A0A077Z3Q8_TRITR Loading...

Transmembrane cochlear expressed protein tmc fam ily membrane protein

AlphaFold DB , UniProt , Accession A0A077Z3Q8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,060 aa.

						>A0A077Z3Q8_TRITR|A0A077Z3Q8
MDLRSLVLYYEMFRDRKSLDIFETELEEEDKCHLTREQLMEKIREKKAVIENLRCQPWPMQRKLRTLRLAQRYLQRQEAKVSRTHLLRESIQKRWKAFCRWFANISIYLIPWEAKIKKIESHFGSVVSSYFIFLRWIFGINLIISLIMTIFITLPECIADAAADEYRKNLTAGHKQLTEKELETADYLQTVWDFKGYLARSPLFYGYYSNQEYVQVIFKYRLPLAYFLVNLIVLGYSFFAILRKMASNARTSKLSSGKTEQYVFSWKVTTGWDYTIGNPETASNAIMATVTKFRVSKQLLLKLVFSGLSDSRKPSWSIKKSKLRSSGRKYERINYMVVLLKWVRFFLRIVANFIILSMMASSTYAIYTVVERSRDIEHDLTATALQKIEVPIVVSFITLVFPNLFEMVSKLERFHPRTALRLQLARILVLYFLNFYTLIFAVFTKMEYLIKVQDSLQKLQFDLTVTNASDLPPQRTLGDNTALFRLVREAFQQIDGELGADALNASAVATATPIPLFHLIPKEFFTNRFLPYAKSIWQRRLIEAKTKSPSKKPIPQRHSITTPPPGLTWTTMHPEYGLLGVDNLQAFLVNGTIYKDLVELETFLKQNNLTFHITYGGSKTNRSREGPPPSGTIFLIPQKLSSVELESLCWETMIGEVEDRLPKSCFTCTHLQEIAKLVTMDLVMNVASILTVDFLRGLWVRFCTSWWCWNLETVFPEYGEFKVAENVLHVINNQGMIWLGMFFCPLLPAMNNIKLVILLYTRAWAVMTCNIPAAEVFRASKFVNRAVQTHEQGRQLIHFRSSNFYYVLLLLIMFICVLPVGYVIASKEPSSTCGPFAGKDNFYTIMSDQLKALLPAEVYTKMNVLSSPGIVIPVLILFILVIYFLVSLVRGLKEANNDLNKQLFQERTEEKRKIFKMAGTVLGEPAVTVLVPQKLHINCFADRKRNKDDQRDQTKKGLPQKRDSRSHSFKKFLSITRDSEEDGVDKATKERPMMQQDTWLNPLHVRNRESAQSFYVPSLKSLPEESEQEDSASAILIGRSKSDSHLKKVPKFCTISNTNL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46	Very low	66.5	Low	225 Å²	225	132.2 Å²	132.2	100%	1.108	63%	0.634	S	S	*	*				0	113.3	0	-89.6	177	161.6	0	0	107.5
2	D	61.7	Low	66.6	Low	122 Å²	122	131.7 Å²	131.7	65%	0.652	63%	0.633	S	S	*	*			trans	-65.3	137.4	-176.5	-115	-23.2	0	0	0	111.4	R4 S5 L6	D2-R4 PolarHBondContact O-N 3.48Å; D2-R4 VanDerWaalsContact O-N 3.09Å; D2-S5 WeakPolarHBondContact O-CA 3.43Å; D2-S5 WeakPolarHBondContact O-CB 3.49Å; D2-S5 PolarHBondContact O-N 3.11Å; D2-L6 PolarHBondContact O-N 3.43Å; D2-L6 VanDerWaalsContact O-N 3.11Å
3	L	66.2	Low	67	Low	141 Å²	141	131 Å²	131	74%	0.738	63%	0.626	S	S	*	*	H	α-helix	trans	-54.7	-31.9	178.1	-147	91.2	0	0	0	111.3	L6 V7	L3-L6 PolarHBondContact O-N 3.47Å; L3-V7 WeakPolarHBondContact O-CG2 3.5Å; L3-V7 PolarHBondContact O-N 3.43Å
4	R	63.6	Low	67.5	Low	205 Å²	205	134.9 Å²	134.9	77%	0.774	63%	0.631	S	S	*	*	H	α-helix	trans	-66.3	-38.1	176.1	-141.9	177.6	-171.5	-173.4	2.8	112.7	D2 L8	D2-R4 PolarHBondContact O-N 3.48Å; D2-R4 VanDerWaalsContact O-N 3.09Å; R4-L8 WeakPolarHBondContact O-CB 3.26Å; R4-L8 WeakPolarHBondContact O-CG 3.06Å; R4-L8 PolarHBondContact O-N 3.36Å
5	S	67.3	Low	67.4	Low	72 Å²	72	129.5 Å²	129.5	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-70.6	-35.1	175.3	-49.9	0	0	0	0	111.3	D2 Y9	D2-S5 WeakPolarHBondContact O-CA 3.43Å; D2-S5 WeakPolarHBondContact O-CB 3.49Å; D2-S5 PolarHBondContact O-N 3.11Å; S5-Y9 VanDerWaalsContact O-CB 3.25Å; S5-Y9 WeakPolarHBondContact O-CB 3.29Å; S5-Y9 PolarHBondContact O-N 3.44Å
