O-N 3.5Å; F773-V775 VanDerWaalsContact C-N 3.3Å; F773-V775 PolarHBondContact O-N 2.97Å; V775-L777 VanDerWaalsContact C-N 3.28Å; V775-L777 PolarHBondContact O-N 2.99Å; V775-R778 PolarHBondContact O-N 3.12Å; V775-L794 HydrophobicContact CB-CD2 4.07Å; V775-L794 HydrophobicContact CG1-CD2 3.58Å
776	L	81.6	Confident	79.8	Confident	30 Å²	30	77.5 Å²	77.5	16%	0.157	40%	0.404	C	S	.	.	H	α-helix	trans	-68.9	-24.8	-179.2	-70.7	179.1	0	0	0	113.4	I772 F773 K791 L794 R795	I772-L776 HydrophobicContact CG2-CD1 3.74Å; I772-L776 HydrophobicContact CG2-CG 4.26Å; I772-L776 WeakPolarHBondContact O-CB 3.39Å; I772-L776 VanDerWaalsContact O-CG 3.31Å; I772-L776 WeakPolarHBondContact O-CG 3.47Å; I772-L776 PolarHBondContact O-N 3.42Å; F773-L776 PolarHBondContact O-N 3.41Å; L776-K791 HydrophobicContact CD2-CB 4.25Å; L776-K791 HydrophobicContact CD2-CG 4.46Å; L776-L794 HydrophobicContact CD2-CB 4.36Å; L776-L794 HydrophobicContact CD2-CD2 4Å; L776-L794 HydrophobicContact CD2-CG 4.3Å; L776-L794 HydrophobicContact CG-CD2 4.16Å; L776-R795 HydrophobicContact CD1-CG 3.87Å; L776-R795 HydrophobicContact CD2-CG 3.74Å; L776-R795 HydrophobicContact CG-CG 4.49Å
777	L	80.4	Confident	79.1	Confident	134 Å²	134	77.7 Å²	77.7	70%	0.702	41%	0.408	S	S	*	.	H	α-helix	trans	-81.6	-18.3	178.6	-74.8	169	0	0	0	113.6	F773 V775	F773-L777 VanDerWaalsContact O-CB 3.27Å; F773-L777 WeakPolarHBondContact O-CB 3.38Å; F773-L777 WeakPolarHBondContact O-CD1 3.32Å; F773-L777 WeakPolarHBondContact O-CG 3.15Å; F773-L777 PolarHBondContact O-N 3.4Å; V775-L777 VanDerWaalsContact C-N 3.28Å; V775-L777 PolarHBondContact O-N 2.99Å
778	R	77.8	Confident	78.5	Confident	138 Å²	138	76.9 Å²	76.9	52%	0.521	41%	0.407	S	S	.	.	S	Bend	trans	-63.9	129.8	173.6	-68.2	176	-171.5	-174.2	3.4	108.6	E774 V775 K791	E774-R778 PolarHBondContact O-N 2.86Å; E774-R778 IonicContact OE1-CZ 3.29Å; E774-R778 IonicContact OE1-NH2 3.75Å; E774-R778 PolarHBondContact OE1-NH2 3.01Å; V775-R778 PolarHBondContact O-N 3.12Å; R778-K791 PolarHBondContact O-NZ 2.79Å
779	P	67.1	Low	78.1	Confident	125 Å²	125	81.1 Å²	81.1	81%	0.812	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-62.7	141.5	175.1	24.1	-30.7	0	0	0	110.3	K791	P779-K791 VanDerWaalsContact C-NZ 3.25Å; P779-K791 PolarHBondContact O-NZ 2.96Å
780	A	65.9	Low	77.6	Confident	42 Å²	42	84.8 Å²	84.8	35%	0.347	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-91	144.8	165.1	0	0	0	0	0	107.4	A787 K791	A780-A787 HydrophobicContact CB-CB 4.42Å; A780-K791 HydrophobicContact CB-CD 4.37Å
781	E	72.9	Confident	77.3	Confident	158 Å²	158	82 Å²	82	74%	0.738	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-64.9	138.2	167.6	-64.4	-173.2	171.1	0	0	109.1	N783 D784	E781-N783 PolarHBondContact O-N 3.42Å; E781-D784 HydrophobicContact CB-CB 4.38Å; E781-D784 PolarHBondContact O-N 3.15Å
782	E	60.1	Low	77.2	Confident	202 Å²	202	83.9 Å²	83.9	94%	0.944	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.7	-173.1	-71	-177.3	158.6	0	0	113.7
783	N	69	Low	77	Confident	155 Å²	155	87.3 Å²	87.3	83%	0.829	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.8	179.3	-69	-23.2	0	0	0	114.2	E781 Q785	E781-N783 PolarHBondContact O-N 3.42Å; N783-Q785 PolarHBondContact O-N 3.06Å
784	D	78.3	Confident	77.1	Confident	68 Å²	68	86.4 Å²	86.4	36%	0.364	45%	0.451	S	S	.	.			trans	-89.9	86	179.3	-170.8	-11.4	0	0	0	110.9	E781 S786 A787 A788	E781-D784 HydrophobicContact CB-CB 4.38Å; E781-D784 PolarHBondContact O-N 3.15Å; D784-S786 PolarHBondContact O-N 3.02Å; D784-S786 WeakPolarHBondContact OD1-CB 3.28Å; D784-S786 PolarHBondContact OD1-N 3.32Å; D784-A787 HydrophobicContact CB-CB 4.11Å; D784-A787 VanDerWaalsContact CG-CB 3.47Å; D784-A787 PolarHBondContact O-N 2.96Å; D784-A787 PolarHBondContact OD1-N 3.45Å; D784-A787 VanDerWaalsContact OD2-CB 3.29Å; D784-A787 WeakPolarHBondContact OD2-CB 3.31Å; D784-A788 PolarHBondContact O-N 3.43Å; D784-A788 VanDerWaalsContact O-N 3.12Å
785	Q	75.6	Confident	77.2	Confident	165 Å²	165	84.2 Å²	84.2	77%	0.771	44%	0.438	S	S	*	.	H	α-helix	trans	-62.5	-27.8	177	-64.6	-176	-4.1	0	0	112.6	N783 L789	N783-Q785 PolarHBondContact O-N 3.06Å; Q785-L789 WeakPolarHBondContact O-CB 3.24Å; Q785-L789 PolarHBondContact O-N 3.41Å
786	S	76.9	Confident	77.5	Confident	71 Å²	71	87.6 Å²	87.6	50%	0.497	45%	0.45	S	S	.	.	H	α-helix	trans	-69.5	-51	178.9	-168.8	0	0	0	0	110.4	D784 A788 L789 E790	D784-S786 PolarHBondContact O-N 3.02Å; D784-S786 WeakPolarHBondContact OD1-CB 3.28Å; D784-S786 PolarHBondContact OD1-N 3.32Å; S786-A788 VanDerWaalsContact C-N 3.27Å; S786-A788 PolarHBondContact O-N 3.2Å; S786-L789 PolarHBondContact O-N 3.43Å; S786-L789 VanDerWaalsContact O-N 3.15Å; S786-E790 WeakPolarHBondContact O-CG 3.36Å; S786-E790 PolarHBondContact O-N 3.31Å
787	A	74.7	Confident	77.9	Confident	19 Å²	19	87.2 Å²	87.2	16%	0.157	45%	0.449	C	S	.	.	H	α-helix	trans	-62.7	-34.8	177.3	0	0	0	0	0	112.4	A780 D784 K791	A780-A787 HydrophobicContact CB-CB 4.42Å; D784-A787 HydrophobicContact CB-CB 4.11Å; D784-A787 VanDerWaalsContact CG-CB 3.47Å; D784-A787 PolarHBondContact O-N 2.96Å; D784-A787 PolarHBondContact OD1-N 3.45Å; D784-A787 VanDerWaalsContact OD2-CB 3.29Å; D784-A787 WeakPolarHBondContact OD2-CB 3.31Å; A787-K791 WeakPolarHBondContact O-CG 3.36Å; A787-K791 PolarHBondContact O-N 2.93Å; A787-K791 VanDerWaalsContact O-N 3.1Å
788	A	75.2	Confident	78.4	Confident	53 Å²	53	81 Å²	81	44%	0.438	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-44.8	174.1	0	0	0	0	0	112	D784 S786 K791 Q792	D784-A788 PolarHBondContact O-N 3.43Å; D784-A788 VanDerWaalsContact O-N 3.12Å; S786-A788 VanDerWaalsContact C-N 3.27Å; S786-A788 PolarHBondContact O-N 3.2Å; A788-K791 PolarHBondContact O-N 2.79Å; A788-Q792 PolarHBondContact O-N 3.17Å
789	L	79.7	Confident	79.1	Confident	88 Å²	88	74.8 Å²	74.8	46%	0.461	39%	0.393	S	S	.	.	H	α-helix	trans	-65.8	-43.9	177.8	-173	70.7	0	0	0	111.7	Q785 S786 K791 Q792 M793	Q785-L789 WeakPolarHBondContact O-CB 3.24Å; Q785-L789 PolarHBondContact O-N 3.41Å; S786-L789 PolarHBondContact O-N 3.43Å; S786-L789 VanDerWaalsContact O-N 3.15Å; L789-K791 PolarHBondContact O-N 3.19Å; L789-Q792 WeakPolarHBondContact O-CB 3.47Å; L789-Q792 PolarHBondContact O-N 3.17Å; L789-Q792 VanDerWaalsContact O-N 3.16Å; L789-M793 HydrophobicContact CD1-CE 4.33Å; L789-M793 HydrophobicContact CD2-CE 3.98Å; L789-M793 HydrophobicContact CG-CE 3.99Å; L789-M793 WeakPolarHBondContact O-CG 3.35Å; L789-M793 PolarHBondContact O-N 3.2Å
790	E	78.9	Confident	80.3	Confident	77 Å²	77	70.3 Å²	70.3	36%	0.36	37%	0.367	S	S	.	.	H	α-helix	trans	-59.4	-44.5	177.1	-74.8	179	-174.8	0	0	111.9	S786 Q792 M793 L794	S786-E790 WeakPolarHBondContact O-CG 3.36Å; S786-E790 PolarHBondContact O-N 3.31Å; E790-Q792 VanDerWaalsContact C-N 3.33Å; E790-Q792 PolarHBondContact O-N 3.48Å; E790-M793 PolarHBondContact O-N 3.23Å; E790-L794 WeakPolarHBondContact O-CB 3.38Å; E790-L794 PolarHBondContact O-N 3.04Å
791	K	80.1	Confident	81.5	Confident	31 Å²	31	68.4 Å²	68.4	14%	0.135	35%	0.351	C	S	.	.	H	α-helix	trans	-63.6	-39.2	175.1	-73.5	176.4	-172.9	176.9	0	112.1	L776 R778 P779 A780 A787 A788 L789 L794 R795	L776-K791 HydrophobicContact CD2-CB 4.25Å; L776-K791 HydrophobicContact CD2-CG 4.46Å; R778-K791 PolarHBondContact O-NZ 2.79Å; P779-K791 VanDerWaalsContact C-NZ 3.25Å; P779-K791 PolarHBondContact O-NZ 2.96Å; A780-K791 HydrophobicContact CB-CD 4.37Å; A787-K791 WeakPolarHBondContact O-CG 3.36Å; A787-K791 PolarHBondContact O-N 2.93Å; A787-K791 VanDerWaalsContact O-N 3.1Å; A788-K791 PolarHBondContact O-N 2.79Å; L789-K791 PolarHBondContact O-N 3.19Å; K791-L794 PolarHBondContact O-N 3.43Å; K791-R795 WeakPolarHBondContact O-CG 3.39Å; K791-R795 PolarHBondContact O-N 2.85Å
792	Q	83.7	Confident	82.5	Confident	62 Å²	62	60.9 Å²	60.9	29%	0.29	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-45.2	174.2	-176.1	-179.7	4.2	0	0	111.2	A788 L789 E790 R795 R796 D838	A788-Q792 PolarHBondContact O-N 3.17Å; L789-Q792 WeakPolarHBondContact O-CB 3.47Å; L789-Q792 PolarHBondContact O-N 3.17Å; L789-Q792 VanDerWaalsContact O-N 3.16Å; E790-Q792 VanDerWaalsContact C-N 3.33Å; E790-Q792 PolarHBondContact O-N 3.48Å; Q792-R795 WeakPolarHBondContact O-CB 3.45Å; Q792-R795 PolarHBondContact O-N 3.49Å; Q792-R796 PolarHBondContact O-N 3.42Å; Q792-D838 WeakPolarHBondContact CG-OD2 3.41Å; Q792-D838 PolarHBondContact NE2-OD2 3.5Å
793	M	84.9	Confident	84	Confident	72 Å²	72	54.2 Å²	54.2	36%	0.355	28%	0.284	S	S	.	.	H	α-helix	trans	-63.6	-41.8	176.8	-69.5	-170.2	176.6	0	0	112.1	Q740 L789 E790 R795 R796 S797	Q740-M793 PolarHBondContact NE2-SD 3.37Å; L789-M793 HydrophobicContact CD1-CE 4.33Å; L789-M793 HydrophobicContact CD2-CE 3.98Å; L789-M793 HydrophobicContact CG-CE 3.99Å; L789-M793 WeakPolarHBondContact O-CG 3.35Å; L789-M793 PolarHBondContact O-N 3.2Å; E790-M793 PolarHBondContact O-N 3.23Å; M793-R795 VanDerWaalsContact C-N 3.33Å; M793-R795 PolarHBondContact O-N 3.2Å; M793-R796 WeakPolarHBondContact O-CB 3.48Å; M793-R796 PolarHBondContact O-N 2.93Å; M793-S797 PolarHBondContact O-N 3.46Å; M793-S797 PolarHBondContact O-OG 3.33Å
794	L	87.9	Confident	85	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-40.8	175.8	-177.4	60.5	0	0	0	111.7	A736 L739 Q740 I743 I772 V775 L776 E790 K791 S797 Y798	A736-L794 HydrophobicContact CB-CD2 4.48Å; L739-L794 HydrophobicContact CB-CD1 3.85Å; Q740-L794 HydrophobicContact CB-CD1 4.42Å; I743-L794 HydrophobicContact CD1-CD1 4.06Å; I772-L794 HydrophobicContact CG2-CG 4.42Å; V775-L794 HydrophobicContact CB-CD2 4.07Å; V775-L794 HydrophobicContact CG1-CD2 3.58Å; L776-L794 HydrophobicContact CD2-CB 4.36Å; L776-L794 HydrophobicContact CD2-CD2 4Å; L776-L794 HydrophobicContact CD2-CG 4.3Å; L776-L794 HydrophobicContact CG-CD2 4.16Å; E790-L794 WeakPolarHBondContact O-CB 3.38Å; E790-L794 PolarHBondContact O-N 3.04Å; K791-L794 PolarHBondContact O-N 3.43Å; L794-S797 PolarHBondContact O-N 3.34Å; L794-Y798 WeakPolarHBondContact O-CB 3.39Å; L794-Y798 PolarHBondContact O-N 3.06Å
795	R	87.9	Confident	85.5	Confident	68 Å²	68	45 Å²	45	26%	0.257	24%	0.237	S	C	.	.	H	α-helix	trans	-60.4	-45.3	172.8	-74.1	173.3	-178	159.1	1.3	111.8	L776 K791 Q792 M793 S797 Y798 F799 Y836	L776-R795 HydrophobicContact CD1-CG 3.87Å; L776-R795 HydrophobicContact CD2-CG 3.74Å; L776-R795 HydrophobicContact CG-CG 4.49Å; K791-R795 WeakPolarHBondContact O-CG 3.39Å; K791-R795 PolarHBondContact O-N 2.85Å; Q792-R795 WeakPolarHBondContact O-CB 3.45Å; Q792-R795 PolarHBondContact O-N 3.49Å; M793-R795 VanDerWaalsContact C-N 3.33Å; M793-R795 PolarHBondContact O-N 3.2Å; R795-S797 VanDerWaalsContact C-N 3.35Å; R795-S797 PolarHBondContact O-N 3.04Å; R795-Y798 WeakPolarHBondContact O-CB 3.42Å; R795-Y798 PolarHBondContact O-N 2.86Å; R795-F799 HydrophobicContact CB-CE2 4.32Å; R795-F799 WeakPolarHBondContact O-CD2 3.37Å; R795-F799 PolarHBondContact O-N 3.08Å; R795-Y836 VanDerWaalsContact CZ-CE1 3.44Å; R795-Y836 VanDerWaalsContact NH1-CD1 3.34Å; R795-Y836 VanDerWaalsContact NH1-CE1 3.32Å
796	R	89.8	Confident	86.1	Confident	82 Å²	82	37.2 Å²	37.2	31%	0.309	20%	0.2	S	C	.	.	H	α-helix	trans	-59.1	-45.8	175.1	-71.5	177.8	175.5	175.9	0.4	111.5	Q792 M793 F799 A800 D838 A841	Q792-R796 PolarHBondContact O-N 3.42Å; M793-R796 WeakPolarHBondContact O-CB 3.48Å; M793-R796 PolarHBondContact O-N 2.93Å; R796-F799 PolarHBondContact O-N 2.94Å; R796-A800 WeakPolarHBondContact O-CB 3.37Å; R796-A800 PolarHBondContact O-N 3.18Å; R796-D838 IonicContact CZ-OD1 3.68Å; R796-D838 IonicContact CZ-OD2 2.82Å; R796-D838 IonicContact NE-OD1 3.9Å; R796-D838 PolarHBondContact NE-OD1 3.35Å; R796-D838 IonicContact NE-OD2 2.68Å; R796-D838 PolarHBondContact NE-OD2 3.22Å; R796-D838 VanDerWaalsContact NH2-CG 3.29Å; R796-D838 IonicContact NH2-OD1 3.29Å; R796-D838 PolarHBondContact NH2-OD1 3.35Å; R796-D838 IonicContact NH2-OD2 3.96Å; R796-D838 PolarHBondContact NH2-OD2 3.48Å; R796-A841 HydrophobicContact CG-CB 4.28Å
797	S	89.7	Confident	86.5	Confident	22 Å²	22	36.4 Å²	36.4	15%	0.154	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-42.9	176.9	-69.5	0	0	0	0	112	I743 M793 L794 R795 F799 A800 F801	I743-S797 WeakPolarHBondContact CG2-O 3.22Å; M793-S797 PolarHBondContact O-N 3.46Å; M793-S797 PolarHBondContact O-OG 3.33Å; L794-S797 PolarHBondContact O-N 3.34Å; R795-S797 VanDerWaalsContact C-N 3.35Å; R795-S797 PolarHBondContact O-N 3.04Å; S797-F799 PolarHBondContact O-N 3.34Å; S797-A800 WeakPolarHBondContact O-CB 3.26Å; S797-A800 PolarHBondContact O-N 3Å; S797-F801 PolarHBondContact O-N 3.37Å
798	Y	91.5	Very high	86.9	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-49.1	174.9	166.4	-114.1	0	0	0	112.3	L769 I772 F773 L794 R795 A800 F801 L802 T828	L769-Y798 HydrophobicContact CD1-CE2 4.25Å; L769-Y798 HydrophobicContact CG-CE2 4.04Å; I772-Y798 HydrophobicContact CD1-CD2 4.01Å; I772-Y798 HydrophobicContact CG2-CD2 4.38Å; I772-Y798 HydrophobicContact CG2-CG 4.37Å; F773-Y798 HydrophobicContact CE1-CE1 4.36Å; F773-Y798 HydrophobicContact CE1-CE2 4.39Å; F773-Y798 AromaticContact CE1-CZ 4Å; F773-Y798 HydrophobicContact CZ-CE2 4.47Å; L794-Y798 WeakPolarHBondContact O-CB 3.39Å; L794-Y798 PolarHBondContact O-N 3.06Å; R795-Y798 WeakPolarHBondContact O-CB 3.42Å; R795-Y798 PolarHBondContact O-N 2.86Å; Y798-A800 PolarHBondContact O-N 3.24Å; Y798-F801 WeakPolarHBondContact O-CB 3.39Å; Y798-F801 PolarHBondContact O-N 3.4Å; Y798-L802 HydrophobicContact CD2-CG 4.49Å; Y798-L802 HydrophobicContact CE1-CD1 3.94Å; Y798-L802 HydrophobicContact CE2-CD1 3.89Å; Y798-L802 HydrophobicContact CE2-CD2 4.3Å; Y798-L802 HydrophobicContact CE2-CG 4.01Å; Y798-L802 PolarHBondContact O-N 2.93Å; Y798-L802 VanDerWaalsContact O-N 3.08Å; Y798-T828 PolarHBondContact OH-OG1 3.26Å
799	F	92.4	Very high	87	Confident	7 Å²	7	36.7 Å²	36.7	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-66.5	-37.6	177.1	-62.9	-53.1	0	0	0	111.9	R795 R796 S797 F801 L802 Q803 V829 G832 A841 T844 C845 I848	R795-F799 HydrophobicContact CB-CE2 4.32Å; R795-F799 WeakPolarHBondContact O-CD2 3.37Å; R795-F799 PolarHBondContact O-N 3.08Å; R796-F799 PolarHBondContact O-N 2.94Å; S797-F799 PolarHBondContact O-N 3.34Å; F799-F801 VanDerWaalsContact C-N 3.26Å; F799-F801 PolarHBondContact O-N 3.29Å; F799-L802 PolarHBondContact O-N 3.34Å; F799-Q803 WeakPolarHBondContact O-CB 3.4Å; F799-Q803 PolarHBondContact O-N 3.44Å; F799-V829 HydrophobicContact CE1-CG2 4.46Å; F799-G832 VanDerWaalsContact CZ-CA 3.5Å; F799-A841 HydrophobicContact CD2-CB 4.06Å; F799-A841 HydrophobicContact CE2-CB 4.35Å; F799-T844 HydrophobicContact CB-CG2 3.82Å; F799-C845 VanDerWaalsContact CD1-SG 3.55Å; F799-I848 HydrophobicContact CB-CD1 4.23Å; F799-I848 WeakPolarHBondContact O-CD1 3.31Å
800	A	91.4	Very high	87.1	Confident	31 Å²	31	32.7 Å²	32.7	26%	0.256	19%	0.187	S	C	.	.	H	α-helix	trans	-60.8	-35.4	173.3	0	0	0	0	0	112.4	R796 S797 Y798 T804	R796-A800 WeakPolarHBondContact O-CB 3.37Å; R796-A800 PolarHBondContact O-N 3.18Å; S797-A800 WeakPolarHBondContact O-CB 3.26Å; S797-A800 PolarHBondContact O-N 3Å; Y798-A800 PolarHBondContact O-N 3.24Å; A800-T804 WeakPolarHBondContact O-CB 3.37Å; A800-T804 PolarHBondContact O-N 3.07Å; A800-T804 PolarHBondContact O-OG1 3.01Å
801	F	92	Very high	87.3	Confident	1 Å²	1	29.8 Å²	29.8	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-63.4	-51.5	172.6	169.9	-113.9	0	0	0	112.3	I743 I746 N747 F765 L768 L769 S797 Y798 F799 Q803 T804 V805	I743-F801 HydrophobicContact CG2-CB 3.87Å; I746-F801 HydrophobicContact CG2-CD2 3.93Å; I746-F801 HydrophobicContact CG2-CE2 3.47Å; I746-F801 VanDerWaalsContact CG2-CE2 3.47Å; I746-F801 HydrophobicContact CG2-CZ 4.42Å; N747-F801 VanDerWaalsContact OD1-CA 3.24Å; N747-F801 WeakPolarHBondContact OD1-CA 3.45Å; N747-F801 WeakPolarHBondContact OD1-CD2 3.49Å; F765-F801 AromaticContact CD2-CE1 3.79Å; F765-F801 HydrophobicContact CD2-CE1 3.79Å; F765-F801 AromaticContact CD2-CZ 3.83Å; F765-F801 HydrophobicContact CD2-CZ 3.83Å; F765-F801 AromaticContact CE2-CE1 3.66Å; F765-F801 HydrophobicContact CE2-CE1 3.66Å; F765-F801 HydrophobicContact CE2-CZ 4.06Å; L768-F801 HydrophobicContact CD2-CD1 4.36Å; L768-F801 HydrophobicContact CD2-CE1 4Å; L768-F801 HydrophobicContact CD2-CE2 4.42Å; L768-F801 HydrophobicContact CD2-CZ 4.04Å; L769-F801 HydrophobicContact CD1-CD1 4.45Å; L769-F801 HydrophobicContact CD1-CE1 3.93Å; S797-F801 PolarHBondContact O-N 3.37Å; Y798-F801 WeakPolarHBondContact O-CB 3.39Å; Y798-F801 PolarHBondContact O-N 3.4Å; F799-F801 VanDerWaalsContact C-N 3.26Å; F799-F801 PolarHBondContact O-N 3.29Å; F801-Q803 VanDerWaalsContact C-N 3.28Å; F801-Q803 PolarHBondContact O-N 3.31Å; F801-T804 WeakPolarHBondContact O-CB 3.29Å; F801-T804 PolarHBondContact O-N 2.81Å; F801-V805 HydrophobicContact CD2-CG2 4.03Å; F801-V805 HydrophobicContact CE1-CG2 4.36Å; F801-V805 HydrophobicContact CE2-CG2 3.57Å; F801-V805 HydrophobicContact CZ-CG2 3.77Å; F801-V805 WeakPolarHBondContact O-CG2 3.49Å; F801-V805 PolarHBondContact O-N 3.43Å
802	L	92.1	Very high	87.4	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-39.1	176.5	-67.1	-175.7	0	0	0	112.5	F765 Y798 F799 T804 V805 T806 I814 V825 V829 I848	F765-L802 HydrophobicContact CE2-CD2 4.01Å; F765-L802 HydrophobicContact CZ-CD2 3.87Å; Y798-L802 HydrophobicContact CD2-CG 4.49Å; Y798-L802 HydrophobicContact CE1-CD1 3.94Å; Y798-L802 HydrophobicContact CE2-CD1 3.89Å; Y798-L802 HydrophobicContact CE2-CD2 4.3Å; Y798-L802 HydrophobicContact CE2-CG 4.01Å; Y798-L802 PolarHBondContact O-N 2.93Å; Y798-L802 VanDerWaalsContact O-N 3.08Å; F799-L802 PolarHBondContact O-N 3.34Å; L802-T804 VanDerWaalsContact C-N 3.33Å; L802-T804 PolarHBondContact O-N 3.04Å; L802-V805 PolarHBondContact O-N 3.36Å; L802-T806 WeakPolarHBondContact O-CB 3.26Å; L802-T806 WeakPolarHBondContact O-CG2 3.35Å; L802-T806 PolarHBondContact O-N 3.45Å; L802-T806 PolarHBondContact O-OG1 2.98Å; L802-I814 HydrophobicContact CD2-CD1 4.45Å; L802-V825 HydrophobicContact CD1-CG1 3.91Å; L802-V825 HydrophobicContact CD2-CG1 4.1Å; L802-V829 HydrophobicContact CD1-CG2 3.7Å; L802-I848 HydrophobicContact CB-CD1 3.86Å
803	Q	91.9	Very high	87.5	Confident	61 Å²	61	31.3 Å²	31.3	29%	0.285	18%	0.183	S	C	.	.	H	α-helix	trans	-61.7	-41.7	174.2	-171.7	-171.7	9.1	0	0	111.4	F799 F801 T806 G807 T844 I847 I848	F799-Q803 WeakPolarHBondContact O-CB 3.4Å; F799-Q803 PolarHBondContact O-N 3.44Å; F801-Q803 VanDerWaalsContact C-N 3.28Å; F801-Q803 PolarHBondContact O-N 3.31Å; Q803-T806 WeakPolarHBondContact CA-OG1 3.23Å; Q803-T806 PolarHBondContact O-OG1 3.45Å; Q803-T806 VanDerWaalsContact O-OG1 3.14Å; Q803-G807 WeakPolarHBondContact O-CA 3.29Å; Q803-G807 PolarHBondContact O-N 2.86Å; Q803-T844 HydrophobicContact CB-CG2 4.05Å; Q803-T844 HydrophobicContact CG-CG2 4.48Å; Q803-I847 HydrophobicContact CG-CG2 4.19Å; Q803-I848 HydrophobicContact CB-CD1 4.22Å; Q803-I848 HydrophobicContact CB-CG1 3.82Å; Q803-I848 HydrophobicContact CG-CG1 4.37Å
804	T	90.3	Very high	87.5	Confident	31 Å²	31	28.1 Å²	28.1	19%	0.19	17%	0.168	C	C	.	.	H	α-helix	trans	-66.6	-42.4	178.8	-56.7	0	0	0	0	111.4	N747 T750 A751 A800 F801 L802 S808	N747-T804 HydrophobicContact CB-CG2 4.21Å; T750-T804 HydrophobicContact CG2-CG2 3.84Å; A751-T804 HydrophobicContact CB-CG2 4.23Å; A800-T804 WeakPolarHBondContact O-CB 3.37Å; A800-T804 PolarHBondContact O-N 3.07Å; A800-T804 PolarHBondContact O-OG1 3.01Å; F801-T804 WeakPolarHBondContact O-CB 3.29Å; F801-T804 PolarHBondContact O-N 2.81Å; L802-T804 VanDerWaalsContact C-N 3.33Å; L802-T804 PolarHBondContact O-N 3.04Å; T804-S808 WeakPolarHBondContact O-CB 3.48Å; T804-S808 PolarHBondContact O-N 3.22Å; T804-S808 PolarHBondContact O-OG 3.39Å
805	V	89.4	Confident	87.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-47.4	177	173.7	0	0	0	0	111.1	T750 F801 L802 M810 V813 I814	T750-V805 HydrophobicContact CG2-CG2 4.19Å; F801-V805 HydrophobicContact CD2-CG2 4.03Å; F801-V805 HydrophobicContact CE1-CG2 4.36Å; F801-V805 HydrophobicContact CE2-CG2 3.57Å; F801-V805 HydrophobicContact CZ-CG2 3.77Å; F801-V805 WeakPolarHBondContact O-CG2 3.49Å; F801-V805 PolarHBondContact O-N 3.43Å; L802-V805 PolarHBondContact O-N 3.36Å; V805-M810 HydrophobicContact CG1-CB 4.23Å; V805-M810 WeakPolarHBondContact CG1-O 3.38Å; V805-M810 CarbonylContact O-C 3.57Å; V805-M810 PolarHBondContact O-N 2.9Å; V805-M810 VanDerWaalsContact O-N 3.14Å; V805-V813 HydrophobicContact CG1-CB 4.3Å; V805-I814 HydrophobicContact CG1-CD1 4.16Å; V805-I814 HydrophobicContact CG1-CG1 4.04Å
806	T	87.9	Confident	87.3	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-71	-37.9	179.9	53.1	0	0	0	0	112.9	L802 Q803 I814 I848 L852	L802-T806 WeakPolarHBondContact O-CB 3.26Å; L802-T806 WeakPolarHBondContact O-CG2 3.35Å; L802-T806 PolarHBondContact O-N 3.45Å; L802-T806 PolarHBondContact O-OG1 2.98Å; Q803-T806 WeakPolarHBondContact CA-OG1 3.23Å; Q803-T806 PolarHBondContact O-OG1 3.45Å; Q803-T806 VanDerWaalsContact O-OG1 3.14Å; T806-I814 HydrophobicContact CG2-CD1 3.79Å; T806-I848 HydrophobicContact CG2-CG2 4.43Å; T806-L852 HydrophobicContact CG2-CD2 3.57Å; T806-L852 HydrophobicContact CG2-CG 4.05Å
807	G	85	Confident	87.1	Confident	54 Å²	54	28.3 Å²	28.3	56%	0.557	18%	0.184	S	C	*	.	H	α-helix	trans	-73	-28.8	178.9	0	0	0	0	0	114.3	Q803 G809	Q803-G807 WeakPolarHBondContact O-CA 3.29Å; Q803-G807 PolarHBondContact O-N 2.86Å; G807-G809 VanDerWaalsContact C-N 3.28Å; G807-G809 PolarHBondContact O-N 2.73Å
808	S	83.7	Confident	86.8	Confident	28 Å²	28	29.2 Å²	29.2	20%	0.196	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	7.8	-178.5	-56.3	0	0	0	0	114.1	T804 M810	T804-S808 WeakPolarHBondContact O-CB 3.48Å; T804-S808 PolarHBondContact O-N 3.22Å; T804-S808 PolarHBondContact O-OG 3.39Å; S808-M810 VanDerWaalsContact CB-CE 3.42Å
809	G	77.2	Confident	86.3	Confident	50 Å²	50	33.1 Å²	33.1	52%	0.515	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	21.2	-179.5	0	0	0	0	0	114.3	G807	G807-G809 VanDerWaalsContact C-N 3.28Å; G807-G809 PolarHBondContact O-N 2.73Å
810	M	81.9	Confident	85.9	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.015	27%	0.265	C	S	.	.			trans	-106.9	31.9	179.3	-74.2	177.5	-77.2	0	0	112.2	T750 K754 V757 L761 V805 S808 E812 V813	T750-M810 HydrophobicContact CG2-CE 3.1Å; T750-M810 HydrophobicContact CG2-SD 4.29Å; T750-M810 VanDerWaalsContact O-CE 3.31Å; T750-M810 WeakPolarHBondContact O-CE 3.35Å; K754-M810 VanDerWaalsContact C-SD 3.56Å; V757-M810 HydrophobicContact CG2-SD 4.41Å; L761-M810 HydrophobicContact CD1-CE 4.29Å; L761-M810 HydrophobicContact CD1-SD 3.69Å; V805-M810 HydrophobicContact CG1-CB 4.23Å; V805-M810 WeakPolarHBondContact CG1-O 3.38Å; V805-M810 CarbonylContact O-C 3.57Å; V805-M810 PolarHBondContact O-N 2.9Å; V805-M810 VanDerWaalsContact O-N 3.14Å; S808-M810 VanDerWaalsContact CB-CE 3.42Å; M810-E812 PolarHBondContact O-N 3.24Å; M810-E812 VanDerWaalsContact O-N 3.12Å; M810-V813 HydrophobicContact CB-CG2 4Å; M810-V813 VanDerWaalsContact O-CB 3.28Å; M810-V813 WeakPolarHBondContact O-CB 3.41Å; M810-V813 PolarHBondContact O-N 3.23Å
811	S	81.7	Confident	85.6	Confident	16 Å²	16	41.4 Å²	41.4	11%	0.112	27%	0.265	C	S	.	.	H	α-helix	trans	-57.4	-26.2	175.4	50.5	0	0	0	0	112.9	V813 I814 A815 W856	S811-V813 PolarHBondContact O-N 3.05Å; S811-I814 PolarHBondContact O-N 3.12Å; S811-I814 VanDerWaalsContact O-N 3.08Å; S811-A815 PolarHBondContact O-N 3.19Å; S811-W856 WeakPolarHBondContact O-CZ2 3.41Å
812	E	82.3	Confident	85.4	Confident	125 Å²	125	42.1 Å²	42.1	58%	0.584	27%	0.269	S	S	*	.	H	α-helix	trans	-59.8	-30.1	174.2	-65.4	-177.2	178.8	0	0	113	M810 I814 A815 N816	M810-E812 PolarHBondContact O-N 3.24Å; M810-E812 VanDerWaalsContact O-N 3.12Å; E812-I814 PolarHBondContact O-N 3.41Å; E812-A815 PolarHBondContact O-N 3.13Å; E812-N816 VanDerWaalsContact O-CB 3.3Å; E812-N816 WeakPolarHBondContact O-CB 3.47Å; E812-N816 PolarHBondContact O-N 2.65Å; E812-N816 PolarHBondContact O-ND2 3.24Å
813	V	86.3	Confident	85.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-37.7	175	173.6	0	0	0	0	110.7	L761 F765 V805 M810 S811 Q817	L761-V813 HydrophobicContact CB-CG1 4.13Å; L761-V813 HydrophobicContact CB-CG2 4.21Å; F765-V813 HydrophobicContact CB-CG1 4.1Å; F765-V813 HydrophobicContact CD2-CG1 3.86Å; F765-V813 HydrophobicContact CG-CG1 4.11Å; V805-V813 HydrophobicContact CG1-CB 4.3Å; M810-V813 HydrophobicContact CB-CG2 4Å; M810-V813 VanDerWaalsContact O-CB 3.28Å; M810-V813 WeakPolarHBondContact O-CB 3.41Å; M810-V813 PolarHBondContact O-N 3.23Å; S811-V813 PolarHBondContact O-N 3.05Å; V813-Q817 WeakPolarHBondContact O-CG 3.33Å; V813-Q817 PolarHBondContact O-NE2 3.36Å
814	I	86.1	Confident	84.9	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-76.2	-49.6	176	-54.5	178.6	0	0	0	109.3	F765 L802 V805 T806 S811 E812 N816 Q817 V822 W856	F765-I814 HydrophobicContact CE2-CG1 4.05Å; F765-I814 HydrophobicContact CZ-CG1 3.82Å; L802-I814 HydrophobicContact CD2-CD1 4.45Å; V805-I814 HydrophobicContact CG1-CD1 4.16Å; V805-I814 HydrophobicContact CG1-CG1 4.04Å; T806-I814 HydrophobicContact CG2-CD1 3.79Å; S811-I814 PolarHBondContact O-N 3.12Å; S811-I814 VanDerWaalsContact O-N 3.08Å; E812-I814 PolarHBondContact O-N 3.41Å; I814-N816 PolarHBondContact O-N 3.21Å; I814-N816 VanDerWaalsContact O-N 3.16Å; I814-Q817 WeakPolarHBondContact O-CG 3.28Å; I814-Q817 PolarHBondContact O-N 3.22Å; I814-V822 HydrophobicContact CG2-CG2 4.45Å; I814-V822 WeakPolarHBondContact O-CG2 3.31Å; I814-W856 HydrophobicContact CB-CH2 4.07Å; I814-W856 HydrophobicContact CB-CZ2 4.49Å; I814-W856 HydrophobicContact CG2-CH2 3.88Å
815	A	85.1	Confident	84.8	Confident	36 Å²	36	48.6 Å²	48.6	30%	0.298	29%	0.293	S	S	.	.	H	α-helix	trans	-58.7	-31.6	-176.1	0	0	0	0	0	113.7	S811 E812 Q817 W856	S811-A815 PolarHBondContact O-N 3.19Å; E812-A815 PolarHBondContact O-N 3.13Å; A815-Q817 VanDerWaalsContact C-N 3.33Å; A815-Q817 PolarHBondContact O-N 3.47Å; A815-W856 HydrophobicContact CB-CZ2 3.98Å
816	N	85.6	Confident	84.9	Confident	88 Å²	88	49 Å²	49	47%	0.471	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	11.4	-175.9	-64.7	-24.6	0	0	0	114.7	E812 I814	E812-N816 VanDerWaalsContact O-CB 3.3Å; E812-N816 WeakPolarHBondContact O-CB 3.47Å; E812-N816 PolarHBondContact O-N 2.65Å; E812-N816 PolarHBondContact O-ND2 3.24Å; I814-N816 PolarHBondContact O-N 3.21Å; I814-N816 VanDerWaalsContact O-N 3.16Å
817	Q	85.3	Confident	85	Confident	31 Å²	31	51.4 Å²	51.4	15%	0.145	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	0.1	-179.6	-58.7	-60.8	-34.5	0	0	114.5	Q762 F765 M766 V813 I814 A815 N821	Q762-Q817 PolarHBondContact O-NE2 3.4Å; F765-Q817 HydrophobicContact CD1-CG 3.66Å; F765-Q817 HydrophobicContact CE1-CG 4.11Å; F765-Q817 HydrophobicContact CG-CG 4.49Å; M766-Q817 HydrophobicContact CG-CB 4.34Å; M766-Q817 HydrophobicContact CG-CG 4.33Å; V813-Q817 WeakPolarHBondContact O-CG 3.33Å; V813-Q817 PolarHBondContact O-NE2 3.36Å; I814-Q817 WeakPolarHBondContact O-CG 3.28Å; I814-Q817 PolarHBondContact O-N 3.22Å; A815-Q817 VanDerWaalsContact C-N 3.33Å; A815-Q817 PolarHBondContact O-N 3.47Å; Q817-N821 HydrophobicContact CB-CB 4.06Å; Q817-N821 PolarHBondContact O-ND2 3.18Å
818	G	82.6	Confident	85.4	Confident	40 Å²	40	49.8 Å²	49.8	41%	0.412	29%	0.289	S	S	.	.			trans	89.1	149.9	-172.5	0	0	0	0	0	112.7	E820 N821 V822	G818-E820 PolarHBondContact O-N 3.13Å; G818-N821 PolarHBondContact O-N 2.92Å; G818-V822 WeakPolarHBondContact O-CG2 3.48Å; G818-V822 PolarHBondContact O-N 3.38Å; G818-V822 VanDerWaalsContact O-N 3.09Å
819	A	81.6	Confident	85.8	Confident	87 Å²	87	48.5 Å²	48.5	72%	0.719	28%	0.28	S	S	*	.	H	α-helix	trans	-58.9	-41.6	-169.2	0	0	0	0	0	113.8	V822 E823	A819-V822 PolarHBondContact O-N 3.19Å; A819-E823 WeakPolarHBondContact O-CB 3.35Å; A819-E823 PolarHBondContact O-N 3.3Å
820	E	83.9	Confident	86.6	Confident	164 Å²	164	47.2 Å²	47.2	77%	0.766	26%	0.261	S	S	*	.	H	α-helix	trans	-64.9	-43	-179.6	-173.2	-178.9	176.7	0	0	112.4	G818 E823 R824	G818-E820 PolarHBondContact O-N 3.13Å; E820-E823 PolarHBondContact O-N 3.24Å; E820-R824 WeakPolarHBondContact O-CB 3.21Å; E820-R824 PolarHBondContact O-N 3.15Å
821	N	86.3	Confident	87	Confident	48 Å²	48	50 Å²	50	26%	0.257	27%	0.274	S	S	.	.	H	α-helix	trans	-69.3	-37.9	178.5	-70.3	-37.1	0	0	0	111.8	M766 Q817 G818 R824 V825	M766-N821 HydrophobicContact CE-CB 4.07Å; M766-N821 VanDerWaalsContact CE-CG 3.49Å; M766-N821 VanDerWaalsContact CE-OD1 3.26Å; M766-N821 WeakPolarHBondContact CE-OD1 3.49Å; M766-N821 HydrophobicContact SD-CB 3.83Å; Q817-N821 HydrophobicContact CB-CB 4.06Å; Q817-N821 PolarHBondContact O-ND2 3.18Å; G818-N821 PolarHBondContact O-N 2.92Å; N821-R824 PolarHBondContact O-N 3.31Å; N821-V825 WeakPolarHBondContact O-CG2 3.49Å; N821-V825 PolarHBondContact O-N 3.04Å
822	V	86.3	Confident	87.3	Confident	16 Å²	16	49.2 Å²	49.2	10%	0.097	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-48.6	174.4	173.2	0	0	0	0	110.4	I814 G818 A819 R824 V825 L826 W856	I814-V822 HydrophobicContact CG2-CG2 4.45Å; I814-V822 WeakPolarHBondContact O-CG2 3.31Å; G818-V822 WeakPolarHBondContact O-CG2 3.48Å; G818-V822 PolarHBondContact O-N 3.38Å; G818-V822 VanDerWaalsContact O-N 3.09Å; A819-V822 PolarHBondContact O-N 3.19Å; V822-R824 VanDerWaalsContact C-N 3.35Å; V822-R824 PolarHBondContact O-N 2.96Å; V822-V825 PolarHBondContact O-N 3.01Å; V822-L826 HydrophobicContact CG1-CD1 3.98Å; V822-L826 HydrophobicContact CG1-CG 4.33Å; V822-L826 VanDerWaalsContact O-CG 3.31Å; V822-L826 WeakPolarHBondContact O-CG 3.45Å; V822-L826 PolarHBondContact O-N 3.13Å; V822-W856 HydrophobicContact CG1-CZ3 4.47Å
823	E	86.4	Confident	87.7	Confident	114 Å²	114	43.3 Å²	43.3	53%	0.533	24%	0.241	S	C	.	.	H	α-helix	trans	-59.5	-45.5	178.2	-173.7	173.5	-174.2	0	0	111.4	A819 E820 V825 L826 V827	A819-E823 WeakPolarHBondContact O-CB 3.35Å; A819-E823 PolarHBondContact O-N 3.3Å; E820-E823 PolarHBondContact O-N 3.24Å; E823-V825 VanDerWaalsContact C-N 3.34Å; E823-V825 PolarHBondContact O-N 3.02Å; E823-L826 PolarHBondContact O-N 3.43Å; E823-V827 WeakPolarHBondContact O-CG2 3.43Å; E823-V827 PolarHBondContact O-N 3.42Å
824	R	87.7	Confident	87.8	Confident	109 Å²	109	43.9 Å²	43.9	41%	0.411	25%	0.245	S	C	.	.	H	α-helix	trans	-55.4	-47.3	175.6	-173.9	177.3	179.4	179.4	1.6	112	E820 N821 V822 V827 T828	E820-R824 WeakPolarHBondContact O-CB 3.21Å; E820-R824 PolarHBondContact O-N 3.15Å; N821-R824 PolarHBondContact O-N 3.31Å; V822-R824 VanDerWaalsContact C-N 3.35Å; V822-R824 PolarHBondContact O-N 2.96Å; R824-V827 PolarHBondContact O-N 3Å; R824-T828 VanDerWaalsContact O-CG2 3.31Å; R824-T828 WeakPolarHBondContact O-CG2 3.36Å; R824-T828 PolarHBondContact O-N 3.33Å; R824-T828 VanDerWaalsContact O-N 3.12Å
825	V	89.5	Confident	87.7	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.03	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-47.1	177.7	172.4	0	0	0	0	111.1	F765 L769 L802 N821 V822 E823 V827 T828 V829	F765-V825 HydrophobicContact CE1-CG2 4.24Å; L769-V825 HydrophobicContact CD2-CG2 3.4Å; L802-V825 HydrophobicContact CD1-CG1 3.91Å; L802-V825 HydrophobicContact CD2-CG1 4.1Å; N821-V825 WeakPolarHBondContact O-CG2 3.49Å; N821-V825 PolarHBondContact O-N 3.04Å; V822-V825 PolarHBondContact O-N 3.01Å; E823-V825 VanDerWaalsContact C-N 3.34Å; E823-V825 PolarHBondContact O-N 3.02Å; V825-V827 VanDerWaalsContact C-N 3.32Å; V825-V827 PolarHBondContact O-N 3.29Å; V825-T828 PolarHBondContact O-N 3.37Å; V825-T828 VanDerWaalsContact O-N 3.13Å; V825-T828 PolarHBondContact O-OG1 3.05Å; V825-V829 PolarHBondContact O-N 3.01Å
826	L	90.4	Very high	87.6	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-41.6	179.4	-68.3	176.2	0	0	0	112.1	V822 E823 T828 V829 I830 L852 W856 F865 F868	V822-L826 HydrophobicContact CG1-CD1 3.98Å; V822-L826 HydrophobicContact CG1-CG 4.33Å; V822-L826 VanDerWaalsContact O-CG 3.31Å; V822-L826 WeakPolarHBondContact O-CG 3.45Å; V822-L826 PolarHBondContact O-N 3.13Å; E823-L826 PolarHBondContact O-N 3.43Å; L826-T828 VanDerWaalsContact C-N 3.34Å; L826-T828 PolarHBondContact O-N 3.39Å; L826-V829 PolarHBondContact O-N 3.2Å; L826-I830 WeakPolarHBondContact O-CG1 3.38Å; L826-I830 PolarHBondContact O-N 2.99Å; L826-L852 HydrophobicContact CD2-CD1 3.56Å; L826-W856 HydrophobicContact CD2-CZ3 4.35Å; L826-F865 HydrophobicContact CD1-CD2 3.94Å; L826-F865 HydrophobicContact CD1-CE2 3.99Å; L826-F865 HydrophobicContact CD2-CE2 4.19Å; L826-F868 HydrophobicContact CB-CD1 4.47Å; L826-F868 HydrophobicContact CB-CE1 3.74Å; L826-F868 HydrophobicContact CB-CE2 3.92Å; L826-F868 HydrophobicContact CB-CZ 3.43Å; L826-F868 VanDerWaalsContact CB-CZ 3.43Å; L826-F868 HydrophobicContact CD1-CD1 4.17Å; L826-F868 HydrophobicContact CD1-CE1 4.24Å; L826-F868 HydrophobicContact CD1-CG 4.34Å; L826-F868 HydrophobicContact CD1-CZ 4.46Å; L826-F868 HydrophobicContact CG-CE1 4.42Å
827	V	90.7	Very high	87.3	Confident	52 Å²	52	50 Å²	50	32%	0.315	27%	0.269	S	S	.	.	H	α-helix	trans	-61.4	-42.1	175.4	171.7	0	0	0	0	111.2	E823 R824 V825 V829 I830 Q831 F868	E823-V827 WeakPolarHBondContact O-CG2 3.43Å; E823-V827 PolarHBondContact O-N 3.42Å; R824-V827 PolarHBondContact O-N 3Å; V825-V827 VanDerWaalsContact C-N 3.32Å; V825-V827 PolarHBondContact O-N 3.29Å; V827-V829 VanDerWaalsContact C-N 3.26Å; V827-V829 PolarHBondContact O-N 3.13Å; V827-I830 WeakPolarHBondContact O-CB 3.34Å; V827-I830 PolarHBondContact O-N 2.6Å; V827-I830 VanDerWaalsContact O-N 3.1Å; V827-Q831 HydrophobicContact CG1-CG 4.44Å; V827-Q831 WeakPolarHBondContact O-CG 3.29Å; V827-Q831 PolarHBondContact O-N 3.08Å; V827-F868 HydrophobicContact CG2-CE2 4.18Å
828	T	92.1	Very high	87.4	Confident	20 Å²	20	49 Å²	49	12%	0.123	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-33.5	177.2	67.8	0	0	0	0	113.2	F773 Y798 R824 V825 L826 Q831 G832	F773-T828 HydrophobicContact CE1-CG2 3.91Å; F773-T828 HydrophobicContact CZ-CG2 3.76Å; Y798-T828 PolarHBondContact OH-OG1 3.26Å; R824-T828 VanDerWaalsContact O-CG2 3.31Å; R824-T828 WeakPolarHBondContact O-CG2 3.36Å; R824-T828 PolarHBondContact O-N 3.33Å; R824-T828 VanDerWaalsContact O-N 3.12Å; V825-T828 PolarHBondContact O-N 3.37Å; V825-T828 VanDerWaalsContact O-N 3.13Å; V825-T828 PolarHBondContact O-OG1 3.05Å; L826-T828 VanDerWaalsContact C-N 3.34Å; L826-T828 PolarHBondContact O-N 3.39Å; T828-Q831 PolarHBondContact O-N 3.41Å; T828-G832 PolarHBondContact O-N 2.73Å
829	V	93	Very high	87.6	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-69.4	-36.7	175.9	-179	0	0	0	0	110.9	F799 L802 V825 L826 V827 G832 A833 C845 I848 L849	F799-V829 HydrophobicContact CE1-CG2 4.46Å; L802-V829 HydrophobicContact CD1-CG2 3.7Å; V825-V829 PolarHBondContact O-N 3.01Å; L826-V829 PolarHBondContact O-N 3.2Å; V827-V829 VanDerWaalsContact C-N 3.26Å; V827-V829 PolarHBondContact O-N 3.13Å; V829-G832 PolarHBondContact O-N 2.81Å; V829-A833 PolarHBondContact O-N 2.69Å; V829-C845 HydrophobicContact CG1-CB 3.86Å; V829-I848 HydrophobicContact CG1-CB 4.24Å; V829-I848 HydrophobicContact CG1-CG2 4.16Å; V829-I848 HydrophobicContact CG2-CG2 4.34Å; V829-L849 HydrophobicContact CB-CD2 4.37Å; V829-L849 HydrophobicContact CG1-CD1 4.32Å; V829-L849 HydrophobicContact CG1-CD2 3.75Å; V829-L849 HydrophobicContact CG1-CG 3.74Å
830	I	93.1	Very high	88	Confident	22 Å²	22	47.8 Å²	47.8	11%	0.113	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-45.3	174	-62.9	-66.3	0	0	0	111.1	L826 V827 G832 A833 V834 L849 F868 H872 I873 A876	L826-I830 WeakPolarHBondContact O-CG1 3.38Å; L826-I830 PolarHBondContact O-N 2.99Å; V827-I830 WeakPolarHBondContact O-CB 3.34Å; V827-I830 PolarHBondContact O-N 2.6Å; V827-I830 VanDerWaalsContact O-N 3.1Å; I830-G832 VanDerWaalsContact C-N 3.29Å; I830-G832 PolarHBondContact O-N 3.32Å; I830-A833 PolarHBondContact O-N 3.45Å; I830-A833 VanDerWaalsContact O-N 3.13Å; I830-V834 WeakPolarHBondContact O-CG2 3.39Å; I830-V834 PolarHBondContact O-N 2.98Å; I830-L849 HydrophobicContact CD1-CD1 3.9Å; I830-L849 HydrophobicContact CD1-CD2 4.01Å; I830-F868 HydrophobicContact CD1-CE1 4.41Å; I830-F868 HydrophobicContact CG1-CE1 4.18Å; I830-F868 HydrophobicContact CG1-CZ 3.88Å; I830-H872 HydrophobicContact CD1-CB 4.2Å; I830-H872 HydrophobicContact CG1-CB 4.13Å; I830-I873 HydrophobicContact CD1-CG1 4.11Å; I830-A876 HydrophobicContact CD1-CB 4.02Å; I830-A876 HydrophobicContact CG2-CB 4.28Å
831	Q	90.6	Very high	88.4	Confident	62 Å²	62	40.1 Å²	40.1	29%	0.29	20%	0.202	S	C	.	.	H	α-helix	trans	-60.5	-41.4	174.4	-66.2	-178.8	-39	0	0	111.2	V827 T828 A833 V834 E835 Y836	V827-Q831 HydrophobicContact CG1-CG 4.44Å; V827-Q831 WeakPolarHBondContact O-CG 3.29Å; V827-Q831 PolarHBondContact O-N 3.08Å; T828-Q831 PolarHBondContact O-N 3.41Å; Q831-A833 VanDerWaalsContact C-N 3.32Å; Q831-A833 PolarHBondContact O-N 3.47Å; Q831-V834 PolarHBondContact O-N 3.33Å; Q831-E835 HydrophobicContact CB-CB 4.45Å; Q831-E835 HydrophobicContact CB-CG 4.43Å; Q831-E835 WeakPolarHBondContact CG-OE2 3.45Å; Q831-E835 PolarHBondContact NE2-OE2 3.28Å; Q831-E835 WeakPolarHBondContact O-CA 3.02Å; Q831-E835 WeakPolarHBondContact O-CB 3.08Å; Q831-E835 PolarHBondContact O-N 3.36Å; Q831-Y836 HydrophobicContact CB-CE2 4Å; Q831-Y836 WeakPolarHBondContact O-CD2 3.4Å; Q831-Y836 PolarHBondContact O-N 2.85Å
832	G	89.2	Confident	88.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-55	-42.1	171.4	0	0	0	0	0	114.2	F799 T828 V829 I830 Q842	F799-G832 VanDerWaalsContact CZ-CA 3.5Å; T828-G832 PolarHBondContact O-N 2.73Å; V829-G832 PolarHBondContact O-N 2.81Å; I830-G832 VanDerWaalsContact C-N 3.29Å; I830-G832 PolarHBondContact O-N 3.32Å; G832-Q842 WeakPolarHBondContact O-CG 3.26Å
833	A	90.6	Very high	89	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-75.5	-31.8	179.9	0	0	0	0	0	113.7	V829 I830 Q831 Q842 C845 F846 L849 A880	V829-A833 PolarHBondContact O-N 2.69Å; I830-A833 PolarHBondContact O-N 3.45Å; I830-A833 VanDerWaalsContact O-N 3.13Å; Q831-A833 VanDerWaalsContact C-N 3.32Å; Q831-A833 PolarHBondContact O-N 3.47Å; A833-Q842 WeakPolarHBondContact O-CG 3.42Å; A833-C845 HydrophobicContact CB-CB 3.81Å; A833-F846 HydrophobicContact CB-CE1 4.36Å; A833-F846 HydrophobicContact CB-CE2 4.2Å; A833-F846 HydrophobicContact CB-CZ 4.07Å; A833-L849 HydrophobicContact CB-CD1 4.48Å; A833-A880 WeakPolarHBondContact O-CB 3.44Å
834	V	88.3	Confident	89.4	Confident	14 Å²	14	35.8 Å²	35.8	9%	0.085	18%	0.18	C	C	.	.	H	α-helix	trans	-114.5	-48.8	-168.7	-176.3	0	0	0	0	113.2	I830 Q831 A876 L879 A880 K883	I830-V834 WeakPolarHBondContact O-CG2 3.39Å; I830-V834 PolarHBondContact O-N 2.98Å; Q831-V834 PolarHBondContact O-N 3.33Å; V834-A876 HydrophobicContact CG2-CB 3.51Å; V834-L879 HydrophobicContact CG1-CB 3.78Å; V834-A880 HydrophobicContact CG2-CB 4.19Å; V834-K883 VanDerWaalsContact O-CD 3.26Å; V834-K883 WeakPolarHBondContact O-CD 3.35Å; V834-K883 WeakPolarHBondContact O-CE 3.49Å; V834-K883 PolarHBondContact O-NZ 3.47Å
835	E	84.5	Confident	89.7	Confident	103 Å²	103	30.6 Å²	30.6	48%	0.481	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-43.6	-167.1	-69	-178.3	178.7	0	0	113.2	Q831 K883	Q831-E835 HydrophobicContact CB-CB 4.45Å; Q831-E835 HydrophobicContact CB-CG 4.43Å; Q831-E835 WeakPolarHBondContact CG-OE2 3.45Å; Q831-E835 PolarHBondContact NE2-OE2 3.28Å; Q831-E835 WeakPolarHBondContact O-CA 3.02Å; Q831-E835 WeakPolarHBondContact O-CB 3.08Å; Q831-E835 PolarHBondContact O-N 3.36Å; E835-K883 VanDerWaalsContact CA-NZ 3.34Å; E835-K883 PolarHBondContact O-NZ 3.42Å
836	Y	82.1	Confident	90	Very high	69 Å²	69	30.4 Å²	30.4	27%	0.271	16%	0.159	S	C	.	.	S	Bend	trans	-91.2	131.2	-172.6	-55.5	-70.7	0	0	0	112.5	R795 Q831 D838 Q842	R795-Y836 VanDerWaalsContact CZ-CE1 3.44Å; R795-Y836 VanDerWaalsContact NH1-CD1 3.34Å; R795-Y836 VanDerWaalsContact NH1-CE1 3.32Å; Q831-Y836 HydrophobicContact CB-CE2 4Å; Q831-Y836 WeakPolarHBondContact O-CD2 3.4Å; Q831-Y836 PolarHBondContact O-N 2.85Å; Y836-D838 PolarHBondContact O-N 3.22Å; Y836-Q842 PolarHBondContact O-NE2 3.22Å
837	P	79.1	Confident	90.2	Very high	85 Å²	85	32.1 Å²	32.1	55%	0.552	17%	0.168	S	C	*	.			trans	-80.9	61.8	-179.1	35.3	-36.8	0	0	0	111.5	T885	P837-T885 HydrophobicContact CB-CG2 4.03Å
838	D	87.4	Confident	90.4	Very high	8 Å²	8	29.7 Å²	29.7	4%	0.043	15%	0.153	C	C	.	.			trans	-128.9	98.1	178.7	-177	-10.7	0	0	0	110.7	Q792 R796 Y836 I840 A841 Q842	Q792-D838 WeakPolarHBondContact CG-OD2 3.41Å; Q792-D838 PolarHBondContact NE2-OD2 3.5Å; R796-D838 IonicContact CZ-OD1 3.68Å; R796-D838 IonicContact CZ-OD2 2.82Å; R796-D838 IonicContact NE-OD1 3.9Å; R796-D838 PolarHBondContact NE-OD1 3.35Å; R796-D838 IonicContact NE-OD2 2.68Å; R796-D838 PolarHBondContact NE-OD2 3.22Å; R796-D838 VanDerWaalsContact NH2-CG 3.29Å; R796-D838 IonicContact NH2-OD1 3.29Å; R796-D838 PolarHBondContact NH2-OD1 3.35Å; R796-D838 IonicContact NH2-OD2 3.96Å; R796-D838 PolarHBondContact NH2-OD2 3.48Å; Y836-D838 PolarHBondContact O-N 3.22Å; D838-I840 PolarHBondContact O-N 3.34Å; D838-I840 VanDerWaalsContact O-N 3.11Å; D838-I840 PolarHBondContact OD1-N 3.21Å; D838-I840 VanDerWaalsContact OD1-N 3.15Å; D838-A841 HydrophobicContact CB-CB 3.93Å; D838-A841 PolarHBondContact O-N 3.1Å; D838-A841 VanDerWaalsContact O-N 3.09Å; D838-A841 PolarHBondContact OD1-N 3.1Å; D838-Q842 VanDerWaalsContact O-CG 3.29Å; D838-Q842 WeakPolarHBondContact O-CG 3.22Å; D838-Q842 PolarHBondContact O-N 3.41Å
839	P	87.8	Confident	90.5	Very high	30 Å²	30	28.8 Å²	28.8	20%	0.195	15%	0.148	C	C	.	.	H	α-helix	trans	-56.7	-32.2	-175.1	-28.1	35.8	0	0	0	113.8	K843 Q892 T893	P839-K843 VanDerWaalsContact O-CB 3.28Å; P839-K843 WeakPolarHBondContact O-CB 3.41Å; P839-K843 PolarHBondContact O-N 2.67Å; P839-Q892 HydrophobicContact CB-CB 3.87Å; P839-T893 WeakPolarHBondContact CG-OG1 3.43Å
840	I	90	Very high	90.5	Very high	72 Å²	72	29.3 Å²	29.3	37%	0.369	15%	0.151	S	C	.	.	H	α-helix	trans	-70.3	-47.5	179.4	-58.1	-177.6	0	0	0	109.9	D838 T844	D838-I840 PolarHBondContact O-N 3.34Å; D838-I840 VanDerWaalsContact O-N 3.11Å; D838-I840 PolarHBondContact OD1-N 3.21Å; D838-I840 VanDerWaalsContact OD1-N 3.15Å; I840-T844 PolarHBondContact O-N 3.35Å; I840-T844 VanDerWaalsContact O-N 3.1Å; I840-T844 PolarHBondContact O-OG1 2.9Å
841	A	90.5	Very high	90.4	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-64.8	-42.4	177.1	0	0	0	0	0	111.6	R796 F799 D838 K843 T844 C845	R796-A841 HydrophobicContact CG-CB 4.28Å; F799-A841 HydrophobicContact CD2-CB 4.06Å; F799-A841 HydrophobicContact CE2-CB 4.35Å; D838-A841 HydrophobicContact CB-CB 3.93Å; D838-A841 PolarHBondContact O-N 3.1Å; D838-A841 VanDerWaalsContact O-N 3.09Å; D838-A841 PolarHBondContact OD1-N 3.1Å; A841-K843 PolarHBondContact O-N 3.36Å; A841-T844 PolarHBondContact O-N 3.25Å; A841-C845 PolarHBondContact O-N 3.19Å; A841-C845 PolarHBondContact O-SG 3.29Å
842	Q	92.4	Very high	90.5	Very high	5 Å²	5	28.3 Å²	28.3	2%	0.023	15%	0.145	C	C	.	.	H	α-helix	trans	-59.8	-47.4	177.9	-70.5	175.8	-14.9	0	0	111.6	G832 A833 Y836 D838 T844 C845 F846 A896	G832-Q842 WeakPolarHBondContact O-CG 3.26Å; A833-Q842 WeakPolarHBondContact O-CG 3.42Å; Y836-Q842 PolarHBondContact O-NE2 3.22Å; D838-Q842 VanDerWaalsContact O-CG 3.29Å; D838-Q842 WeakPolarHBondContact O-CG 3.22Å; D838-Q842 PolarHBondContact O-N 3.41Å; Q842-T844 PolarHBondContact O-N 3.36Å; Q842-C845 PolarHBondContact O-N 3.06Å; Q842-F846 WeakPolarHBondContact O-CD2 3.44Å; Q842-F846 PolarHBondContact O-N 2.8Å; Q842-A896 HydrophobicContact CB-CB 4.31Å
843	K	93.9	Very high	90.6	Very high	60 Å²	60	28.3 Å²	28.3	26%	0.261	15%	0.146	S	C	.	.	H	α-helix	trans	-55.6	-49.7	174.1	-178.5	-170.3	172.4	-175	0	111.2	P839 A841 C845 F846 I847 L895 A896 E899	P839-K843 VanDerWaalsContact O-CB 3.28Å; P839-K843 WeakPolarHBondContact O-CB 3.41Å; P839-K843 PolarHBondContact O-N 2.67Å; A841-K843 PolarHBondContact O-N 3.36Å; K843-C845 VanDerWaalsContact C-N 3.32Å; K843-C845 PolarHBondContact O-N 3.19Å; K843-F846 PolarHBondContact O-N 3.05Å; K843-I847 HydrophobicContact CG-CD1 4.24Å; K843-I847 WeakPolarHBondContact O-CG1 3.42Å; K843-I847 PolarHBondContact O-N 3.3Å; K843-L895 HydrophobicContact CD-CB 4.13Å; K843-A896 HydrophobicContact CB-CB 4.02Å; K843-E899 HydrophobicContact CG-CG 3.74Å
844	T	93.9	Very high	90.6	Very high	22 Å²	22	32.1 Å²	32.1	14%	0.135	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-40.6	178.3	-63.1	0	0	0	0	111.9	F799 Q803 I840 A841 Q842 I847 I848	F799-T844 HydrophobicContact CB-CG2 3.82Å; Q803-T844 HydrophobicContact CB-CG2 4.05Å; Q803-T844 HydrophobicContact CG-CG2 4.48Å; I840-T844 PolarHBondContact O-N 3.35Å; I840-T844 VanDerWaalsContact O-N 3.1Å; I840-T844 PolarHBondContact O-OG1 2.9Å; A841-T844 PolarHBondContact O-N 3.25Å; Q842-T844 PolarHBondContact O-N 3.36Å; T844-I847 PolarHBondContact O-N 3.36Å; T844-I848 HydrophobicContact CG2-CD1 4.08Å; T844-I848 VanDerWaalsContact O-CG1 3.31Å; T844-I848 WeakPolarHBondContact O-CG1 3.49Å; T844-I848 PolarHBondContact O-N 3.2Å
845	C	95.3	Very high	90.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-45.1	176.1	-67	0	0	0	0	112.1	F799 V829 A833 A841 Q842 K843 I847 I848 L849	F799-C845 VanDerWaalsContact CD1-SG 3.55Å; V829-C845 HydrophobicContact CG1-CB 3.86Å; A833-C845 HydrophobicContact CB-CB 3.81Å; A841-C845 PolarHBondContact O-N 3.19Å; A841-C845 PolarHBondContact O-SG 3.29Å; Q842-C845 PolarHBondContact O-N 3.06Å; K843-C845 VanDerWaalsContact C-N 3.32Å; K843-C845 PolarHBondContact O-N 3.19Å; C845-I847 VanDerWaalsContact C-N 3.31Å; C845-I847 PolarHBondContact O-N 2.8Å; C845-I848 WeakPolarHBondContact O-CB 3.48Å; C845-I848 PolarHBondContact O-N 2.86Å; C845-L849 VanDerWaalsContact O-CG 3.29Å; C845-L849 WeakPolarHBondContact O-CG 3.27Å; C845-L849 PolarHBondContact O-N 3.35Å
846	F	94.9	Very high	90.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-36.9	175.2	-76.3	-62.6	0	0	0	112.7	A833 Q842 K843 I848 L849 S850 A880 E899 C900 T903	A833-F846 HydrophobicContact CB-CE1 4.36Å; A833-F846 HydrophobicContact CB-CE2 4.2Å; A833-F846 HydrophobicContact CB-CZ 4.07Å; Q842-F846 WeakPolarHBondContact O-CD2 3.44Å; Q842-F846 PolarHBondContact O-N 2.8Å; K843-F846 PolarHBondContact O-N 3.05Å; F846-I848 PolarHBondContact O-N 2.9Å; F846-L849 HydrophobicContact CD1-CD1 4.37Å; F846-L849 PolarHBondContact O-N 3.28Å; F846-S850 WeakPolarHBondContact O-CB 3.27Å; F846-S850 PolarHBondContact O-N 2.96Å; F846-A880 HydrophobicContact CE2-CB 4.35Å; F846-A880 HydrophobicContact CZ-CB 4.07Å; F846-E899 HydrophobicContact CB-CB 3.77Å; F846-C900 HydrophobicContact CD1-CB 4.11Å; F846-C900 HydrophobicContact CD2-CB 4.14Å; F846-C900 HydrophobicContact CE1-CB 4.02Å; F846-C900 HydrophobicContact CE2-CB 4.05Å; F846-C900 HydrophobicContact CG-CB 4.19Å; F846-C900 HydrophobicContact CZ-CB 3.99Å; F846-T903 PolarHBondContact O-OG1 2.99Å; F846-T903 VanDerWaalsContact O-OG1 3.13Å
847	I	94.6	Very high	90.7	Very high	45 Å²	45	27.7 Å²	27.7	23%	0.231	15%	0.145	C	C	.	.	H	α-helix	trans	-61.9	-44.5	173.7	-65.3	165.6	0	0	0	111	Q803 K843 T844 C845 K851 E899	Q803-I847 HydrophobicContact CG-CG2 4.19Å; K843-I847 HydrophobicContact CG-CD1 4.24Å; K843-I847 WeakPolarHBondContact O-CG1 3.42Å; K843-I847 PolarHBondContact O-N 3.3Å; T844-I847 PolarHBondContact O-N 3.36Å; C845-I847 VanDerWaalsContact C-N 3.31Å; C845-I847 PolarHBondContact O-N 2.8Å; I847-K851 WeakPolarHBondContact O-CB 3.13Å; I847-K851 PolarHBondContact O-N 3.34Å; I847-E899 HydrophobicContact CD1-CG 4.21Å; I847-E899 HydrophobicContact CG1-CB 4.34Å; I847-E899 HydrophobicContact CG1-CG 3.82Å
848	I	94.1	Very high	90.7	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-50.4	176.4	-65	160.5	0	0	0	110.3	F799 L802 Q803 T806 V829 T844 C845 F846 S850 K851 L852	F799-I848 HydrophobicContact CB-CD1 4.23Å; F799-I848 WeakPolarHBondContact O-CD1 3.31Å; L802-I848 HydrophobicContact CB-CD1 3.86Å; Q803-I848 HydrophobicContact CB-CD1 4.22Å; Q803-I848 HydrophobicContact CB-CG1 3.82Å; Q803-I848 HydrophobicContact CG-CG1 4.37Å; T806-I848 HydrophobicContact CG2-CG2 4.43Å; V829-I848 HydrophobicContact CG1-CB 4.24Å; V829-I848 HydrophobicContact CG1-CG2 4.16Å; V829-I848 HydrophobicContact CG2-CG2 4.34Å; T844-I848 HydrophobicContact CG2-CD1 4.08Å; T844-I848 VanDerWaalsContact O-CG1 3.31Å; T844-I848 WeakPolarHBondContact O-CG1 3.49Å; T844-I848 PolarHBondContact O-N 3.2Å; C845-I848 WeakPolarHBondContact O-CB 3.48Å; C845-I848 PolarHBondContact O-N 2.86Å; F846-I848 PolarHBondContact O-N 2.9Å; I848-S850 PolarHBondContact O-N 3.26Å; I848-K851 PolarHBondContact O-N 3.34Å; I848-L852 HydrophobicContact CG2-CD1 3.78Å; I848-L852 HydrophobicContact CG2-CG 4.22Å; I848-L852 WeakPolarHBondContact O-CG 3.47Å; I848-L852 PolarHBondContact O-N 3.04Å
849	L	94.3	Very high	89.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.1	-45.5	-179.2	-66.9	172.6	0	0	0	111.5	V829 I830 A833 C845 F846 K851 L852 V853 I873 T903	V829-L849 HydrophobicContact CB-CD2 4.37Å; V829-L849 HydrophobicContact CG1-CD1 4.32Å; V829-L849 HydrophobicContact CG1-CD2 3.75Å; V829-L849 HydrophobicContact CG1-CG 3.74Å; I830-L849 HydrophobicContact CD1-CD1 3.9Å; I830-L849 HydrophobicContact CD1-CD2 4.01Å; A833-L849 HydrophobicContact CB-CD1 4.48Å; C845-L849 VanDerWaalsContact O-CG 3.29Å; C845-L849 WeakPolarHBondContact O-CG 3.27Å; C845-L849 PolarHBondContact O-N 3.35Å; F846-L849 HydrophobicContact CD1-CD1 4.37Å; F846-L849 PolarHBondContact O-N 3.28Å; L849-K851 VanDerWaalsContact C-N 3.34Å; L849-K851 PolarHBondContact O-N 2.8Å; L849-L852 PolarHBondContact O-N 3.02Å; L849-V853 WeakPolarHBondContact O-CB 3.2Å; L849-V853 VanDerWaalsContact O-CG2 3.27Å; L849-V853 WeakPolarHBondContact O-CG2 3.17Å; L849-V853 PolarHBondContact O-N 3.31Å; L849-I873 HydrophobicContact CB-CG2 4.27Å; L849-I873 HydrophobicContact CD1-CG2 4.33Å; L849-I873 HydrophobicContact CD2-CD1 4.05Å; L849-I873 HydrophobicContact CD2-CG1 4.11Å; L849-T903 HydrophobicContact CB-CG2 4.2Å
850	S	93.8	Very high	89	Confident	13 Å²	13	41.3 Å²	41.3	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-46.1	175.2	174.9	0	0	0	0	111.4	F846 I848 V853 E854 T906	F846-S850 WeakPolarHBondContact O-CB 3.27Å; F846-S850 PolarHBondContact O-N 2.96Å; I848-S850 PolarHBondContact O-N 3.26Å; S850-V853 PolarHBondContact O-N 2.98Å; S850-E854 PolarHBondContact O-N 2.97Å; S850-T906 PolarHBondContact OG-OG1 3.47Å; S850-T906 VanDerWaalsContact OG-OG1 3.09Å
851	K	92	Very high	88.3	Confident	60 Å²	60	38.9 Å²	38.9	26%	0.261	20%	0.203	S	C	.	.	H	α-helix	trans	-66.3	-40.6	179.2	-166.4	71.4	-162.1	165.3	0	112.6	I847 I848 L849 E854 L855	I847-K851 WeakPolarHBondContact O-CB 3.13Å; I847-K851 PolarHBondContact O-N 3.34Å; I848-K851 PolarHBondContact O-N 3.34Å; L849-K851 VanDerWaalsContact C-N 3.34Å; L849-K851 PolarHBondContact O-N 2.8Å; K851-E854 WeakPolarHBondContact CD-OE2 3.43Å; K851-E854 WeakPolarHBondContact CE-OE2 3.18Å; K851-E854 VanDerWaalsContact NZ-CD 3.33Å; K851-E854 IonicContact NZ-OE1 2.74Å; K851-E854 PolarHBondContact NZ-OE1 2.84Å; K851-E854 IonicContact NZ-OE2 3.88Å; K851-E854 PolarHBondContact NZ-OE2 3.43Å; K851-E854 WeakPolarHBondContact O-CB 3.26Å; K851-E854 PolarHBondContact O-N 3.23Å; K851-L855 HydrophobicContact CG-CD1 4.19Å; K851-L855 VanDerWaalsContact O-CG 3.32Å; K851-L855 WeakPolarHBondContact O-CG 3.19Å; K851-L855 PolarHBondContact O-N 3.13Å
852	L	90.8	Very high	87.7	Confident	3 Å²	3	41 Å²	41	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-64.9	-40.4	175.7	-70.2	176.3	0	0	0	111.6	T806 L826 I848 L849 E854 L855 W856 F865	T806-L852 HydrophobicContact CG2-CD2 3.57Å; T806-L852 HydrophobicContact CG2-CG 4.05Å; L826-L852 HydrophobicContact CD2-CD1 3.56Å; I848-L852 HydrophobicContact CG2-CD1 3.78Å; I848-L852 HydrophobicContact CG2-CG 4.22Å; I848-L852 WeakPolarHBondContact O-CG 3.47Å; I848-L852 PolarHBondContact O-N 3.04Å; L849-L852 PolarHBondContact O-N 3.02Å; L852-E854 VanDerWaalsContact C-N 3.32Å; L852-E854 PolarHBondContact O-N 2.66Å; L852-L855 PolarHBondContact O-N 2.87Å; L852-W856 HydrophobicContact CB-CE3 4.45Å; L852-W856 HydrophobicContact CD1-CZ3 4.49Å; L852-W856 HydrophobicContact CD2-CD2 4.28Å; L852-W856 HydrophobicContact CD2-CE3 3.95Å; L852-W856 HydrophobicContact CD2-CH2 3.81Å; L852-W856 HydrophobicContact CD2-CZ2 4.14Å; L852-W856 HydrophobicContact CD2-CZ3 3.72Å; L852-W856 WeakPolarHBondContact O-CB 3.49Å; L852-W856 PolarHBondContact O-N 2.74Å; L852-F865 HydrophobicContact CB-CZ 4.03Å
853	V	91.6	Very high	87	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-38.9	172.7	171.7	0	0	0	0	111.4	L849 S850 L855 G857 F865 V869 I873 T906 I907	L849-V853 WeakPolarHBondContact O-CB 3.2Å; L849-V853 VanDerWaalsContact O-CG2 3.27Å; L849-V853 WeakPolarHBondContact O-CG2 3.17Å; L849-V853 PolarHBondContact O-N 3.31Å; S850-V853 PolarHBondContact O-N 2.98Å; V853-L855 VanDerWaalsContact C-N 3.31Å; V853-L855 PolarHBondContact O-N 2.98Å; V853-G857 WeakPolarHBondContact O-CA 3.27Å; V853-G857 PolarHBondContact O-N 3.49Å; V853-F865 HydrophobicContact CG2-CE1 4.47Å; V853-F865 HydrophobicContact CG2-CZ 4.46Å; V853-V869 HydrophobicContact CG2-CG2 4.22Å; V853-I873 HydrophobicContact CG2-CD1 3.81Å; V853-T906 HydrophobicContact CB-CG2 4.4Å; V853-T906 HydrophobicContact CG1-CG2 4.09Å; V853-I907 HydrophobicContact CB-CG1 4.4Å; V853-I907 HydrophobicContact CG1-CB 4.32Å; V853-I907 HydrophobicContact CG1-CG1 3.7Å; V853-I907 HydrophobicContact CG2-CG1 3.98Å
854	E	90.3	Very high	86.3	Confident	80 Å²	80	47.5 Å²	47.5	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-60.7	-41.6	176.1	-166.8	-166	155.3	0	0	111.9	S850 K851 L852 T906 K910	S850-E854 PolarHBondContact O-N 2.97Å; K851-E854 WeakPolarHBondContact CD-OE2 3.43Å; K851-E854 WeakPolarHBondContact CE-OE2 3.18Å; K851-E854 VanDerWaalsContact NZ-CD 3.33Å; K851-E854 IonicContact NZ-OE1 2.74Å; K851-E854 PolarHBondContact NZ-OE1 2.84Å; K851-E854 IonicContact NZ-OE2 3.88Å; K851-E854 PolarHBondContact NZ-OE2 3.43Å; K851-E854 WeakPolarHBondContact O-CB 3.26Å; K851-E854 PolarHBondContact O-N 3.23Å; L852-E854 VanDerWaalsContact C-N 3.32Å; L852-E854 PolarHBondContact O-N 2.66Å; E854-T906 HydrophobicContact CB-CG2 4.09Å; E854-K910 WeakPolarHBondContact O-CE 3.49Å; E854-K910 PolarHBondContact O-NZ 3.41Å
855	L	86.9	Confident	86	Confident	71 Å²	71	46.9 Å²	46.9	37%	0.372	27%	0.265	S	S	.	.	H	α-helix	trans	-83	-42.4	-176	-65.3	171.5	0	0	0	113	K851 L852 V853	K851-L855 HydrophobicContact CG-CD1 4.19Å; K851-L855 VanDerWaalsContact O-CG 3.32Å; K851-L855 WeakPolarHBondContact O-CG 3.19Å; K851-L855 PolarHBondContact O-N 3.13Å; L852-L855 PolarHBondContact O-N 2.87Å; V853-L855 VanDerWaalsContact C-N 3.31Å; V853-L855 PolarHBondContact O-N 2.98Å
856	W	89.3	Confident	85.4	Confident	20 Å²	20	48.2 Å²	48.2	8%	0.076	28%	0.276	C	S	.	.	H	α-helix	trans	-112.3	-6.8	-170.2	-62.6	-16.8	0	0	0	114.3	S811 I814 A815 V822 L826 L852 G858 G861 P862 F865	S811-W856 WeakPolarHBondContact O-CZ2 3.41Å; I814-W856 HydrophobicContact CB-CH2 4.07Å; I814-W856 HydrophobicContact CB-CZ2 4.49Å; I814-W856 HydrophobicContact CG2-CH2 3.88Å; A815-W856 HydrophobicContact CB-CZ2 3.98Å; V822-W856 HydrophobicContact CG1-CZ3 4.47Å; L826-W856 HydrophobicContact CD2-CZ3 4.35Å; L852-W856 HydrophobicContact CB-CE3 4.45Å; L852-W856 HydrophobicContact CD1-CZ3 4.49Å; L852-W856 HydrophobicContact CD2-CD2 4.28Å; L852-W856 HydrophobicContact CD2-CE3 3.95Å; L852-W856 HydrophobicContact CD2-CH2 3.81Å; L852-W856 HydrophobicContact CD2-CZ2 4.14Å; L852-W856 HydrophobicContact CD2-CZ3 3.72Å; L852-W856 WeakPolarHBondContact O-CB 3.49Å; L852-W856 PolarHBondContact O-N 2.74Å; W856-G858 PolarHBondContact O-N 2.82Å; W856-G861 WeakPolarHBondContact O-CA 3.41Å; W856-P862 HydrophobicContact CD2-CG 3.88Å; W856-P862 HydrophobicContact CE3-CG 4.18Å; W856-P862 VanDerWaalsContact CG-CD 3.45Å; W856-P862 HydrophobicContact CG-CG 4.09Å; W856-F865 HydrophobicContact CB-CD1 3.51Å; W856-F865 HydrophobicContact CB-CE1 3.59Å; W856-F865 HydrophobicContact CB-CG 4.04Å; W856-F865 HydrophobicContact CB-CZ 4.18Å; W856-F865 AromaticContact CE3-CD2 3.78Å; W856-F865 HydrophobicContact CE3-CD2 3.78Å; W856-F865 AromaticContact CE3-CE2 3.65Å; W856-F865 HydrophobicContact CE3-CE2 3.65Å; W856-F865 HydrophobicContact CE3-CG 4.29Å; W856-F865 HydrophobicContact CE3-CZ 4.06Å; W856-F865 HydrophobicContact CZ3-CD2 4.45Å; W856-F865 HydrophobicContact CZ3-CE2 4.28Å; W856-F865 WeakPolarHBondContact O-CD1 3.46Å
857	G	81.4	Confident	85	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-72.1	-10.6	-177.7	0	0	0	0	0	115	V853 R911	V853-G857 WeakPolarHBondContact O-CA 3.27Å; V853-G857 PolarHBondContact O-N 3.49Å; G857-R911 WeakPolarHBondContact O-CD 3.49Å; G857-R911 PolarHBondContact O-NH1 3.05Å
858	G	79.9	Confident	84.7	Confident	34 Å²	34	51.5 Å²	51.5	35%	0.351	29%	0.293	S	S	.	.	S	Bend	trans	-82	-171.5	176.5	0	0	0	0	0	113.9	W856 D860	W856-G858 PolarHBondContact O-N 2.82Å; G858-D860 PolarHBondContact O-N 3.14Å
859	K	69.4	Low	84.5	Confident	210 Å²	210	51.5 Å²	51.5	91%	0.913	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-18.6	178.6	-66.9	-175.8	178.9	-179.7	0	113.6
860	D	69.5	Low	84.3	Confident	166 Å²	166	52.5 Å²	52.5	89%	0.888	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	11.3	-176.8	-50.6	-54.1	0	0	0	113.2	G858	G858-D860 PolarHBondContact O-N 3.14Å
861	G	75	Confident	84.1	Confident	21 Å²	21	58.6 Å²	58.6	22%	0.216	32%	0.322	C	S	.	.	S	Bend	trans	-79.6	168.4	178.9	0	0	0	0	0	114.1	W856	W856-G861 WeakPolarHBondContact O-CA 3.41Å
862	P	79.1	Confident	84.1	Confident	48 Å²	48	59.2 Å²	59.2	31%	0.312	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-55.9	142	173.2	-23.1	34.3	0	0	0	112.3	W856 G864 F865	W856-P862 HydrophobicContact CD2-CG 3.88Å; W856-P862 HydrophobicContact CE3-CG 4.18Å; W856-P862 VanDerWaalsContact CG-CD 3.45Å; W856-P862 HydrophobicContact CG-CG 4.09Å; P862-G864 PolarHBondContact O-N 3.48Å; P862-F865 WeakPolarHBondContact O-CB 3.34Å; P862-F865 PolarHBondContact O-N 3.4Å; P862-F865 VanDerWaalsContact O-N 3.09Å
863	V	77.2	Confident	84.2	Confident	160 Å²	160	59.1 Å²	59.1	97%	0.97	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	129	178.7	-177.6	0	0	0	0	109.7
864	G	79.9	Confident	84.2	Confident	42 Å²	42	59.1 Å²	59.1	43%	0.433	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-9.2	-178.4	0	0	0	0	0	115.4	P862 A866 D867 F868	P862-G864 PolarHBondContact O-N 3.48Å; G864-A866 PolarHBondContact O-N 3.05Å; G864-D867 PolarHBondContact O-N 3.33Å; G864-F868 PolarHBondContact O-N 2.88Å; G864-F868 VanDerWaalsContact O-N 3.09Å
865	F	86.1	Confident	84.3	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.035	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-36.7	178.7	-172.4	-103.3	0	0	0	112.6	L826 L852 V853 W856 P862 D867 F868 V869 I873	L826-F865 HydrophobicContact CD1-CD2 3.94Å; L826-F865 HydrophobicContact CD1-CE2 3.99Å; L826-F865 HydrophobicContact CD2-CE2 4.19Å; L852-F865 HydrophobicContact CB-CZ 4.03Å; V853-F865 HydrophobicContact CG2-CE1 4.47Å; V853-F865 HydrophobicContact CG2-CZ 4.46Å; W856-F865 HydrophobicContact CB-CD1 3.51Å; W856-F865 HydrophobicContact CB-CE1 3.59Å; W856-F865 HydrophobicContact CB-CG 4.04Å; W856-F865 HydrophobicContact CB-CZ 4.18Å; W856-F865 AromaticContact CE3-CD2 3.78Å; W856-F865 HydrophobicContact CE3-CD2 3.78Å; W856-F865 AromaticContact CE3-CE2 3.65Å; W856-F865 HydrophobicContact CE3-CE2 3.65Å; W856-F865 HydrophobicContact CE3-CG 4.29Å; W856-F865 HydrophobicContact CE3-CZ 4.06Å; W856-F865 HydrophobicContact CZ3-CD2 4.45Å; W856-F865 HydrophobicContact CZ3-CE2 4.28Å; W856-F865 WeakPolarHBondContact O-CD1 3.46Å; P862-F865 WeakPolarHBondContact O-CB 3.34Å; P862-F865 PolarHBondContact O-N 3.4Å; P862-F865 VanDerWaalsContact O-N 3.09Å; F865-D867 VanDerWaalsContact C-N 3.3Å; F865-D867 PolarHBondContact O-N 2.88Å; F865-F868 HydrophobicContact CE2-CD1 4.47Å; F865-F868 WeakPolarHBondContact O-CA 3.34Å; F865-F868 WeakPolarHBondContact O-CB 3.48Å; F865-F868 PolarHBondContact O-N 3.45Å; F865-F868 VanDerWaalsContact O-N 3.1Å; F865-V869 HydrophobicContact CD1-CG2 4.07Å; F865-V869 HydrophobicContact CE1-CG2 3.78Å; F865-V869 HydrophobicContact CZ-CG2 4.31Å; F865-V869 WeakPolarHBondContact O-CG2 3.42Å; F865-V869 PolarHBondContact O-N 3.01Å; F865-I873 HydrophobicContact CZ-CD1 4.25Å
866	A	84.3	Confident	84.5	Confident	29 Å²	29	52.9 Å²	52.9	24%	0.24	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-42.4	175.3	0	0	0	0	0	112.2	G864 F868 V869 Y870	G864-A866 PolarHBondContact O-N 3.05Å; A866-F868 VanDerWaalsContact C-N 3.33Å; A866-V869 PolarHBondContact O-N 3.38Å; A866-Y870 WeakPolarHBondContact O-CD2 3.48Å
867	D	86.1	Confident	84.6	Confident	97 Å²	97	51.9 Å²	51.9	52%	0.519	29%	0.292	S	S	.	.	H	α-helix	trans	-66.7	-38	175.7	-64.7	-18.9	0	0	0	111	G864 F865 V869 Y870 K871	G864-D867 PolarHBondContact O-N 3.33Å; F865-D867 VanDerWaalsContact C-N 3.3Å; F865-D867 PolarHBondContact O-N 2.88Å; D867-V869 VanDerWaalsContact C-N 3.34Å; D867-V869 PolarHBondContact O-N 2.96Å; D867-Y870 PolarHBondContact O-N 3.42Å; D867-K871 WeakPolarHBondContact O-CB 3.47Å; D867-K871 WeakPolarHBondContact O-CG 3.47Å; D867-K871 PolarHBondContact O-N 2.8Å
868	F	88.7	Confident	85.1	Confident	16 Å²	16	52 Å²	52	7%	0.07	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-38.2	176.1	-171.1	-87.8	0	0	0	112.6	L826 V827 I830 G864 F865 A866 Y870 H872 I873	L826-F868 HydrophobicContact CB-CD1 4.47Å; L826-F868 HydrophobicContact CB-CE1 3.74Å; L826-F868 HydrophobicContact CB-CE2 3.92Å; L826-F868 HydrophobicContact CB-CZ 3.43Å; L826-F868 VanDerWaalsContact CB-CZ 3.43Å; L826-F868 HydrophobicContact CD1-CD1 4.17Å; L826-F868 HydrophobicContact CD1-CE1 4.24Å; L826-F868 HydrophobicContact CD1-CG 4.34Å; L826-F868 HydrophobicContact CD1-CZ 4.46Å; L826-F868 HydrophobicContact CG-CE1 4.42Å; V827-F868 HydrophobicContact CG2-CE2 4.18Å; I830-F868 HydrophobicContact CD1-CE1 4.41Å; I830-F868 HydrophobicContact CG1-CE1 4.18Å; I830-F868 HydrophobicContact CG1-CZ 3.88Å; G864-F868 PolarHBondContact O-N 2.88Å; G864-F868 VanDerWaalsContact O-N 3.09Å; F865-F868 HydrophobicContact CE2-CD1 4.47Å; F865-F868 WeakPolarHBondContact O-CA 3.34Å; F865-F868 WeakPolarHBondContact O-CB 3.48Å; F865-F868 PolarHBondContact O-N 3.45Å; F865-F868 VanDerWaalsContact O-N 3.1Å; A866-F868 VanDerWaalsContact C-N 3.33Å; F868-Y870 PolarHBondContact O-N 3.5Å; F868-H872 HydrophobicContact CD1-CB 4.48Å; F868-H872 HydrophobicContact CD2-CB 4.48Å; F868-H872 AromaticContact CD2-CD2 3.47Å; F868-H872 VanDerWaalsContact CD2-CD2 3.47Å; F868-H872 WeakPolarHBondContact CD2-CD2 3.45Å; F868-H872 HydrophobicContact CE1-CB 4.1Å; F868-H872 HydrophobicContact CE2-CB 4.1Å; F868-H872 AromaticContact CE2-CD2 3.52Å; F868-H872 AromaticContact CE2-CG 3.93Å; F868-H872 HydrophobicContact CZ-CB 3.88Å; F868-H872 PolarHBondContact O-N 3.18Å; F868-I873 HydrophobicContact CD1-CD1 4.12Å; F868-I873 HydrophobicContact CD1-CG1 3.95Å; F868-I873 HydrophobicContact CE1-CD1 4.28Å; F868-I873 HydrophobicContact CE1-CG1 3.89Å; F868-I873 PolarHBondContact O-N 2.88Å
869	V	89.6	Confident	85.6	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.012	30%	0.296	C	S	.	.	I	π-helix	trans	-56.3	-50.1	176	178.3	0	0	0	0	110.6	V853 F865 A866 D867 I873 V874 I907	V853-V869 HydrophobicContact CG2-CG2 4.22Å; F865-V869 HydrophobicContact CD1-CG2 4.07Å; F865-V869 HydrophobicContact CE1-CG2 3.78Å; F865-V869 HydrophobicContact CZ-CG2 4.31Å; F865-V869 WeakPolarHBondContact O-CG2 3.42Å; F865-V869 PolarHBondContact O-N 3.01Å; A866-V869 PolarHBondContact O-N 3.38Å; D867-V869 VanDerWaalsContact C-N 3.34Å; D867-V869 PolarHBondContact O-N 2.96Å; V869-I873 HydrophobicContact CB-CD1 4.48Å; V869-I873 HydrophobicContact CG1-CB 4.48Å; V869-I873 HydrophobicContact CG2-CD1 4.11Å; V869-I873 WeakPolarHBondContact O-CB 3.45Å; V869-I873 PolarHBondContact O-N 2.88Å; V869-I873 VanDerWaalsContact O-N 3.14Å; V869-V874 HydrophobicContact CG1-CG2 4.38Å; V869-V874 PolarHBondContact O-N 3.19Å; V869-I907 HydrophobicContact CG1-CD1 3.88Å; V869-I907 HydrophobicContact CG1-CG1 3.91Å; V869-I907 HydrophobicContact CG1-CG2 3.83Å
870	Y	90.1	Very high	86.5	Confident	20 Å²	20	44.3 Å²	44.3	8%	0.078	25%	0.253	C	S	.	.	I	π-helix	trans	-77.9	-35.9	-176.7	-66.6	-63.6	0	0	0	113.2	A866 D867 F868 V874 P875 R911 E914 C915 Y918	A866-Y870 WeakPolarHBondContact O-CD2 3.48Å; D867-Y870 PolarHBondContact O-N 3.42Å; F868-Y870 PolarHBondContact O-N 3.5Å; Y870-V874 HydrophobicContact CD1-CG2 4.16Å; Y870-P875 WeakPolarHBondContact O-CD 3.48Å; Y870-R911 WeakPolarHBondContact OH-CB 3.43Å; Y870-E914 WeakPolarHBondContact CE2-OE1 3.4Å; Y870-E914 WeakPolarHBondContact OH-CG 3.46Å; Y870-C915 HydrophobicContact CE1-CB 4.41Å; Y870-C915 PolarHBondContact OH-N 2.98Å; Y870-Y918 AromaticContact CD1-CD1 3.44Å; Y870-Y918 HydrophobicContact CD1-CD1 3.44Å; Y870-Y918 VanDerWaalsContact CD1-CD1 3.44Å; Y870-Y918 HydrophobicContact CD1-CD2 4.28Å; Y870-Y918 AromaticContact CD1-CE1 3.78Å; Y870-Y918 HydrophobicContact CD1-CE1 3.78Å; Y870-Y918 AromaticContact CD1-CG 3.71Å; Y870-Y918 HydrophobicContact CD1-CG 3.71Å; Y870-Y918 AromaticContact CE1-CD1 3.97Å; Y870-Y918 HydrophobicContact CE1-CD1 3.97Å; Y870-Y918 HydrophobicContact CE1-CG 4.05Å; Y870-Y918 HydrophobicContact CG-CD1 4.35Å; Y870-Y918 HydrophobicContact CG-CE1 4.41Å; Y870-Y918 HydrophobicContact CG-CG 4.43Å; Y870-Y918 PolarHBondContact O-OH 3.13Å
871	K	89.2	Confident	87.4	Confident	142 Å²	142	36.4 Å²	36.4	62%	0.617	21%	0.211	S	C	*	.	I	π-helix	trans	-75.1	-28.4	179.9	-72.3	179.9	179.9	174.8	0	114.3	D867 P875	D867-K871 WeakPolarHBondContact O-CB 3.47Å; D867-K871 WeakPolarHBondContact O-CG 3.47Å; D867-K871 PolarHBondContact O-N 2.8Å; K871-P875 WeakPolarHBondContact O-CG 3.23Å
872	H	91.3	Very high	88	Confident	73 Å²	73	39 Å²	39	34%	0.338	22%	0.219	S	C	.	.	I	π-helix	trans	-130.9	-47.8	-171.2	-59.4	-71.5	0	0	0	114.4	I830 F868 A876	I830-H872 HydrophobicContact CD1-CB 4.2Å; I830-H872 HydrophobicContact CG1-CB 4.13Å; F868-H872 HydrophobicContact CD1-CB 4.48Å; F868-H872 HydrophobicContact CD2-CB 4.48Å; F868-H872 AromaticContact CD2-CD2 3.47Å; F868-H872 VanDerWaalsContact CD2-CD2 3.47Å; F868-H872 WeakPolarHBondContact CD2-CD2 3.45Å; F868-H872 HydrophobicContact CE1-CB 4.1Å; F868-H872 HydrophobicContact CE2-CB 4.1Å; F868-H872 AromaticContact CE2-CD2 3.52Å; F868-H872 AromaticContact CE2-CG 3.93Å; F868-H872 HydrophobicContact CZ-CB 3.88Å; F868-H872 PolarHBondContact O-N 3.18Å; H872-A876 WeakPolarHBondContact O-CB 3.33Å; H872-A876 PolarHBondContact O-N 3.19Å
873	I	92.4	Very high	88.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	I	π-helix	trans	-69.9	-47.5	-175.2	-53.7	-175.7	0	0	0	111.7	I830 L849 V853 F865 F868 V869 A876 C877 T903 I907	I830-I873 HydrophobicContact CD1-CG1 4.11Å; L849-I873 HydrophobicContact CB-CG2 4.27Å; L849-I873 HydrophobicContact CD1-CG2 4.33Å; L849-I873 HydrophobicContact CD2-CD1 4.05Å; L849-I873 HydrophobicContact CD2-CG1 4.11Å; V853-I873 HydrophobicContact CG2-CD1 3.81Å; F865-I873 HydrophobicContact CZ-CD1 4.25Å; F868-I873 HydrophobicContact CD1-CD1 4.12Å; F868-I873 HydrophobicContact CD1-CG1 3.95Å; F868-I873 HydrophobicContact CE1-CD1 4.28Å; F868-I873 HydrophobicContact CE1-CG1 3.89Å; F868-I873 PolarHBondContact O-N 2.88Å; V869-I873 HydrophobicContact CB-CD1 4.48Å; V869-I873 HydrophobicContact CG1-CB 4.48Å; V869-I873 HydrophobicContact CG2-CD1 4.11Å; V869-I873 WeakPolarHBondContact O-CB 3.45Å; V869-I873 PolarHBondContact O-N 2.88Å; V869-I873 VanDerWaalsContact O-N 3.14Å; I873-A876 PolarHBondContact O-N 3.43Å; I873-C877 PolarHBondContact O-N 3.03Å; I873-C877 PolarHBondContact O-SG 3.35Å; I873-T903 HydrophobicContact CG2-CG2 3.88Å; I873-I907 HydrophobicContact CG2-CD1 3.88Å
874	V	91.9	Very high	88.5	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-50.3	177.2	171.1	0	0	0	0	110.1	V869 Y870 A876 C877 F878 I907 Y918 L919 Y923	V869-V874 HydrophobicContact CG1-CG2 4.38Å; V869-V874 PolarHBondContact O-N 3.19Å; Y870-V874 HydrophobicContact CD1-CG2 4.16Å; V874-A876 VanDerWaalsContact C-N 3.33Å; V874-A876 PolarHBondContact O-N 3.07Å; V874-C877 WeakPolarHBondContact O-CB 3.27Å; V874-C877 PolarHBondContact O-N 3.2Å; V874-C877 VanDerWaalsContact O-N 3.15Å; V874-F878 HydrophobicContact CG1-CE2 4.27Å; V874-F878 VanDerWaalsContact O-CD2 3.31Å; V874-F878 WeakPolarHBondContact O-CD2 3.34Å; V874-I907 HydrophobicContact CG2-CD1 3.92Å; V874-Y918 HydrophobicContact CB-CE1 4.49Å; V874-Y918 HydrophobicContact CG1-CE1 4.07Å; V874-L919 HydrophobicContact CG1-CD2 3.83Å; V874-Y923 HydrophobicContact CG1-CD1 4.14Å; V874-Y923 HydrophobicContact CG1-CG 4.36Å
875	P	92.9	Very high	88.5	Confident	18 Å²	18	43.8 Å²	43.8	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-39.7	175.2	-28.6	35.4	0	0	0	115.1	Y870 K871 C877 F878 L879 Y923	Y870-P875 WeakPolarHBondContact O-CD 3.48Å; K871-P875 WeakPolarHBondContact O-CG 3.23Å; P875-C877 PolarHBondContact O-N 3.16Å; P875-F878 PolarHBondContact O-N 3.36Å; P875-L879 HydrophobicContact CB-CD1 4.23Å; P875-L879 WeakPolarHBondContact O-CB 3.45Å; P875-L879 WeakPolarHBondContact O-CG 3.31Å; P875-L879 PolarHBondContact O-N 3.37Å; P875-Y923 VanDerWaalsContact CA-OH 3.28Å; P875-Y923 WeakPolarHBondContact CA-OH 3.42Å; P875-Y923 HydrophobicContact CB-CE2 3.84Å; P875-Y923 HydrophobicContact CG-CD2 4.25Å; P875-Y923 HydrophobicContact CG-CE2 3.63Å
876	A	91.8	Very high	88.4	Confident	2 Å²	2	43.5 Å²	43.5	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-58.4	-34.4	178.1	0	0	0	0	0	113	I830 V834 H872 I873 V874 F878 A880	I830-A876 HydrophobicContact CD1-CB 4.02Å; I830-A876 HydrophobicContact CG2-CB 4.28Å; V834-A876 HydrophobicContact CG2-CB 3.51Å; H872-A876 WeakPolarHBondContact O-CB 3.33Å; H872-A876 PolarHBondContact O-N 3.19Å; I873-A876 PolarHBondContact O-N 3.43Å; V874-A876 VanDerWaalsContact C-N 3.33Å; V874-A876 PolarHBondContact O-N 3.07Å; A876-F878 PolarHBondContact O-N 3.09Å; A876-A880 WeakPolarHBondContact O-CB 3.45Å; A876-A880 PolarHBondContact O-N 2.8Å; A876-A880 VanDerWaalsContact O-N 3.14Å
877	C	91.8	Very high	88.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.1	-17.4	178	-63	0	0	0	0	113.8	I873 V874 P875 P881 C900 L904	I873-C877 PolarHBondContact O-N 3.03Å; I873-C877 PolarHBondContact O-SG 3.35Å; V874-C877 WeakPolarHBondContact O-CB 3.27Å; V874-C877 PolarHBondContact O-N 3.2Å; V874-C877 VanDerWaalsContact O-N 3.15Å; P875-C877 PolarHBondContact O-N 3.16Å; C877-P881 WeakPolarHBondContact O-CD 3.43Å; C877-P881 WeakPolarHBondContact O-CG 3.35Å; C877-C900 WeakPolarHBondContact CA-SG 3.13Å; C877-C900 VanDerWaalsContact CB-SG 3.51Å; C877-C900 PolarHBondContact O-SG 2.9Å; C877-L904 HydrophobicContact CB-CD1 4.04Å; C877-L904 HydrophobicContact CB-CD2 3.76Å; C877-L904 HydrophobicContact CB-CG 3.82Å
878	F	91.4	Very high	88.2	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-109.2	-38.3	177.1	-64.5	-91.6	0	0	0	112	V874 P875 A876 A880 P881 L882 L904 L919 Y923 L924 L927 F937 F956 F957	V874-F878 HydrophobicContact CG1-CE2 4.27Å; V874-F878 VanDerWaalsContact O-CD2 3.31Å; V874-F878 WeakPolarHBondContact O-CD2 3.34Å; P875-F878 PolarHBondContact O-N 3.36Å; A876-F878 PolarHBondContact O-N 3.09Å; F878-A880 PolarHBondContact O-N 3.06Å; F878-P881 WeakPolarHBondContact O-CD 3.5Å; F878-L882 WeakPolarHBondContact O-CB 3.47Å; F878-L882 WeakPolarHBondContact O-CD1 3.49Å; F878-L882 WeakPolarHBondContact O-CG 3.49Å; F878-L882 PolarHBondContact O-N 2.9Å; F878-L904 HydrophobicContact CE2-CD2 4.14Å; F878-L904 HydrophobicContact CZ-CD1 4.44Å; F878-L919 HydrophobicContact CE2-CD2 4.13Å; F878-L919 HydrophobicContact CZ-CD2 4.25Å; F878-Y923 HydrophobicContact CB-CE1 4.04Å; F878-Y923 HydrophobicContact CD2-CD1 4.05Å; F878-Y923 AromaticContact CD2-CE1 3.33Å; F878-Y923 HydrophobicContact CD2-CE1 3.33Å; F878-Y923 HydrophobicContact CE2-CD1 4.1Å; F878-Y923 AromaticContact CE2-CE1 3.85Å; F878-Y923 HydrophobicContact CE2-CE1 3.85Å; F878-Y923 AromaticContact CG-CE1 3.75Å; F878-Y923 HydrophobicContact CG-CE1 3.75Å; F878-L924 HydrophobicContact CD1-CD2 4.24Å; F878-L924 HydrophobicContact CE1-CD2 3.6Å; F878-L924 HydrophobicContact CZ-CD2 3.8Å; F878-L927 HydrophobicContact CB-CD1 4.19Å; F878-L927 HydrophobicContact CD1-CD1 4.49Å; F878-L927 HydrophobicContact CG-CD1 4.4Å; F878-F937 HydrophobicContact CE1-CE1 4.42Å; F878-F937 AromaticContact CE1-CE2 3.94Å; F878-F937 HydrophobicContact CE1-CE2 3.94Å; F878-F937 AromaticContact CE1-CZ 3.74Å; F878-F937 HydrophobicContact CE1-CZ 3.74Å; F878-F937 AromaticContact CZ-CE1 3.93Å; F878-F937 HydrophobicContact CZ-CE1 3.93Å; F878-F937 HydrophobicContact CZ-CE2 4.21Å; F878-F937 AromaticContact CZ-CZ 3.53Å; F878-F937 HydrophobicContact CZ-CZ 3.53Å; F878-F956 HydrophobicContact CE1-CE1 4.39Å; F878-F957 HydrophobicContact CD1-CE1 4.32Å; F878-F957 AromaticContact CD1-CZ 3.96Å; F878-F957 HydrophobicContact CD1-CZ 3.96Å
879	L	89.9	Confident	87.8	Confident	83 Å²	83	46.1 Å²	46.1	44%	0.435	24%	0.242	S	C	.	.	H	α-helix	trans	-65.2	-39.3	179.1	-68	173.4	0	0	0	112.5	V834 P875	V834-L879 HydrophobicContact CG1-CB 3.78Å; P875-L879 HydrophobicContact CB-CD1 4.23Å; P875-L879 WeakPolarHBondContact O-CB 3.45Å; P875-L879 WeakPolarHBondContact O-CG 3.31Å; P875-L879 PolarHBondContact O-N 3.37Å
880	A	88.4	Confident	87.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-52.2	-179.6	0	0	0	0	0	112.3	A833 V834 F846 A876 F878 L882 K883 F886	A833-A880 WeakPolarHBondContact O-CB 3.44Å; V834-A880 HydrophobicContact CG2-CB 4.19Å; F846-A880 HydrophobicContact CE2-CB 4.35Å; F846-A880 HydrophobicContact CZ-CB 4.07Å; A876-A880 WeakPolarHBondContact O-CB 3.45Å; A876-A880 PolarHBondContact O-N 2.8Å; A876-A880 VanDerWaalsContact O-N 3.14Å; F878-A880 PolarHBondContact O-N 3.06Å; A880-L882 VanDerWaalsContact C-N 3.25Å; A880-L882 PolarHBondContact O-N 2.87Å; A880-K883 PolarHBondContact O-N 3.34Å; A880-F886 WeakPolarHBondContact O-CB 3.35Å
881	P	88.3	Confident	87.3	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-25.8	178.9	-24.3	37.2	0	0	0	114.1	C877 F878 K883 F886 L897 F957 K961	C877-P881 WeakPolarHBondContact O-CD 3.43Å; C877-P881 WeakPolarHBondContact O-CG 3.35Å; F878-P881 WeakPolarHBondContact O-CD 3.5Å; P881-K883 VanDerWaalsContact C-N 3.32Å; P881-K883 PolarHBondContact O-N 3.33Å; P881-F886 HydrophobicContact CB-CD1 4.29Å; P881-F886 HydrophobicContact CB-CE1 4.24Å; P881-L897 HydrophobicContact CB-CD1 4.03Å; P881-L897 HydrophobicContact CG-CD1 3.71Å; P881-F957 HydrophobicContact CB-CD1 3.75Å; P881-F957 HydrophobicContact CB-CD2 3.75Å; P881-F957 HydrophobicContact CB-CE1 3.74Å; P881-F957 HydrophobicContact CB-CE2 3.71Å; P881-F957 HydrophobicContact CB-CG 3.76Å; P881-F957 HydrophobicContact CB-CZ 3.72Å; P881-F957 HydrophobicContact CG-CD2 4.22Å; P881-F957 HydrophobicContact CG-CE1 4.27Å; P881-F957 HydrophobicContact CG-CE2 3.74Å; P881-F957 HydrophobicContact CG-CZ 3.78Å; P881-K961 WeakPolarHBondContact O-CE 3.31Å; P881-K961 PolarHBondContact O-NZ 2.87Å
882	L	88.1	Confident	87.2	Confident	76 Å²	76	48.3 Å²	48.3	40%	0.398	27%	0.269	S	S	.	.	H	α-helix	trans	-77.4	-10.9	179.9	-72.7	172	0	0	0	114.4	F878 A880 F957 A960	F878-L882 WeakPolarHBondContact O-CB 3.47Å; F878-L882 WeakPolarHBondContact O-CD1 3.49Å; F878-L882 WeakPolarHBondContact O-CG 3.49Å; F878-L882 PolarHBondContact O-N 2.9Å; A880-L882 VanDerWaalsContact C-N 3.25Å; A880-L882 PolarHBondContact O-N 2.87Å; L882-F957 HydrophobicContact CD2-CD1 4.15Å; L882-F957 HydrophobicContact CD2-CE1 4.3Å; L882-F957 HydrophobicContact CG-CD1 4.36Å; L882-F957 HydrophobicContact CG-CE1 4.11Å; L882-A960 HydrophobicContact CD2-CB 4.29Å
883	K	85.9	Confident	87.1	Confident	68 Å²	68	45 Å²	45	30%	0.296	25%	0.254	S	S	.	.	S	Bend	trans	-69	147.8	177.3	-74.7	-170.3	172.9	-167.9	0	112.5	V834 E835 A880 P881 T885 F886 K961	V834-K883 VanDerWaalsContact O-CD 3.26Å; V834-K883 WeakPolarHBondContact O-CD 3.35Å; V834-K883 WeakPolarHBondContact O-CE 3.49Å; V834-K883 PolarHBondContact O-NZ 3.47Å; E835-K883 VanDerWaalsContact CA-NZ 3.34Å; E835-K883 PolarHBondContact O-NZ 3.42Å; A880-K883 PolarHBondContact O-N 3.34Å; P881-K883 VanDerWaalsContact C-N 3.32Å; P881-K883 PolarHBondContact O-N 3.33Å; K883-T885 PolarHBondContact O-N 3.47Å; K883-F886 PolarHBondContact O-N 3.32Å; K883-K961 PolarHBondContact O-NZ 2.78Å
884	Q	79.6	Confident	86.9	Confident	199 Å²	199	46.6 Å²	46.6	93%	0.93	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.7	173.7	-69.6	-174.9	-4.7	0	0	112.2	F886	Q884-F886 PolarHBondContact O-N 2.87Å
885	T	81.8	Confident	86.8	Confident	84 Å²	84	50 Å²	50	52%	0.515	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-6.5	178.6	53.7	0	0	0	0	114.5	P837 K883 D887	P837-T885 HydrophobicContact CB-CG2 4.03Å; K883-T885 PolarHBondContact O-N 3.47Å; T885-D887 PolarHBondContact O-N 3.47Å
886	F	83.3	Confident	86.7	Confident	1 Å²	1	49.1 Å²	49.1	0%	0.004	28%	0.275	C	S	.	.			trans	-97.5	82	-177.8	-161.7	-83.1	0	0	0	110.6	A880 P881 K883 Q884 L888 T893 A896 L897 K961	A880-F886 WeakPolarHBondContact O-CB 3.35Å; P881-F886 HydrophobicContact CB-CD1 4.29Å; P881-F886 HydrophobicContact CB-CE1 4.24Å; K883-F886 PolarHBondContact O-N 3.32Å; Q884-F886 PolarHBondContact O-N 2.87Å; F886-L888 HydrophobicContact CD1-CD2 4.09Å; F886-L888 HydrophobicContact CE1-CD2 4Å; F886-L888 PolarHBondContact O-N 3.4Å; F886-T893 HydrophobicContact CB-CG2 4.35Å; F886-T893 HydrophobicContact CD1-CG2 3.16Å; F886-T893 HydrophobicContact CD2-CG2 3.81Å; F886-T893 HydrophobicContact CE1-CG2 3.16Å; F886-T893 HydrophobicContact CE2-CG2 3.8Å; F886-T893 HydrophobicContact CG-CG2 3.5Å; F886-T893 VanDerWaalsContact CG-CG2 3.5Å; F886-T893 HydrophobicContact CZ-CG2 3.49Å; F886-T893 VanDerWaalsContact CZ-CG2 3.49Å; F886-T893 WeakPolarHBondContact CZ-O 3.48Å; F886-A896 HydrophobicContact CE2-CB 4.19Å; F886-A896 HydrophobicContact CZ-CB 4.13Å; F886-L897 HydrophobicContact CE1-CB 4.07Å; F886-L897 HydrophobicContact CE1-CD1 4.42Å; F886-L897 HydrophobicContact CZ-CB 4.08Å; F886-K961 PolarHBondContact O-NZ 3.49Å
887	D	82.8	Confident	86.8	Confident	90 Å²	90	49.2 Å²	49.2	48%	0.481	28%	0.276	S	S	.	.			trans	-73.6	120.9	-176.1	-177.2	10.2	0	0	0	113.2	T885 A889 D890 T893	T885-D887 PolarHBondContact O-N 3.47Å; D887-A889 VanDerWaalsContact C-N 3.3Å; D887-A889 PolarHBondContact O-N 3.36Å; D887-A889 WeakPolarHBondContact OD1-CB 3.17Å; D887-A889 PolarHBondContact OD1-N 2.99Å; D887-D890 HydrophobicContact CB-CB 4.18Å; D887-D890 PolarHBondContact O-N 3.45Å; D887-T893 WeakPolarHBondContact O-CB 3.33Å; D887-T893 WeakPolarHBondContact O-CG2 3.33Å
888	L	83.1	Confident	86.8	Confident	17 Å²	17	50.6 Å²	50.6	9%	0.089	29%	0.285	C	S	.	.	S	Bend	trans	-81.4	-6.9	179.3	-65	173.7	0	0	0	113.8	F886 V894 L897 F957 Q958 K961	F886-L888 HydrophobicContact CD1-CD2 4.09Å; F886-L888 HydrophobicContact CE1-CD2 4Å; F886-L888 PolarHBondContact O-N 3.4Å; L888-V894 WeakPolarHBondContact O-CG2 3.24Å; L888-L897 HydrophobicContact CD2-CD2 3.8Å; L888-F957 HydrophobicContact CD1-CB 4.02Å; L888-Q958 HydrophobicContact CD1-CG 3.86Å; L888-K961 HydrophobicContact CD1-CD 4.18Å
889	A	80.6	Confident	86.9	Confident	90 Å²	90	52.6 Å²	52.6	74%	0.744	30%	0.295	S	S	*	.	S	Bend	trans	-83.4	-27.7	169.1	0	0	0	0	0	112.1	D887	D887-A889 VanDerWaalsContact C-N 3.3Å; D887-A889 PolarHBondContact O-N 3.36Å; D887-A889 WeakPolarHBondContact OD1-CB 3.17Å; D887-A889 PolarHBondContact OD1-N 2.99Å
890	D	84	Confident	87.1	Confident	55 Å²	55	48.6 Å²	48.6	29%	0.294	27%	0.274	S	S	.	.	S	Bend	trans	-70.9	128.9	176.2	169.3	42.6	0	0	0	112.4	D887 Q892 T893 V894	D887-D890 HydrophobicContact CB-CB 4.18Å; D887-D890 PolarHBondContact O-N 3.45Å; D890-Q892 VanDerWaalsContact C-N 3.34Å; D890-Q892 PolarHBondContact O-N 3.36Å; D890-Q892 PolarHBondContact OD1-N 3.04Å; D890-Q892 WeakPolarHBondContact OD2-CB 3.39Å; D890-Q892 PolarHBondContact OD2-N 3.43Å; D890-T893 PolarHBondContact O-N 3.29Å; D890-T893 WeakPolarHBondContact OD2-CB 3.38Å; D890-T893 PolarHBondContact OD2-N 3.31Å; D890-T893 PolarHBondContact OD2-OG1 3.44Å; D890-V894 WeakPolarHBondContact O-CG2 3.41Å; D890-V894 PolarHBondContact O-N 2.89Å; D890-V894 VanDerWaalsContact O-N 3.11Å
891	A	85.8	Confident	87.3	Confident	69 Å²	69	48.7 Å²	48.7	57%	0.57	28%	0.275	S	S	*	.	H	α-helix	trans	-63.2	-35.9	-179.8	0	0	0	0	0	112.8	V894 L895	A891-V894 PolarHBondContact O-N 3.14Å; A891-L895 WeakPolarHBondContact O-CG 3.27Å; A891-L895 PolarHBondContact O-N 3.4Å
892	Q	86.5	Confident	87.5	Confident	87 Å²	87	50.5 Å²	50.5	41%	0.407	29%	0.285	S	S	.	.	H	α-helix	trans	-71	-39.9	-179.1	-66.5	-62.9	-28.1	0	0	111.8	P839 D890 V894 L895 A896	P839-Q892 HydrophobicContact CB-CB 3.87Å; D890-Q892 VanDerWaalsContact C-N 3.34Å; D890-Q892 PolarHBondContact O-N 3.36Å; D890-Q892 PolarHBondContact OD1-N 3.04Å; D890-Q892 WeakPolarHBondContact OD2-CB 3.39Å; D890-Q892 PolarHBondContact OD2-N 3.43Å; Q892-V894 VanDerWaalsContact C-N 3.34Å; Q892-V894 PolarHBondContact O-N 2.93Å; Q892-L895 WeakPolarHBondContact O-CB 3.28Å; Q892-L895 PolarHBondContact O-N 3.44Å; Q892-L895 VanDerWaalsContact O-N 3.11Å; Q892-A896 PolarHBondContact O-N 3.24Å; Q892-A896 VanDerWaalsContact O-N 3.1Å
893	T	88	Confident	87.8	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-36.2	176.2	-59.6	0	0	0	0	112.1	P839 F886 D887 D890 L895 A896 L897	P839-T893 WeakPolarHBondContact CG-OG1 3.43Å; F886-T893 HydrophobicContact CB-CG2 4.35Å; F886-T893 HydrophobicContact CD1-CG2 3.16Å; F886-T893 HydrophobicContact CD2-CG2 3.81Å; F886-T893 HydrophobicContact CE1-CG2 3.16Å; F886-T893 HydrophobicContact CE2-CG2 3.8Å; F886-T893 HydrophobicContact CG-CG2 3.5Å; F886-T893 VanDerWaalsContact CG-CG2 3.5Å; F886-T893 HydrophobicContact CZ-CG2 3.49Å; F886-T893 VanDerWaalsContact CZ-CG2 3.49Å; F886-T893 WeakPolarHBondContact CZ-O 3.48Å; D887-T893 WeakPolarHBondContact O-CB 3.33Å; D887-T893 WeakPolarHBondContact O-CG2 3.33Å; D890-T893 PolarHBondContact O-N 3.29Å; D890-T893 WeakPolarHBondContact OD2-CB 3.38Å; D890-T893 PolarHBondContact OD2-N 3.31Å; D890-T893 PolarHBondContact OD2-OG1 3.44Å; T893-L895 VanDerWaalsContact C-N 3.27Å; T893-L895 PolarHBondContact O-N 3.46Å; T893-A896 WeakPolarHBondContact O-CB 3.48Å; T893-A896 PolarHBondContact O-N 3.23Å; T893-A896 VanDerWaalsContact O-N 3.17Å; T893-L897 PolarHBondContact O-N 3.09Å
894	V	88.7	Confident	88.1	Confident	34 Å²	34	43.7 Å²	43.7	21%	0.206	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-33.3	171.1	172.3	0	0	0	0	112.1	L888 D890 A891 Q892 L897 S898	L888-V894 WeakPolarHBondContact O-CG2 3.24Å; D890-V894 WeakPolarHBondContact O-CG2 3.41Å; D890-V894 PolarHBondContact O-N 2.89Å; D890-V894 VanDerWaalsContact O-N 3.11Å; A891-V894 PolarHBondContact O-N 3.14Å; Q892-V894 VanDerWaalsContact C-N 3.34Å; Q892-V894 PolarHBondContact O-N 2.93Å; V894-L897 PolarHBondContact O-N 2.99Å; V894-S898 PolarHBondContact O-N 3.41Å; V894-S898 PolarHBondContact O-OG 2.97Å
895	L	90.4	Very high	88.7	Confident	71 Å²	71	35.2 Å²	35.2	37%	0.372	21%	0.213	S	C	.	.	H	α-helix	trans	-68.4	-41.1	173	-64.8	173.6	0	0	0	111.7	K843 A891 Q892 T893 L897 S898 E899	K843-L895 HydrophobicContact CD-CB 4.13Å; A891-L895 WeakPolarHBondContact O-CG 3.27Å; A891-L895 PolarHBondContact O-N 3.4Å; Q892-L895 WeakPolarHBondContact O-CB 3.28Å; Q892-L895 PolarHBondContact O-N 3.44Å; Q892-L895 VanDerWaalsContact O-N 3.11Å; T893-L895 VanDerWaalsContact C-N 3.27Å; T893-L895 PolarHBondContact O-N 3.46Å; L895-L897 VanDerWaalsContact C-N 3.34Å; L895-L897 PolarHBondContact O-N 2.91Å; L895-S898 WeakPolarHBondContact O-CB 2.99Å; L895-S898 PolarHBondContact O-N 3.36Å; L895-E899 PolarHBondContact O-N 3.06Å
896	A	91.6	Very high	89.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-42.6	173.8	0	0	0	0	0	111.6	Q842 K843 F886 Q892 T893 S898 E899 C900	Q842-A896 HydrophobicContact CB-CB 4.31Å; K843-A896 HydrophobicContact CB-CB 4.02Å; F886-A896 HydrophobicContact CE2-CB 4.19Å; F886-A896 HydrophobicContact CZ-CB 4.13Å; Q892-A896 PolarHBondContact O-N 3.24Å; Q892-A896 VanDerWaalsContact O-N 3.1Å; T893-A896 WeakPolarHBondContact O-CB 3.48Å; T893-A896 PolarHBondContact O-N 3.23Å; T893-A896 VanDerWaalsContact O-N 3.17Å; A896-S898 VanDerWaalsContact C-N 3.27Å; A896-S898 PolarHBondContact O-N 3.06Å; A896-E899 PolarHBondContact O-N 2.99Å; A896-E899 VanDerWaalsContact O-N 3.17Å; A896-C900 PolarHBondContact O-N 3.21Å
897	L	92.3	Very high	89.6	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-62	-36.3	175	-173.5	64.5	0	0	0	112.3	P881 F886 L888 T893 V894 L895 E899 C900 A901 L953 K954 F957	P881-L897 HydrophobicContact CB-CD1 4.03Å; P881-L897 HydrophobicContact CG-CD1 3.71Å; F886-L897 HydrophobicContact CE1-CB 4.07Å; F886-L897 HydrophobicContact CE1-CD1 4.42Å; F886-L897 HydrophobicContact CZ-CB 4.08Å; L888-L897 HydrophobicContact CD2-CD2 3.8Å; T893-L897 PolarHBondContact O-N 3.09Å; V894-L897 PolarHBondContact O-N 2.99Å; L895-L897 VanDerWaalsContact C-N 3.34Å; L895-L897 PolarHBondContact O-N 2.91Å; L897-E899 VanDerWaalsContact C-N 3.33Å; L897-E899 PolarHBondContact O-N 3.26Å; L897-C900 WeakPolarHBondContact O-CB 3.36Å; L897-C900 PolarHBondContact O-N 3.02Å; L897-A901 PolarHBondContact O-N 2.95Å; L897-L953 HydrophobicContact CD1-CD2 3.85Å; L897-L953 HydrophobicContact CD1-CG 4.12Å; L897-L953 HydrophobicContact CG-CD2 4.27Å; L897-K954 HydrophobicContact CD2-CB 4.16Å; L897-F957 HydrophobicContact CD1-CD2 3.7Å; L897-F957 HydrophobicContact CD1-CE2 3.86Å
898	S	92.6	Very high	90	Very high	29 Å²	29	29.4 Å²	29.4	20%	0.203	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-38.2	176.2	-63.9	0	0	0	0	112.1	V894 L895 A896 A901 V902 K950	V894-S898 PolarHBondContact O-N 3.41Å; V894-S898 PolarHBondContact O-OG 2.97Å; L895-S898 WeakPolarHBondContact O-CB 2.99Å; L895-S898 PolarHBondContact O-N 3.36Å; A896-S898 VanDerWaalsContact C-N 3.27Å; A896-S898 PolarHBondContact O-N 3.06Å; S898-A901 WeakPolarHBondContact O-CB 3.44Å; S898-A901 PolarHBondContact O-N 2.99Å; S898-V902 WeakPolarHBondContact O-CG2 3.45Å; S898-V902 PolarHBondContact O-N 3.2Å; S898-K950 WeakPolarHBondContact O-CE 3.45Å
899	E	93.4	Very high	90.3	Very high	44 Å²	44	34.9 Å²	34.9	21%	0.206	21%	0.207	C	C	.	.	H	α-helix	trans	-75.5	-32.8	175.5	-63.1	-54.4	150.8	0	0	112.4	K843 F846 I847 L895 A896 L897 A901 V902 T903	K843-E899 HydrophobicContact CG-CG 3.74Å; F846-E899 HydrophobicContact CB-CB 3.77Å; I847-E899 HydrophobicContact CD1-CG 4.21Å; I847-E899 HydrophobicContact CG1-CB 4.34Å; I847-E899 HydrophobicContact CG1-CG 3.82Å; L895-E899 PolarHBondContact O-N 3.06Å; A896-E899 PolarHBondContact O-N 2.99Å; A896-E899 VanDerWaalsContact O-N 3.17Å; L897-E899 VanDerWaalsContact C-N 3.33Å; L897-E899 PolarHBondContact O-N 3.26Å; E899-A901 VanDerWaalsContact C-N 3.3Å; E899-A901 PolarHBondContact O-N 3.33Å; E899-V902 PolarHBondContact O-N 3.23Å; E899-T903 PolarHBondContact O-N 3.1Å; E899-T903 PolarHBondContact O-OG1 3.09Å
900	C	93.6	Very high	90.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.7	-44.6	167.9	176.5	0	0	0	0	111.3	F846 C877 A896 L897 V902 T903 L904	F846-C900 HydrophobicContact CD1-CB 4.11Å; F846-C900 HydrophobicContact CD2-CB 4.14Å; F846-C900 HydrophobicContact CE1-CB 4.02Å; F846-C900 HydrophobicContact CE2-CB 4.05Å; F846-C900 HydrophobicContact CG-CB 4.19Å; F846-C900 HydrophobicContact CZ-CB 3.99Å; C877-C900 WeakPolarHBondContact CA-SG 3.13Å; C877-C900 VanDerWaalsContact CB-SG 3.51Å; C877-C900 PolarHBondContact O-SG 2.9Å; A896-C900 PolarHBondContact O-N 3.21Å; L897-C900 WeakPolarHBondContact O-CB 3.36Å; L897-C900 PolarHBondContact O-N 3.02Å; C900-V902 VanDerWaalsContact C-N 3.34Å; C900-V902 PolarHBondContact O-N 3.26Å; C900-T903 WeakPolarHBondContact O-CB 3.45Å; C900-T903 PolarHBondContact O-N 2.96Å; C900-L904 PolarHBondContact O-N 3.18Å; C900-L904 VanDerWaalsContact O-N 3.09Å
901	A	92.8	Very high	90.8	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-40.9	175.3	0	0	0	0	0	112.6	L897 S898 E899 T903 K905 F949 K950 L953	L897-A901 PolarHBondContact O-N 2.95Å; S898-A901 WeakPolarHBondContact O-CB 3.44Å; S898-A901 PolarHBondContact O-N 2.99Å; E899-A901 VanDerWaalsContact C-N 3.3Å; E899-A901 PolarHBondContact O-N 3.33Å; A901-T903 VanDerWaalsContact C-N 3.32Å; A901-K905 WeakPolarHBondContact O-CB 3.42Å; A901-K905 PolarHBondContact O-N 3.43Å; A901-F949 HydrophobicContact CB-CD1 3.88Å; A901-F949 HydrophobicContact CB-CE1 3.99Å; A901-F949 WeakPolarHBondContact O-CE1 3.31Å; A901-K950 HydrophobicContact CB-CG 3.79Å; A901-L953 HydrophobicContact CB-CD2 3.58Å
902	V	93.6	Very high	90.8	Very high	37 Å²	37	33 Å²	33	22%	0.224	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-40.1	175.6	174.2	0	0	0	0	110.8	S898 E899 C900 K905 T906 K950	S898-V902 WeakPolarHBondContact O-CG2 3.45Å; S898-V902 PolarHBondContact O-N 3.2Å; E899-V902 PolarHBondContact O-N 3.23Å; C900-V902 VanDerWaalsContact C-N 3.34Å; C900-V902 PolarHBondContact O-N 3.26Å; V902-K905 PolarHBondContact O-N 3.45Å; V902-T906 WeakPolarHBondContact O-CB 3.25Å; V902-T906 PolarHBondContact O-N 3.27Å; V902-T906 PolarHBondContact O-OG1 3.05Å; V902-K950 VanDerWaalsContact CG2-CE 3.45Å
903	T	93.9	Very high	90.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-52.6	177.9	-55.6	0	0	0	0	111.2	F846 L849 I873 E899 C900 A901 K905 T906 I907	F846-T903 PolarHBondContact O-OG1 2.99Å; F846-T903 VanDerWaalsContact O-OG1 3.13Å; L849-T903 HydrophobicContact CB-CG2 4.2Å; I873-T903 HydrophobicContact CG2-CG2 3.88Å; E899-T903 PolarHBondContact O-N 3.1Å; E899-T903 PolarHBondContact O-OG1 3.09Å; C900-T903 WeakPolarHBondContact O-CB 3.45Å; C900-T903 PolarHBondContact O-N 2.96Å; A901-T903 VanDerWaalsContact C-N 3.32Å; T903-K905 VanDerWaalsContact C-N 3.3Å; T903-K905 PolarHBondContact O-N 2.99Å; T903-T906 WeakPolarHBondContact O-CB 3.47Å; T903-T906 PolarHBondContact O-N 2.92Å; T903-T906 VanDerWaalsContact O-N 3.13Å; T903-I907 HydrophobicContact CG2-CD1 4.27Å; T903-I907 WeakPolarHBondContact O-CG1 3.16Å; T903-I907 PolarHBondContact O-N 3.02Å
904	L	92.8	Very high	90.8	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-42.8	176.2	-72.6	171.4	0	0	0	112.3	C877 F878 C900 T906 I907 H908 F937 L941 F949	C877-L904 HydrophobicContact CB-CD1 4.04Å; C877-L904 HydrophobicContact CB-CD2 3.76Å; C877-L904 HydrophobicContact CB-CG 3.82Å; F878-L904 HydrophobicContact CE2-CD2 4.14Å; F878-L904 HydrophobicContact CZ-CD1 4.44Å; C900-L904 PolarHBondContact O-N 3.18Å; C900-L904 VanDerWaalsContact O-N 3.09Å; L904-T906 VanDerWaalsContact C-N 3.34Å; L904-T906 PolarHBondContact O-N 3.13Å; L904-I907 PolarHBondContact O-N 3.18Å; L904-H908 PolarHBondContact O-N 3.4Å; L904-F937 HydrophobicContact CD1-CZ 4.03Å; L904-L941 HydrophobicContact CB-CD1 4.17Å; L904-F949 HydrophobicContact CB-CE1 4.13Å; L904-F949 HydrophobicContact CB-CZ 4.44Å; L904-F949 HydrophobicContact CD1-CE1 4.37Å; L904-F949 HydrophobicContact CD1-CZ 4.22Å
905	K	91.9	Very high	90.7	Very high	21 Å²	21	36.1 Å²	36.1	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-65.8	-38.1	177.9	-161.7	166	-164.7	167.3	0	112.3	A901 V902 T903 H908 L909 L941 Q943 P944 D945 A946	A901-K905 WeakPolarHBondContact O-CB 3.42Å; A901-K905 PolarHBondContact O-N 3.43Å; V902-K905 PolarHBondContact O-N 3.45Å; T903-K905 VanDerWaalsContact C-N 3.3Å; T903-K905 PolarHBondContact O-N 2.99Å; K905-H908 PolarHBondContact O-N 3.19Å; K905-L909 VanDerWaalsContact O-CG 3.29Å; K905-L909 WeakPolarHBondContact O-CG 3.34Å; K905-L909 PolarHBondContact O-N 3.25Å; K905-L941 HydrophobicContact CB-CD1 4.41Å; K905-Q943 VanDerWaalsContact CE-O 3.25Å; K905-Q943 WeakPolarHBondContact CE-O 3.38Å; K905-Q943 PolarHBondContact NZ-O 3.36Å; K905-P944 PolarHBondContact NZ-O 2.94Å; K905-D945 PolarHBondContact NZ-O 3.09Å; K905-A946 HydrophobicContact CD-CB 4.16Å; K905-A946 VanDerWaalsContact NZ-CA 3.34Å; K905-A946 VanDerWaalsContact NZ-N 3.13Å
906	T	91.3	Very high	90.7	Very high	19 Å²	19	33.2 Å²	33.2	12%	0.117	18%	0.177	C	C	.	.	H	α-helix	trans	-65.8	-40.7	176.7	-52.8	0	0	0	0	111.3	S850 V853 E854 V902 T903 L904 L909 K910	S850-T906 PolarHBondContact OG-OG1 3.47Å; S850-T906 VanDerWaalsContact OG-OG1 3.09Å; V853-T906 HydrophobicContact CB-CG2 4.4Å; V853-T906 HydrophobicContact CG1-CG2 4.09Å; E854-T906 HydrophobicContact CB-CG2 4.09Å; V902-T906 WeakPolarHBondContact O-CB 3.25Å; V902-T906 PolarHBondContact O-N 3.27Å; V902-T906 PolarHBondContact O-OG1 3.05Å; T903-T906 WeakPolarHBondContact O-CB 3.47Å; T903-T906 PolarHBondContact O-N 2.92Å; T903-T906 VanDerWaalsContact O-N 3.13Å; L904-T906 VanDerWaalsContact C-N 3.34Å; L904-T906 PolarHBondContact O-N 3.13Å; T906-L909 PolarHBondContact O-N 3.21Å; T906-K910 WeakPolarHBondContact O-CG 3.28Å; T906-K910 PolarHBondContact O-N 2.73Å
907	I	91.9	Very high	90.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.7	-47.9	173.4	-64	165.3	0	0	0	110	V853 V869 I873 V874 T903 L904 L909 K910 R911 C915	V853-I907 HydrophobicContact CB-CG1 4.4Å; V853-I907 HydrophobicContact CG1-CB 4.32Å; V853-I907 HydrophobicContact CG1-CG1 3.7Å; V853-I907 HydrophobicContact CG2-CG1 3.98Å; V869-I907 HydrophobicContact CG1-CD1 3.88Å; V869-I907 HydrophobicContact CG1-CG1 3.91Å; V869-I907 HydrophobicContact CG1-CG2 3.83Å; I873-I907 HydrophobicContact CG2-CD1 3.88Å; V874-I907 HydrophobicContact CG2-CD1 3.92Å; T903-I907 HydrophobicContact CG2-CD1 4.27Å; T903-I907 WeakPolarHBondContact O-CG1 3.16Å; T903-I907 PolarHBondContact O-N 3.02Å; L904-I907 PolarHBondContact O-N 3.18Å; I907-L909 PolarHBondContact O-N 3.29Å; I907-K910 PolarHBondContact O-N 3.31Å; I907-R911 HydrophobicContact CG2-CG 4.43Å; I907-R911 WeakPolarHBondContact O-CB 3.36Å; I907-R911 PolarHBondContact O-N 2.72Å; I907-C915 HydrophobicContact CG2-CB 4.24Å
908	H	91.1	Very high	90.4	Very high	33 Å²	33	40.2 Å²	40.2	15%	0.153	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-43.5	176.7	177.2	50.3	0	0	0	112.4	L904 K905 K910 G912 L941	L904-H908 PolarHBondContact O-N 3.4Å; K905-H908 PolarHBondContact O-N 3.19Å; H908-K910 VanDerWaalsContact C-N 3.3Å; H908-K910 PolarHBondContact O-N 3.03Å; H908-G912 PolarHBondContact ND1-O 3.32Å; H908-G912 WeakPolarHBondContact O-CA 3.32Å; H908-G912 PolarHBondContact O-N 3.36Å; H908-L941 HydrophobicContact CB-CD1 4.31Å; H908-L941 HydrophobicContact CB-CD2 4.21Å; H908-L941 HydrophobicContact CB-CG 4.15Å
909	L	89.6	Confident	90.3	Very high	132 Å²	132	38.9 Å²	38.9	69%	0.691	20%	0.199	S	C	*	.	H	α-helix	trans	-62.6	-34.5	178.2	-73.2	170.4	0	0	0	112.9	K905 T906 I907	K905-L909 VanDerWaalsContact O-CG 3.29Å; K905-L909 WeakPolarHBondContact O-CG 3.34Å; K905-L909 PolarHBondContact O-N 3.25Å; T906-L909 PolarHBondContact O-N 3.21Å; I907-L909 PolarHBondContact O-N 3.29Å
910	K	88.8	Confident	90	Very high	98 Å²	98	40.5 Å²	40.5	43%	0.426	21%	0.207	S	C	.	.	H	α-helix	trans	-87.4	-34.8	-176.9	-71.1	-79	166.2	162.3	0	113.7	E854 T906 I907 H908	E854-K910 WeakPolarHBondContact O-CE 3.49Å; E854-K910 PolarHBondContact O-NZ 3.41Å; T906-K910 WeakPolarHBondContact O-CG 3.28Å; T906-K910 PolarHBondContact O-N 2.73Å; I907-K910 PolarHBondContact O-N 3.31Å; H908-K910 VanDerWaalsContact C-N 3.3Å; H908-K910 PolarHBondContact O-N 3.03Å
911	R	87.6	Confident	89.6	Confident	57 Å²	57	46.4 Å²	46.4	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-101.7	-13.4	-178.2	-57.9	-59.2	-65.6	-153.1	-10.8	113.9	G857 Y870 I907 E914 C915	G857-R911 WeakPolarHBondContact O-CD 3.49Å; G857-R911 PolarHBondContact O-NH1 3.05Å; Y870-R911 WeakPolarHBondContact OH-CB 3.43Å; I907-R911 HydrophobicContact CG2-CG 4.43Å; I907-R911 WeakPolarHBondContact O-CB 3.36Å; I907-R911 PolarHBondContact O-N 2.72Å; R911-E914 IonicContact CZ-OE1 3.7Å; R911-E914 IonicContact CZ-OE2 3.18Å; R911-E914 IonicContact NE-OE1 2.91Å; R911-E914 IonicContact NE-OE2 3.45Å; R911-E914 PolarHBondContact NE-OE2 2.83Å; R911-E914 VanDerWaalsContact NH2-CD 3.25Å; R911-E914 IonicContact NH2-OE1 2.78Å; R911-E914 PolarHBondContact NH2-OE1 2.87Å; R911-E914 IonicContact NH2-OE2 2.87Å; R911-E914 PolarHBondContact NH2-OE2 3.04Å; R911-C915 HydrophobicContact CB-CB 4.2Å
912	G	85.7	Confident	89.4	Confident	21 Å²	21	52 Å²	52	22%	0.216	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	-128.1	176.7	0	0	0	0	0	113	H908 E914	H908-G912 PolarHBondContact ND1-O 3.32Å; H908-G912 WeakPolarHBondContact O-CA 3.32Å; H908-G912 PolarHBondContact O-N 3.36Å; G912-E914 VanDerWaalsContact C-N 3.3Å; G912-E914 PolarHBondContact O-N 3.17Å
913	P	84.8	Confident	89.1	Confident	108 Å²	108	51.2 Å²	51.2	70%	0.701	25%	0.253	S	S	*	.	H	α-helix	trans	-70.2	-23.2	-172.8	28.9	-34.7	0	0	0	113.8	C915 V916 Q917	P913-C915 VanDerWaalsContact C-N 3.31Å; P913-C915 PolarHBondContact O-N 3.12Å; P913-V916 PolarHBondContact O-N 3.06Å; P913-Q917 PolarHBondContact O-N 3.09Å
914	E	88.3	Confident	88.8	Confident	80 Å²	80	51.2 Å²	51.2	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-42.8	178	-173.1	-165.8	169.1	0	0	111.7	Y870 R911 G912 V916 Q917 Y918	Y870-E914 WeakPolarHBondContact CE2-OE1 3.4Å; Y870-E914 WeakPolarHBondContact OH-CG 3.46Å; R911-E914 IonicContact CZ-OE1 3.7Å; R911-E914 IonicContact CZ-OE2 3.18Å; R911-E914 IonicContact NE-OE1 2.91Å; R911-E914 IonicContact NE-OE2 3.45Å; R911-E914 PolarHBondContact NE-OE2 2.83Å; R911-E914 VanDerWaalsContact NH2-CD 3.25Å; R911-E914 IonicContact NH2-OE1 2.78Å; R911-E914 PolarHBondContact NH2-OE1 2.87Å; R911-E914 IonicContact NH2-OE2 2.87Å; R911-E914 PolarHBondContact NH2-OE2 3.04Å; G912-E914 VanDerWaalsContact C-N 3.3Å; G912-E914 PolarHBondContact O-N 3.17Å; E914-V916 VanDerWaalsContact C-N 3.34Å; E914-V916 PolarHBondContact O-N 3.24Å; E914-Q917 PolarHBondContact O-N 2.93Å; E914-Y918 PolarHBondContact O-N 2.71Å
915	C	88.1	Confident	88.6	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-39.8	178.8	170.1	0	0	0	0	112	Y870 I907 R911 P913 L919	Y870-C915 HydrophobicContact CE1-CB 4.41Å; Y870-C915 PolarHBondContact OH-N 2.98Å; I907-C915 HydrophobicContact CG2-CB 4.24Å; R911-C915 HydrophobicContact CB-CB 4.2Å; P913-C915 VanDerWaalsContact C-N 3.31Å; P913-C915 PolarHBondContact O-N 3.12Å; C915-L919 WeakPolarHBondContact O-CG 3.48Å; C915-L919 PolarHBondContact O-N 3.14Å
916	V	88.6	Confident	88.3	Confident	9 Å²	9	56.6 Å²	56.6	6%	0.055	29%	0.292	C	S	.	.	H	α-helix	trans	-68	-42.5	178.4	179.1	0	0	0	0	110.3	P913 E914 L919 Q920 C938 Q942	P913-V916 PolarHBondContact O-N 3.06Å; E914-V916 VanDerWaalsContact C-N 3.34Å; E914-V916 PolarHBondContact O-N 3.24Å; V916-L919 PolarHBondContact O-N 3.44Å; V916-Q920 HydrophobicContact CG1-CG 4.29Å; V916-Q920 WeakPolarHBondContact O-CB 3.38Å; V916-Q920 VanDerWaalsContact O-CG 3.28Å; V916-Q920 WeakPolarHBondContact O-CG 3.41Å; V916-Q920 PolarHBondContact O-N 3.19Å; V916-C938 HydrophobicContact CG1-CB 4.08Å; V916-Q942 HydrophobicContact CG2-CG 4.28Å
917	Q	88.9	Confident	88	Confident	107 Å²	107	58.6 Å²	58.6	50%	0.5	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-45.3	177.5	-171.9	177.6	-4.4	0	0	111.6	P913 E914 L919 Q920 Q921	P913-Q917 PolarHBondContact O-N 3.09Å; E914-Q917 PolarHBondContact O-N 2.93Å; Q917-L919 PolarHBondContact O-N 2.84Å; Q917-Q920 PolarHBondContact O-N 3.13Å; Q917-Q921 HydrophobicContact CG-CG 4.28Å; Q917-Q921 VanDerWaalsContact CG-OE1 3.3Å; Q917-Q921 WeakPolarHBondContact O-CB 3.49Å; Q917-Q921 WeakPolarHBondContact O-CG 3.29Å; Q917-Q921 PolarHBondContact O-N 3.35Å
918	Y	90.3	Very high	87.6	Confident	45 Å²	45	67.4 Å²	67.4	18%	0.176	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-44.9	176.5	178.5	-100.4	0	0	0	112.6	Y870 V874 E914 Q920 E922 Y923	Y870-Y918 AromaticContact CD1-CD1 3.44Å; Y870-Y918 HydrophobicContact CD1-CD1 3.44Å; Y870-Y918 VanDerWaalsContact CD1-CD1 3.44Å; Y870-Y918 HydrophobicContact CD1-CD2 4.28Å; Y870-Y918 AromaticContact CD1-CE1 3.78Å; Y870-Y918 HydrophobicContact CD1-CE1 3.78Å; Y870-Y918 AromaticContact CD1-CG 3.71Å; Y870-Y918 HydrophobicContact CD1-CG 3.71Å; Y870-Y918 AromaticContact CE1-CD1 3.97Å; Y870-Y918 HydrophobicContact CE1-CD1 3.97Å; Y870-Y918 HydrophobicContact CE1-CG 4.05Å; Y870-Y918 HydrophobicContact CG-CD1 4.35Å; Y870-Y918 HydrophobicContact CG-CE1 4.41Å; Y870-Y918 HydrophobicContact CG-CG 4.43Å; Y870-Y918 PolarHBondContact O-OH 3.13Å; V874-Y918 HydrophobicContact CB-CE1 4.49Å; V874-Y918 HydrophobicContact CG1-CE1 4.07Å; E914-Y918 PolarHBondContact O-N 2.71Å; Y918-Q920 PolarHBondContact O-N 3.49Å; Y918-E922 HydrophobicContact CD2-CB 3.99Å; Y918-E922 HydrophobicContact CD2-CG 4.32Å; Y918-E922 WeakPolarHBondContact CD2-OE2 3.21Å; Y918-E922 HydrophobicContact CE2-CB 3.97Å; Y918-E922 WeakPolarHBondContact CE2-OE2 3.3Å; Y918-E922 WeakPolarHBondContact O-CB 3.43Å; Y918-E922 PolarHBondContact O-N 3.32Å; Y918-Y923 HydrophobicContact CE1-CG 4.27Å; Y918-Y923 PolarHBondContact O-N 2.89Å
919	L	89.1	Confident	87.2	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.345	C	S	.	.	I	π-helix	trans	-64.5	-39.1	177.3	-72.8	171.8	0	0	0	112.3	V874 F878 C915 V916 Q917 Y923 L924 F937 L941	V874-L919 HydrophobicContact CG1-CD2 3.83Å; F878-L919 HydrophobicContact CE2-CD2 4.13Å; F878-L919 HydrophobicContact CZ-CD2 4.25Å; C915-L919 WeakPolarHBondContact O-CG 3.48Å; C915-L919 PolarHBondContact O-N 3.14Å; V916-L919 PolarHBondContact O-N 3.44Å; Q917-L919 PolarHBondContact O-N 2.84Å; L919-Y923 HydrophobicContact CD2-CD1 4.29Å; L919-L924 HydrophobicContact CB-CD1 4.27Å; L919-L924 HydrophobicContact CD2-CG 4.43Å; L919-L924 VanDerWaalsContact O-CB 3.31Å; L919-L924 WeakPolarHBondContact O-CB 3.36Å; L919-L924 WeakPolarHBondContact O-CG 3.47Å; L919-L924 PolarHBondContact O-N 3.32Å; L919-F937 HydrophobicContact CD1-CE1 4.34Å; L919-L941 HydrophobicContact CD1-CD2 3.73Å
920	Q	87.5	Confident	87.1	Confident	78 Å²	78	63 Å²	63	36%	0.364	33%	0.328	S	S	.	.	I	π-helix	trans	-75.4	-38.1	-178.4	-73.8	-178.9	-15.9	0	0	113.8	V916 Q917 Y918 P925 I934 C938	V916-Q920 HydrophobicContact CG1-CG 4.29Å; V916-Q920 WeakPolarHBondContact O-CB 3.38Å; V916-Q920 VanDerWaalsContact O-CG 3.28Å; V916-Q920 WeakPolarHBondContact O-CG 3.41Å; V916-Q920 PolarHBondContact O-N 3.19Å; Q917-Q920 PolarHBondContact O-N 3.13Å; Y918-Q920 PolarHBondContact O-N 3.49Å; Q920-P925 VanDerWaalsContact O-CG 3.24Å; Q920-P925 WeakPolarHBondContact O-CG 3.29Å; Q920-I934 HydrophobicContact CB-CG2 4.4Å; Q920-I934 HydrophobicContact CG-CG2 4.13Å; Q920-C938 HydrophobicContact CG-CB 4.33Å; Q920-C938 WeakPolarHBondContact CG-SG 3.28Å
921	Q	86.4	Confident	86.9	Confident	124 Å²	124	62.4 Å²	62.4	58%	0.579	33%	0.334	S	S	*	.	I	π-helix	trans	-102.8	-26.1	-168.6	-63	-178.4	-9.2	0	0	113.3	Q917	Q917-Q921 HydrophobicContact CG-CG 4.28Å; Q917-Q921 VanDerWaalsContact CG-OE1 3.3Å; Q917-Q921 WeakPolarHBondContact O-CB 3.49Å; Q917-Q921 WeakPolarHBondContact O-CG 3.29Å; Q917-Q921 PolarHBondContact O-N 3.35Å
922	E	87.3	Confident	86.8	Confident	121 Å²	121	66.1 Å²	66.1	57%	0.565	35%	0.354	S	S	*	.	I	π-helix	trans	-120.3	-62.1	-172.1	-61.3	-174.1	-159.5	0	0	112.6	Y918 S926	Y918-E922 HydrophobicContact CD2-CB 3.99Å; Y918-E922 HydrophobicContact CD2-CG 4.32Å; Y918-E922 WeakPolarHBondContact CD2-OE2 3.21Å; Y918-E922 HydrophobicContact CE2-CB 3.97Å; Y918-E922 WeakPolarHBondContact CE2-OE2 3.3Å; Y918-E922 WeakPolarHBondContact O-CB 3.43Å; Y918-E922 PolarHBondContact O-N 3.32Å; E922-S926 PolarHBondContact O-N 3.35Å
923	Y	87.9	Confident	86.7	Confident	19 Å²	19	68.4 Å²	68.4	8%	0.075	36%	0.36	C	S	.	.	I	π-helix	trans	-78.2	-55.1	-165.2	-171.5	-102.6	0	0	0	114.7	V874 P875 F878 Y918 L919 S926 L927	V874-Y923 HydrophobicContact CG1-CD1 4.14Å; V874-Y923 HydrophobicContact CG1-CG 4.36Å; P875-Y923 VanDerWaalsContact CA-OH 3.28Å; P875-Y923 WeakPolarHBondContact CA-OH 3.42Å; P875-Y923 HydrophobicContact CB-CE2 3.84Å; P875-Y923 HydrophobicContact CG-CD2 4.25Å; P875-Y923 HydrophobicContact CG-CE2 3.63Å; F878-Y923 HydrophobicContact CB-CE1 4.04Å; F878-Y923 HydrophobicContact CD2-CD1 4.05Å; F878-Y923 AromaticContact CD2-CE1 3.33Å; F878-Y923 HydrophobicContact CD2-CE1 3.33Å; F878-Y923 HydrophobicContact CE2-CD1 4.1Å; F878-Y923 AromaticContact CE2-CE1 3.85Å; F878-Y923 HydrophobicContact CE2-CE1 3.85Å; F878-Y923 AromaticContact CG-CE1 3.75Å; F878-Y923 HydrophobicContact CG-CE1 3.75Å; Y918-Y923 HydrophobicContact CE1-CG 4.27Å; Y918-Y923 PolarHBondContact O-N 2.89Å; L919-Y923 HydrophobicContact CD2-CD1 4.29Å; Y923-S926 WeakPolarHBondContact O-CB 3.35Å; Y923-S926 PolarHBondContact O-N 3.14Å; Y923-S926 VanDerWaalsContact O-N 3.08Å; Y923-S926 PolarHBondContact O-OG 3.5Å; Y923-L927 HydrophobicContact CD1-CD1 4.34Å; Y923-L927 HydrophobicContact CE1-CD1 3.63Å; Y923-L927 HydrophobicContact CE1-CG 4.38Å; Y923-L927 PolarHBondContact O-N 3.41Å
924	L	87.3	Confident	86.8	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-35.7	-179.2	-63.1	172	0	0	0	113.6	F878 L919 S926 L927 V929 I934 F937	F878-L924 HydrophobicContact CD1-CD2 4.24Å; F878-L924 HydrophobicContact CE1-CD2 3.6Å; F878-L924 HydrophobicContact CZ-CD2 3.8Å; L919-L924 HydrophobicContact CB-CD1 4.27Å; L919-L924 HydrophobicContact CD2-CG 4.43Å; L919-L924 VanDerWaalsContact O-CB 3.31Å; L919-L924 WeakPolarHBondContact O-CB 3.36Å; L919-L924 WeakPolarHBondContact O-CG 3.47Å; L919-L924 PolarHBondContact O-N 3.32Å; L924-S926 VanDerWaalsContact C-N 3.26Å; L924-S926 PolarHBondContact O-N 3.3Å; L924-L927 PolarHBondContact O-N 2.95Å; L924-L927 VanDerWaalsContact O-N 3.13Å; L924-V929 PolarHBondContact O-N 2.92Å; L924-I934 HydrophobicContact CB-CD1 3.77Å; L924-I934 HydrophobicContact CB-CG1 3.74Å; L924-I934 HydrophobicContact CB-CG2 4.39Å; L924-I934 HydrophobicContact CD1-CB 4.4Å; L924-I934 HydrophobicContact CD1-CG1 4.21Å; L924-I934 HydrophobicContact CD1-CG2 4.01Å; L924-F937 HydrophobicContact CD1-CD1 4.09Å; L924-F937 HydrophobicContact CD1-CG 4.42Å
925	P	87.9	Confident	86.7	Confident	56 Å²	56	65.5 Å²	65.5	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-59.4	-35.2	169.7	-26.1	35.9	0	0	0	113.2	Q920 L927 Q928 I934	Q920-P925 VanDerWaalsContact O-CG 3.24Å; Q920-P925 WeakPolarHBondContact O-CG 3.29Å; P925-L927 PolarHBondContact O-N 3.46Å; P925-Q928 PolarHBondContact O-N 3.29Å; P925-I934 HydrophobicContact CG-CD1 4Å
926	S	87.1	Confident	86.7	Confident	79 Å²	79	69.3 Å²	69.3	55%	0.552	36%	0.356	S	S	*	.	H	α-helix	trans	-65.5	-23.7	176.6	80.8	0	0	0	0	113.4	E922 Y923 L924 Q928	E922-S926 PolarHBondContact O-N 3.35Å; Y923-S926 WeakPolarHBondContact O-CB 3.35Å; Y923-S926 PolarHBondContact O-N 3.14Å; Y923-S926 VanDerWaalsContact O-N 3.08Å; Y923-S926 PolarHBondContact O-OG 3.5Å; L924-S926 VanDerWaalsContact C-N 3.26Å; L924-S926 PolarHBondContact O-N 3.3Å; S926-Q928 VanDerWaalsContact C-N 3.32Å
927	L	83.1	Confident	86.8	Confident	62 Å²	62	68.9 Å²	68.9	33%	0.325	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	7.5	174.5	-63.4	179	0	0	0	113.3	F878 Y923 L924 P925 V929	F878-L927 HydrophobicContact CB-CD1 4.19Å; F878-L927 HydrophobicContact CD1-CD1 4.49Å; F878-L927 HydrophobicContact CG-CD1 4.4Å; Y923-L927 HydrophobicContact CD1-CD1 4.34Å; Y923-L927 HydrophobicContact CE1-CD1 3.63Å; Y923-L927 HydrophobicContact CE1-CG 4.38Å; Y923-L927 PolarHBondContact O-N 3.41Å; L924-L927 PolarHBondContact O-N 2.95Å; L924-L927 VanDerWaalsContact O-N 3.13Å; P925-L927 PolarHBondContact O-N 3.46Å; L927-V929 VanDerWaalsContact C-N 3.25Å; L927-V929 HydrophobicContact CB-CG2 4.05Å; L927-V929 PolarHBondContact O-N 3.42Å
928	Q	83.7	Confident	86.8	Confident	184 Å²	184	63.9 Å²	63.9	86%	0.86	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	28.6	-178.6	-54.7	-179.3	-5.4	0	0	114.4	P925 S926	P925-Q928 PolarHBondContact O-N 3.29Å; S926-Q928 VanDerWaalsContact C-N 3.32Å
929	V	84.1	Confident	86.7	Confident	33 Å²	33	67.2 Å²	67.2	20%	0.2	35%	0.347	C	S	.	.			trans	-74.6	137.4	176.1	-175.8	0	0	0	0	110.2	L924 L927 I933 I934	L924-V929 PolarHBondContact O-N 2.92Å; L927-V929 VanDerWaalsContact C-N 3.25Å; L927-V929 HydrophobicContact CB-CG2 4.05Å; L927-V929 PolarHBondContact O-N 3.42Å; V929-I933 HydrophobicContact CG1-CB 3.86Å; V929-I933 HydrophobicContact CG1-CG2 3.73Å; V929-I934 HydrophobicContact CB-CD1 4.22Å; V929-I934 HydrophobicContact CB-CG1 3.92Å; V929-I934 HydrophobicContact CG1-CG1 3.78Å; V929-I934 WeakPolarHBondContact O-CD1 3.26Å
930	A	86.6	Confident	86.7	Confident	40 Å²	40	67.8 Å²	67.8	33%	0.331	35%	0.352	S	S	.	.			trans	-62	141.1	179.8	0	0	0	0	0	112.2	E932 I933 I934	A930-E932 PolarHBondContact O-N 3.34Å; A930-E932 VanDerWaalsContact O-N 3.13Å; A930-I933 HydrophobicContact CB-CD1 4.15Å; A930-I933 HydrophobicContact CB-CG1 4.3Å; A930-I933 PolarHBondContact O-N 3.31Å; A930-I934 WeakPolarHBondContact O-CG1 3.11Å; A930-I934 PolarHBondContact O-N 3.08Å
931	P	83.9	Confident	86.8	Confident	85 Å²	85	64.1 Å²	64.1	55%	0.552	34%	0.335	S	S	*	.	H	α-helix	trans	-54.7	-34	-176.9	-26.8	35	0	0	0	114.6	I934 Q935	P931-I934 PolarHBondContact O-N 2.93Å; P931-Q935 WeakPolarHBondContact O-CG 3.35Å; P931-Q935 PolarHBondContact O-N 3.04Å
932	E	85.7	Confident	86.8	Confident	136 Å²	136	63.1 Å²	63.1	64%	0.636	33%	0.33	S	S	*	.	H	α-helix	trans	-66.4	-41.6	178.6	-59.7	74.4	-160.7	0	0	111.3	A930 Q935 E936	A930-E932 PolarHBondContact O-N 3.34Å; A930-E932 VanDerWaalsContact O-N 3.13Å; E932-Q935 PolarHBondContact O-N 2.91Å; E932-E936 PolarHBondContact O-N 2.78Å
933	I	85.1	Confident	86.8	Confident	68 Å²	68	62.3 Å²	62.3	35%	0.349	33%	0.326	S	S	.	.	H	α-helix	trans	-71.6	-36.9	178.3	-59.9	175.8	0	0	0	110.1	V929 A930 Q935 E936 F937 F956	V929-I933 HydrophobicContact CG1-CB 3.86Å; V929-I933 HydrophobicContact CG1-CG2 3.73Å; A930-I933 HydrophobicContact CB-CD1 4.15Å; A930-I933 HydrophobicContact CB-CG1 4.3Å; A930-I933 PolarHBondContact O-N 3.31Å; I933-Q935 VanDerWaalsContact C-N 3.33Å; I933-Q935 PolarHBondContact O-N 3.3Å; I933-E936 PolarHBondContact O-N 3.22Å; I933-F937 WeakPolarHBondContact O-CB 3.39Å; I933-F937 PolarHBondContact O-N 3.47Å; I933-F956 HydrophobicContact CG2-CD2 4.11Å; I933-F956 HydrophobicContact CG2-CE2 3.64Å
934	I	86.8	Confident	86.3	Confident	13 Å²	13	67 Å²	67	7%	0.067	36%	0.359	C	S	.	.	H	α-helix	trans	-60	-45	173.7	-66.1	178.3	0	0	0	110.5	Q920 L924 P925 V929 A930 P931 F937 C938	Q920-I934 HydrophobicContact CB-CG2 4.4Å; Q920-I934 HydrophobicContact CG-CG2 4.13Å; L924-I934 HydrophobicContact CB-CD1 3.77Å; L924-I934 HydrophobicContact CB-CG1 3.74Å; L924-I934 HydrophobicContact CB-CG2 4.39Å; L924-I934 HydrophobicContact CD1-CB 4.4Å; L924-I934 HydrophobicContact CD1-CG1 4.21Å; L924-I934 HydrophobicContact CD1-CG2 4.01Å; P925-I934 HydrophobicContact CG-CD1 4Å; V929-I934 HydrophobicContact CB-CD1 4.22Å; V929-I934 HydrophobicContact CB-CG1 3.92Å; V929-I934 HydrophobicContact CG1-CG1 3.78Å; V929-I934 WeakPolarHBondContact O-CD1 3.26Å; A930-I934 WeakPolarHBondContact O-CG1 3.11Å; A930-I934 PolarHBondContact O-N 3.08Å; P931-I934 PolarHBondContact O-N 2.93Å; I934-F937 PolarHBondContact O-N 2.98Å; I934-C938 PolarHBondContact O-N 2.95Å; I934-C938 PolarHBondContact O-SG 3.26Å; I934-C938 VanDerWaalsContact O-SG 3.36Å
935	Q	86	Confident	86	Confident	115 Å²	115	70.8 Å²	70.8	54%	0.537	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-44.7	176.8	-73.2	-176.6	11.9	0	0	112	P931 E932 I933 F937 C938 Q939	P931-Q935 WeakPolarHBondContact O-CG 3.35Å; P931-Q935 PolarHBondContact O-N 3.04Å; E932-Q935 PolarHBondContact O-N 2.91Å; I933-Q935 VanDerWaalsContact C-N 3.33Å; I933-Q935 PolarHBondContact O-N 3.3Å; Q935-F937 VanDerWaalsContact C-N 3.35Å; Q935-F937 PolarHBondContact O-N 3.36Å; Q935-C938 PolarHBondContact O-N 3.38Å; Q935-Q939 WeakPolarHBondContact O-CB 3.45Å; Q935-Q939 VanDerWaalsContact O-CG 3.26Å; Q935-Q939 WeakPolarHBondContact O-CG 3.32Å; Q935-Q939 PolarHBondContact O-N 3.06Å
936	E	88.5	Confident	85.7	Confident	81 Å²	81	70.1 Å²	70.1	38%	0.379	38%	0.378	S	S	.	.	H	α-helix	trans	-58.8	-45	176.3	-169	-172.8	-177.5	0	0	111.6	E932 I933 Q939 A940 Y952	E932-E936 PolarHBondContact O-N 2.78Å; I933-E936 PolarHBondContact O-N 3.22Å; E936-Q939 PolarHBondContact O-N 3.29Å; E936-A940 WeakPolarHBondContact O-CB 3.39Å; E936-A940 PolarHBondContact O-N 3.23Å; E936-Y952 HydrophobicContact CG-CE2 3.83Å; E936-Y952 WeakPolarHBondContact OE1-CE2 3.18Å
937	F	90	Very high	85.6	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-47.7	178.3	-175.4	-81.8	0	0	0	111.8	F878 L904 L919 L924 I933 I934 Q935 Q939 A940 L941 F949 Y952 L953 F956	F878-F937 HydrophobicContact CE1-CE1 4.42Å; F878-F937 AromaticContact CE1-CE2 3.94Å; F878-F937 HydrophobicContact CE1-CE2 3.94Å; F878-F937 AromaticContact CE1-CZ 3.74Å; F878-F937 HydrophobicContact CE1-CZ 3.74Å; F878-F937 AromaticContact CZ-CE1 3.93Å; F878-F937 HydrophobicContact CZ-CE1 3.93Å; F878-F937 HydrophobicContact CZ-CE2 4.21Å; F878-F937 AromaticContact CZ-CZ 3.53Å; F878-F937 HydrophobicContact CZ-CZ 3.53Å; L904-F937 HydrophobicContact CD1-CZ 4.03Å; L919-F937 HydrophobicContact CD1-CE1 4.34Å; L924-F937 HydrophobicContact CD1-CD1 4.09Å; L924-F937 HydrophobicContact CD1-CG 4.42Å; I933-F937 WeakPolarHBondContact O-CB 3.39Å; I933-F937 PolarHBondContact O-N 3.47Å; I934-F937 PolarHBondContact O-N 2.98Å; Q935-F937 VanDerWaalsContact C-N 3.35Å; Q935-F937 PolarHBondContact O-N 3.36Å; F937-Q939 VanDerWaalsContact C-N 3.34Å; F937-Q939 PolarHBondContact O-N 3.02Å; F937-A940 PolarHBondContact O-N 3.16Å; F937-L941 WeakPolarHBondContact O-CB 3.45Å; F937-L941 PolarHBondContact O-N 3.36Å; F937-F949 HydrophobicContact CE1-CZ 4.42Å; F937-F949 HydrophobicContact CE2-CZ 4.47Å; F937-F949 HydrophobicContact CZ-CE2 4.33Å; F937-F949 AromaticContact CZ-CZ 4Å; F937-F949 HydrophobicContact CZ-CZ 4Å; F937-Y952 HydrophobicContact CB-CE1 4.21Å; F937-Y952 AromaticContact CD2-CE1 3.79Å; F937-Y952 HydrophobicContact CD2-CE1 3.79Å; F937-Y952 HydrophobicContact CG-CE1 4.3Å; F937-Y952 PolarHBondContact N-OH 3.25Å; F937-L953 HydrophobicContact CE2-CD1 3.63Å; F937-L953 HydrophobicContact CZ-CD1 4.16Å; F937-F956 HydrophobicContact CD2-CD1 4.46Å; F937-F956 HydrophobicContact CD2-CD2 4.01Å; F937-F956 HydrophobicContact CD2-CE1 4.44Å; F937-F956 AromaticContact CD2-CE2 3.98Å; F937-F956 HydrophobicContact CD2-CE2 3.98Å; F937-F956 HydrophobicContact CD2-CG 4.27Å; F937-F956 HydrophobicContact CD2-CZ 4.2Å; F937-F956 HydrophobicContact CE2-CD1 4.38Å; F937-F956 HydrophobicContact CE2-CE1 4.37Å
938	C	88.9	Confident	85.8	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.007	39%	0.388	C	S	.	.	H	α-helix	trans	-64.9	-37.2	178.3	-71	0	0	0	0	112.4	V916 Q920 I934 Q935 L941 Q942	V916-C938 HydrophobicContact CG1-CB 4.08Å; Q920-C938 HydrophobicContact CG-CB 4.33Å; Q920-C938 WeakPolarHBondContact CG-SG 3.28Å; I934-C938 PolarHBondContact O-N 2.95Å; I934-C938 PolarHBondContact O-SG 3.26Å; I934-C938 VanDerWaalsContact O-SG 3.36Å; Q935-C938 PolarHBondContact O-N 3.38Å; C938-L941 PolarHBondContact O-N 3.23Å; C938-Q942 VanDerWaalsContact O-CG 3.29Å; C938-Q942 WeakPolarHBondContact O-CG 3.41Å; C938-Q942 PolarHBondContact O-N 3.09Å; C938-Q942 VanDerWaalsContact O-N 3.14Å
939	Q	88.2	Confident	86.1	Confident	116 Å²	116	65.1 Å²	65.1	54%	0.542	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-43.8	173.8	-73.9	174.7	13.3	0	0	111.4	Q935 E936 F937 L941 Q942 Q943	Q935-Q939 WeakPolarHBondContact O-CB 3.45Å; Q935-Q939 VanDerWaalsContact O-CG 3.26Å; Q935-Q939 WeakPolarHBondContact O-CG 3.32Å; Q935-Q939 PolarHBondContact O-N 3.06Å; E936-Q939 PolarHBondContact O-N 3.29Å; F937-Q939 VanDerWaalsContact C-N 3.34Å; F937-Q939 PolarHBondContact O-N 3.02Å; Q939-L941 VanDerWaalsContact C-N 3.33Å; Q939-L941 PolarHBondContact O-N 3.44Å; Q939-Q942 PolarHBondContact O-N 2.96Å; Q939-Q943 PolarHBondContact O-N 3.4Å
940	A	87.9	Confident	86.4	Confident	12 Å²	12	66.6 Å²	66.6	10%	0.099	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-36.4	177	0	0	0	0	0	112.4	E936 F937 Q943 F949 Y952	E936-A940 WeakPolarHBondContact O-CB 3.39Å; E936-A940 PolarHBondContact O-N 3.23Å; F937-A940 PolarHBondContact O-N 3.16Å; A940-Q943 WeakPolarHBondContact O-CB 3.37Å; A940-Q943 PolarHBondContact O-N 2.96Å; A940-F949 HydrophobicContact CB-CD2 4.02Å; A940-F949 HydrophobicContact CB-CE2 4.44Å; A940-F949 WeakPolarHBondContact O-CD2 3.21Å; A940-Y952 HydrophobicContact CB-CD1 3.62Å; A940-Y952 HydrophobicContact CB-CD2 4.24Å; A940-Y952 HydrophobicContact CB-CE1 3.92Å; A940-Y952 HydrophobicContact CB-CG 3.8Å
941	L	89.8	Confident	86.5	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-66.8	-35.6	176.4	-179.3	62.7	0	0	0	112.7	L904 K905 H908 L919 F937 C938 Q939 Q943 F949	L904-L941 HydrophobicContact CB-CD1 4.17Å; K905-L941 HydrophobicContact CB-CD1 4.41Å; H908-L941 HydrophobicContact CB-CD1 4.31Å; H908-L941 HydrophobicContact CB-CD2 4.21Å; H908-L941 HydrophobicContact CB-CG 4.15Å; L919-L941 HydrophobicContact CD1-CD2 3.73Å; F937-L941 WeakPolarHBondContact O-CB 3.45Å; F937-L941 PolarHBondContact O-N 3.36Å; C938-L941 PolarHBondContact O-N 3.23Å; Q939-L941 VanDerWaalsContact C-N 3.33Å; Q939-L941 PolarHBondContact O-N 3.44Å; L941-Q943 VanDerWaalsContact C-N 3.31Å; L941-Q943 PolarHBondContact O-N 3.07Å; L941-F949 HydrophobicContact CB-CD2 4.38Å; L941-F949 HydrophobicContact CB-CE2 3.87Å; L941-F949 HydrophobicContact CB-CZ 4.22Å; L941-F949 HydrophobicContact CD1-CD1 4.33Å; L941-F949 HydrophobicContact CD1-CE1 3.75Å; L941-F949 HydrophobicContact CD1-CE2 4.1Å; L941-F949 HydrophobicContact CD1-CZ 3.63Å; L941-F949 HydrophobicContact CG-CZ 4.49Å
942	Q	87.8	Confident	86.8	Confident	103 Å²	103	66.9 Å²	66.9	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-74.7	-16.8	178.9	-73.5	174.4	-24.1	0	0	113.6	V916 C938 Q939	V916-Q942 HydrophobicContact CG2-CG 4.28Å; C938-Q942 VanDerWaalsContact O-CG 3.29Å; C938-Q942 WeakPolarHBondContact O-CG 3.41Å; C938-Q942 PolarHBondContact O-N 3.09Å; C938-Q942 VanDerWaalsContact O-N 3.14Å; Q939-Q942 PolarHBondContact O-N 2.96Å
943	Q	87	Confident	87	Confident	103 Å²	103	60.4 Å²	60.4	48%	0.481	31%	0.309	S	S	.	.	S	Bend	trans	-62.6	138.7	177.5	-71.5	-72.8	-18.1	0	0	111.2	K905 Q939 A940 L941 D945	K905-Q943 VanDerWaalsContact CE-O 3.25Å; K905-Q943 WeakPolarHBondContact CE-O 3.38Å; K905-Q943 PolarHBondContact NZ-O 3.36Å; Q939-Q943 PolarHBondContact O-N 3.4Å; A940-Q943 WeakPolarHBondContact O-CB 3.37Å; A940-Q943 PolarHBondContact O-N 2.96Å; L941-Q943 VanDerWaalsContact C-N 3.31Å; L941-Q943 PolarHBondContact O-N 3.07Å; Q943-D945 VanDerWaalsContact C-N 3.35Å; Q943-D945 PolarHBondContact O-N 3.1Å
944	P	76.3	Confident	87.1	Confident	117 Å²	117	60.6 Å²	60.6	76%	0.76	31%	0.308	S	S	*	.	S	Bend	trans	-68.6	-30.8	-178.6	25.7	-32.8	0	0	0	112.9	K905 A946	K905-P944 PolarHBondContact NZ-O 2.94Å; P944-A946 PolarHBondContact O-N 3.39Å
945	D	82	Confident	87.1	Confident	82 Å²	82	62.6 Å²	62.6	44%	0.439	32%	0.321	S	S	.	.			trans	-74.2	116.3	-179.4	-170.4	-11	0	0	0	112	K905 Q943 K947 V948	K905-D945 PolarHBondContact NZ-O 3.09Å; Q943-D945 VanDerWaalsContact C-N 3.35Å; Q943-D945 PolarHBondContact O-N 3.1Å; D945-K947 VanDerWaalsContact C-N 3.31Å; D945-K947 VanDerWaalsContact OD1-CB 3.27Å; D945-K947 WeakPolarHBondContact OD1-CB 3.33Å; D945-K947 PolarHBondContact OD1-N 3.29Å; D945-V948 HydrophobicContact CB-CB 4.2Å; D945-V948 HydrophobicContact CB-CG2 3.85Å; D945-V948 WeakPolarHBondContact OD2-CG2 3.47Å
946	A	81.8	Confident	87.2	Confident	42 Å²	42	58.2 Å²	58.2	35%	0.347	30%	0.3	S	S	.	.	H	α-helix	trans	-70.6	-26.2	178	0	0	0	0	0	112.8	K905 P944 K950	K905-A946 HydrophobicContact CD-CB 4.16Å; K905-A946 VanDerWaalsContact NZ-CA 3.34Å; K905-A946 VanDerWaalsContact NZ-N 3.13Å; P944-A946 PolarHBondContact O-N 3.39Å; A946-K950 VanDerWaalsContact O-CG 3.27Å; A946-K950 WeakPolarHBondContact O-CG 2.91Å; A946-K950 PolarHBondContact O-N 3.44Å
947	K	85.5	Confident	87.2	Confident	148 Å²	148	54.4 Å²	54.4	64%	0.643	28%	0.282	S	S	*	.	H	α-helix	trans	-70.7	-39.5	179.2	-167.9	177.3	-178.2	-179.7	0	111.3	D945 K950 N951	D945-K947 VanDerWaalsContact C-N 3.31Å; D945-K947 VanDerWaalsContact OD1-CB 3.27Å; D945-K947 WeakPolarHBondContact OD1-CB 3.33Å; D945-K947 PolarHBondContact OD1-N 3.29Å; K947-K950 PolarHBondContact O-N 3.48Å; K947-N951 PolarHBondContact O-N 2.9Å
948	V	87.1	Confident	86.9	Confident	71 Å²	71	59 Å²	59	43%	0.43	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-48	175.1	174	0	0	0	0	110.4	D945 K950 N951 Y952	D945-V948 HydrophobicContact CB-CB 4.2Å; D945-V948 HydrophobicContact CB-CG2 3.85Å; D945-V948 WeakPolarHBondContact OD2-CG2 3.47Å; V948-K950 PolarHBondContact O-N 3.3Å; V948-N951 PolarHBondContact O-N 2.82Å; V948-Y952 WeakPolarHBondContact O-CB 3.48Å; V948-Y952 PolarHBondContact O-N 2.86Å
949	F	90.3	Very high	86.5	Confident	1 Å²	1	67.8 Å²	67.8	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-39	179	-173.6	-117	0	0	0	112.9	A901 L904 F937 A940 L941 N951 Y952 L953	A901-F949 HydrophobicContact CB-CD1 3.88Å; A901-F949 HydrophobicContact CB-CE1 3.99Å; A901-F949 WeakPolarHBondContact O-CE1 3.31Å; L904-F949 HydrophobicContact CB-CE1 4.13Å; L904-F949 HydrophobicContact CB-CZ 4.44Å; L904-F949 HydrophobicContact CD1-CE1 4.37Å; L904-F949 HydrophobicContact CD1-CZ 4.22Å; F937-F949 HydrophobicContact CE1-CZ 4.42Å; F937-F949 HydrophobicContact CE2-CZ 4.47Å; F937-F949 HydrophobicContact CZ-CE2 4.33Å; F937-F949 AromaticContact CZ-CZ 4Å; F937-F949 HydrophobicContact CZ-CZ 4Å; A940-F949 HydrophobicContact CB-CD2 4.02Å; A940-F949 HydrophobicContact CB-CE2 4.44Å; A940-F949 WeakPolarHBondContact O-CD2 3.21Å; L941-F949 HydrophobicContact CB-CD2 4.38Å; L941-F949 HydrophobicContact CB-CE2 3.87Å; L941-F949 HydrophobicContact CB-CZ 4.22Å; L941-F949 HydrophobicContact CD1-CD1 4.33Å; L941-F949 HydrophobicContact CD1-CE1 3.75Å; L941-F949 HydrophobicContact CD1-CE2 4.1Å; L941-F949 HydrophobicContact CD1-CZ 3.63Å; L941-F949 HydrophobicContact CG-CZ 4.49Å; F949-N951 PolarHBondContact O-N 3.18Å; F949-Y952 HydrophobicContact CD2-CD1 4.43Å; F949-Y952 HydrophobicContact CE2-CD1 4.42Å; F949-Y952 PolarHBondContact O-N 2.9Å; F949-L953 HydrophobicContact CZ-CD1 4.43Å; F949-L953 WeakPolarHBondContact O-CB 3.2Å; F949-L953 PolarHBondContact O-N 3.05Å
950	K	89.9	Confident	86	Confident	63 Å²	63	64.6 Å²	64.6	27%	0.274	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-46.6	174.4	-76.5	174.9	-179.4	-165.7	0	112.3	S898 A901 V902 A946 K947 V948 L953 K954	S898-K950 WeakPolarHBondContact O-CE 3.45Å; A901-K950 HydrophobicContact CB-CG 3.79Å; V902-K950 VanDerWaalsContact CG2-CE 3.45Å; A946-K950 VanDerWaalsContact O-CG 3.27Å; A946-K950 WeakPolarHBondContact O-CG 2.91Å; A946-K950 PolarHBondContact O-N 3.44Å; K947-K950 PolarHBondContact O-N 3.48Å; V948-K950 PolarHBondContact O-N 3.3Å; K950-L953 PolarHBondContact O-N 3.49Å; K950-K954 PolarHBondContact O-N 2.98Å
951	N	87.4	Confident	85.1	Confident	98 Å²	98	66.5 Å²	66.5	52%	0.524	34%	0.336	S	S	.	.	H	α-helix	trans	-65.4	-42.9	178.1	-72.1	-12.7	0	0	0	111.5	K947 V948 F949 K954 V955	K947-N951 PolarHBondContact O-N 2.9Å; V948-N951 PolarHBondContact O-N 2.82Å; F949-N951 PolarHBondContact O-N 3.18Å; N951-K954 PolarHBondContact O-N 2.74Å; N951-V955 PolarHBondContact O-N 3.43Å
952	Y	90.8	Very high	83.3	Confident	33 Å²	33	76 Å²	76	13%	0.129	40%	0.398	C	S	.	.	H	α-helix	trans	-59.4	-46.4	175.7	176.6	-96	0	0	0	111.5	E936 F937 A940 V948 F949 K954 V955 F956	E936-Y952 HydrophobicContact CG-CE2 3.83Å; E936-Y952 WeakPolarHBondContact OE1-CE2 3.18Å; F937-Y952 HydrophobicContact CB-CE1 4.21Å; F937-Y952 AromaticContact CD2-CE1 3.79Å; F937-Y952 HydrophobicContact CD2-CE1 3.79Å; F937-Y952 HydrophobicContact CG-CE1 4.3Å; F937-Y952 PolarHBondContact N-OH 3.25Å; A940-Y952 HydrophobicContact CB-CD1 3.62Å; A940-Y952 HydrophobicContact CB-CD2 4.24Å; A940-Y952 HydrophobicContact CB-CE1 3.92Å; A940-Y952 HydrophobicContact CB-CG 3.8Å; V948-Y952 WeakPolarHBondContact O-CB 3.48Å; V948-Y952 PolarHBondContact O-N 2.86Å; F949-Y952 HydrophobicContact CD2-CD1 4.43Å; F949-Y952 HydrophobicContact CE2-CD1 4.42Å; F949-Y952 PolarHBondContact O-N 2.9Å; Y952-K954 VanDerWaalsContact C-N 3.28Å; Y952-K954 PolarHBondContact O-N 3.45Å; Y952-V955 PolarHBondContact O-N 3.18Å; Y952-V955 VanDerWaalsContact O-N 3.09Å; Y952-F956 HydrophobicContact CE1-CB 4.24Å; Y952-F956 HydrophobicContact CE1-CD2 4.41Å; Y952-F956 WeakPolarHBondContact O-CB 3.44Å; Y952-F956 PolarHBondContact O-N 3.38Å
953	L	89.5	Confident	83.1	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-61.1	-36.9	-179.1	-164.5	67.8	0	0	0	112.1	L897 A901 F937 F949 K950 F956 F957	L897-L953 HydrophobicContact CD1-CD2 3.85Å; L897-L953 HydrophobicContact CD1-CG 4.12Å; L897-L953 HydrophobicContact CG-CD2 4.27Å; A901-L953 HydrophobicContact CB-CD2 3.58Å; F937-L953 HydrophobicContact CE2-CD1 3.63Å; F937-L953 HydrophobicContact CZ-CD1 4.16Å; F949-L953 HydrophobicContact CZ-CD1 4.43Å; F949-L953 WeakPolarHBondContact O-CB 3.2Å; F949-L953 PolarHBondContact O-N 3.05Å; K950-L953 PolarHBondContact O-N 3.49Å; L953-F956 HydrophobicContact CD1-CD1 4.48Å; L953-F956 PolarHBondContact O-N 3.35Å; L953-F957 HydrophobicContact CD1-CD2 4.07Å; L953-F957 HydrophobicContact CD1-CE2 3.51Å; L953-F957 HydrophobicContact CD1-CZ 4.37Å; L953-F957 HydrophobicContact CD2-CE2 4.2Å; L953-F957 HydrophobicContact CG-CD2 3.9Å; L953-F957 HydrophobicContact CG-CE2 3.65Å; L953-F957 VanDerWaalsContact O-CD2 3.26Å; L953-F957 WeakPolarHBondContact O-CD2 3.48Å; L953-F957 PolarHBondContact O-N 3.25Å; L953-F957 VanDerWaalsContact O-N 3.11Å
954	K	87.1	Confident	82.9	Confident	72 Å²	72	73.1 Å²	73.1	31%	0.313	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-50.2	172.5	-174.8	176.6	-179.5	174.7	0	111.6	L897 K950 N951 Y952 F956 F957 Q958	L897-K954 HydrophobicContact CD2-CB 4.16Å; K950-K954 PolarHBondContact O-N 2.98Å; N951-K954 PolarHBondContact O-N 2.74Å; Y952-K954 VanDerWaalsContact C-N 3.28Å; Y952-K954 PolarHBondContact O-N 3.45Å; K954-F956 VanDerWaalsContact C-N 3.32Å; K954-F956 PolarHBondContact O-N 3.31Å; K954-F957 PolarHBondContact O-N 3.38Å; K954-Q958 WeakPolarHBondContact O-CB 3.47Å; K954-Q958 VanDerWaalsContact O-CG 3.26Å; K954-Q958 WeakPolarHBondContact O-CG 3.17Å; K954-Q958 PolarHBondContact O-N 2.77Å
955	V	87.1	Confident	83.2	Confident	56 Å²	56	70.7 Å²	70.7	34%	0.339	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-38.7	179.6	176.1	0	0	0	0	111.3	N951 Y952 Q958 R959	N951-V955 PolarHBondContact O-N 3.43Å; Y952-V955 PolarHBondContact O-N 3.18Å; Y952-V955 VanDerWaalsContact O-N 3.09Å; V955-Q958 PolarHBondContact O-N 2.79Å; V955-R959 WeakPolarHBondContact O-CG 3.18Å; V955-R959 PolarHBondContact O-N 3.41Å
956	F	88.4	Confident	83.3	Confident	23 Å²	23	70 Å²	70	10%	0.101	36%	0.364	C	S	.	.	H	α-helix	trans	-57.5	-51.6	177	175.4	-93.3	0	0	0	111.4	F878 I933 F937 Y952 L953 K954 R959 A960	F878-F956 HydrophobicContact CE1-CE1 4.39Å; I933-F956 HydrophobicContact CG2-CD2 4.11Å; I933-F956 HydrophobicContact CG2-CE2 3.64Å; F937-F956 HydrophobicContact CD2-CD1 4.46Å; F937-F956 HydrophobicContact CD2-CD2 4.01Å; F937-F956 HydrophobicContact CD2-CE1 4.44Å; F937-F956 AromaticContact CD2-CE2 3.98Å; F937-F956 HydrophobicContact CD2-CE2 3.98Å; F937-F956 HydrophobicContact CD2-CG 4.27Å; F937-F956 HydrophobicContact CD2-CZ 4.2Å; F937-F956 HydrophobicContact CE2-CD1 4.38Å; F937-F956 HydrophobicContact CE2-CE1 4.37Å; Y952-F956 HydrophobicContact CE1-CB 4.24Å; Y952-F956 HydrophobicContact CE1-CD2 4.41Å; Y952-F956 WeakPolarHBondContact O-CB 3.44Å; Y952-F956 PolarHBondContact O-N 3.38Å; L953-F956 HydrophobicContact CD1-CD1 4.48Å; L953-F956 PolarHBondContact O-N 3.35Å; K954-F956 VanDerWaalsContact C-N 3.32Å; K954-F956 PolarHBondContact O-N 3.31Å; F956-R959 PolarHBondContact O-N 3.4Å; F956-A960 WeakPolarHBondContact O-CB 3.47Å; F956-A960 PolarHBondContact O-N 3Å; F956-A960 VanDerWaalsContact O-N 3.12Å
957	F	87.9	Confident	83.4	Confident	1 Å²	1	71.8 Å²	71.8	0%	0.004	37%	0.365	C	S	.	.	H	α-helix	trans	-74.4	-28.5	179.1	-72	-66.1	0	0	0	113.7	F878 P881 L882 L888 L897 L953 K954 R959 A960 K961	F878-F957 HydrophobicContact CD1-CE1 4.32Å; F878-F957 AromaticContact CD1-CZ 3.96Å; F878-F957 HydrophobicContact CD1-CZ 3.96Å; P881-F957 HydrophobicContact CB-CD1 3.75Å; P881-F957 HydrophobicContact CB-CD2 3.75Å; P881-F957 HydrophobicContact CB-CE1 3.74Å; P881-F957 HydrophobicContact CB-CE2 3.71Å; P881-F957 HydrophobicContact CB-CG 3.76Å; P881-F957 HydrophobicContact CB-CZ 3.72Å; P881-F957 HydrophobicContact CG-CD2 4.22Å; P881-F957 HydrophobicContact CG-CE1 4.27Å; P881-F957 HydrophobicContact CG-CE2 3.74Å; P881-F957 HydrophobicContact CG-CZ 3.78Å; L882-F957 HydrophobicContact CD2-CD1 4.15Å; L882-F957 HydrophobicContact CD2-CE1 4.3Å; L882-F957 HydrophobicContact CG-CD1 4.36Å; L882-F957 HydrophobicContact CG-CE1 4.11Å; L888-F957 HydrophobicContact CD1-CB 4.02Å; L897-F957 HydrophobicContact CD1-CD2 3.7Å; L897-F957 HydrophobicContact CD1-CE2 3.86Å; L953-F957 HydrophobicContact CD1-CD2 4.07Å; L953-F957 HydrophobicContact CD1-CE2 3.51Å; L953-F957 HydrophobicContact CD1-CZ 4.37Å; L953-F957 HydrophobicContact CD2-CE2 4.2Å; L953-F957 HydrophobicContact CG-CD2 3.9Å; L953-F957 HydrophobicContact CG-CE2 3.65Å; L953-F957 VanDerWaalsContact O-CD2 3.26Å; L953-F957 WeakPolarHBondContact O-CD2 3.48Å; L953-F957 PolarHBondContact O-N 3.25Å; L953-F957 VanDerWaalsContact O-N 3.11Å; K954-F957 PolarHBondContact O-N 3.38Å; F957-R959 VanDerWaalsContact C-N 3.26Å; F957-R959 PolarHBondContact O-N 3.38Å; F957-A960 PolarHBondContact O-N 3.33Å; F957-K961 WeakPolarHBondContact O-CG 3.46Å; F957-K961 PolarHBondContact O-N 3.33Å
958	Q	83.5	Confident	83.3	Confident	97 Å²	97	66.7 Å²	66.7	45%	0.453	35%	0.347	S	S	.	.	H	α-helix	trans	-61.5	-34.9	170.8	-78.5	177.5	-28.6	0	0	112.4	L888 K954 V955	L888-Q958 HydrophobicContact CD1-CG 3.86Å; K954-Q958 WeakPolarHBondContact O-CB 3.47Å; K954-Q958 VanDerWaalsContact O-CG 3.26Å; K954-Q958 WeakPolarHBondContact O-CG 3.17Å; K954-Q958 PolarHBondContact O-N 2.77Å; V955-Q958 PolarHBondContact O-N 2.79Å
959	R	81.6	Confident	83	Confident	184 Å²	184	66.4 Å²	66.4	69%	0.694	34%	0.341	S	S	*	.	H	α-helix	trans	-78.6	-26.4	175.1	-68.5	175.2	-177.7	174.9	2.2	113.1	V955 F956 F957	V955-R959 WeakPolarHBondContact O-CG 3.18Å; V955-R959 PolarHBondContact O-N 3.41Å; F956-R959 PolarHBondContact O-N 3.4Å; F957-R959 VanDerWaalsContact C-N 3.26Å; F957-R959 PolarHBondContact O-N 3.38Å
960	A	77.3	Confident	82.4	Confident	50 Å²	50	71.4 Å²	71.4	41%	0.413	37%	0.367	S	S	.	.	H	α-helix	trans	-85.8	-20.2	-176.9	0	0	0	0	0	113.5	L882 F956 F957	L882-A960 HydrophobicContact CD2-CB 4.29Å; F956-A960 WeakPolarHBondContact O-CB 3.47Å; F956-A960 PolarHBondContact O-N 3Å; F956-A960 VanDerWaalsContact O-N 3.12Å; F957-A960 PolarHBondContact O-N 3.33Å
961	K	69.1	Low	81.8	Confident	51 Å²	51	72.1 Å²	72.1	22%	0.222	37%	0.374	C	S	.	.			trans	-83.1	132.4	173.2	-71.3	-164.7	-179.1	-152.4	0	110.6	P881 K883 F886 L888 F957	P881-K961 WeakPolarHBondContact O-CE 3.31Å; P881-K961 PolarHBondContact O-NZ 2.87Å; K883-K961 PolarHBondContact O-NZ 2.78Å; F886-K961 PolarHBondContact O-NZ 3.49Å; L888-K961 HydrophobicContact CD1-CD 4.18Å; F957-K961 WeakPolarHBondContact O-CG 3.46Å; F957-K961 PolarHBondContact O-N 3.33Å
962	P	52.1	Low	81.3	Confident	200 Å²	200	69.7 Å²	69.7	100%	1.299	36%	0.361	S	S	*	.			trans	-68	0	171.9	29.1	-33.1	0	0	0	112.4

Retrieved 962 of 962 residues in 511.3 ms (Link to these results)

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