6	L	71	Confident	67.5	Low	95 Å²	95	132.8 Å²	132.8	50%	0.497	61%	0.613	S	S	.	*	H	α-helix	trans	-68.9	-42	174.4	-110.7	156.7	0	0	0	112.1	D2 L3 Y9 Y10	D2-L6 PolarHBondContact O-N 3.43Å; D2-L6 VanDerWaalsContact O-N 3.11Å; L3-L6 PolarHBondContact O-N 3.47Å; L6-Y9 PolarHBondContact O-N 3.19Å; L6-Y10 WeakPolarHBondContact O-CB 3.24Å; L6-Y10 PolarHBondContact O-N 3.08Å
7	V	72.8	Confident	67.8	Low	77 Å²	77	132.9 Å²	132.9	47%	0.467	61%	0.611	S	S	.	*	H	α-helix	trans	-64.1	-44.9	174.4	172.2	0	0	0	0	111.1	L3 Y9 Y10 E11	L3-V7 WeakPolarHBondContact O-CG2 3.5Å; L3-V7 PolarHBondContact O-N 3.43Å; V7-Y9 VanDerWaalsContact C-N 3.35Å; V7-Y9 PolarHBondContact O-N 2.88Å; V7-Y10 PolarHBondContact O-N 3.37Å; V7-E11 WeakPolarHBondContact O-CB 3.27Å; V7-E11 WeakPolarHBondContact O-CG 3.19Å; V7-E11 PolarHBondContact O-N 3.3Å
8	L	68.4	Low	67.8	Low	105 Å²	105	127.9 Å²	127.9	55%	0.55	60%	0.595	S	S	.	*	H	α-helix	trans	-64	-37.9	175	-76.3	168.9	0	0	0	112.5	R4 M12	R4-L8 WeakPolarHBondContact O-CB 3.26Å; R4-L8 WeakPolarHBondContact O-CG 3.06Å; R4-L8 PolarHBondContact O-N 3.36Å; L8-M12 WeakPolarHBondContact O-CB 2.94Å; L8-M12 WeakPolarHBondContact O-CG 3.18Å; L8-M12 PolarHBondContact O-N 3.36Å
9	Y	72.3	Confident	67.6	Low	146 Å²	146	122.8 Å²	122.8	57%	0.573	57%	0.572	S	S	*	*	H	α-helix	trans	-66.5	-42.3	174.8	-166.5	-91.2	0	0	0	111.3	S5 L6 V7 M12 F13	S5-Y9 VanDerWaalsContact O-CB 3.25Å; S5-Y9 WeakPolarHBondContact O-CB 3.29Å; S5-Y9 PolarHBondContact O-N 3.44Å; L6-Y9 PolarHBondContact O-N 3.19Å; V7-Y9 VanDerWaalsContact C-N 3.35Å; V7-Y9 PolarHBondContact O-N 2.88Å; Y9-M12 PolarHBondContact O-N 3.04Å; Y9-F13 HydrophobicContact CE1-CD2 4.02Å; Y9-F13 WeakPolarHBondContact O-CB 3.19Å; Y9-F13 PolarHBondContact O-N 2.98Å
10	Y	73	Confident	67.7	Low	173 Å²	173	120.7 Å²	120.7	68%	0.678	56%	0.564	S	S	*	*	H	α-helix	trans	-68.1	-39.9	178	-151.2	-87.3	0	0	0	112.1	L6 V7 F13 R14	L6-Y10 WeakPolarHBondContact O-CB 3.24Å; L6-Y10 PolarHBondContact O-N 3.08Å; V7-Y10 PolarHBondContact O-N 3.37Å; Y10-F13 PolarHBondContact O-N 3.49Å; Y10-R14 WeakPolarHBondContact O-CB 3.22Å; Y10-R14 PolarHBondContact O-N 3.26Å
11	E	69	Low	68	Low	93 Å²	93	119.1 Å²	119.1	44%	0.435	56%	0.559	S	S	.	*	H	α-helix	trans	-63.8	-44.1	172	-77.2	-169.2	159.2	0	0	111.6	V7 F13 R14 D15	V7-E11 WeakPolarHBondContact O-CB 3.27Å; V7-E11 WeakPolarHBondContact O-CG 3.19Å; V7-E11 PolarHBondContact O-N 3.3Å; E11-F13 PolarHBondContact O-N 2.85Å; E11-R14 PolarHBondContact O-N 3.12Å; E11-D15 WeakPolarHBondContact O-CB 3.49Å; E11-D15 PolarHBondContact O-N 2.8Å
12	M	68.2	Low	69.1	Low	126 Å²	126	111.3 Å²	111.3	62%	0.621	52%	0.519	S	S	*	.	H	α-helix	trans	-62.4	-41.1	173.9	-84.5	-164.3	-10.2	0	0	112.7	L8 Y9 D15 R16	L8-M12 WeakPolarHBondContact O-CB 2.94Å; L8-M12 WeakPolarHBondContact O-CG 3.18Å; L8-M12 PolarHBondContact O-N 3.36Å; Y9-M12 PolarHBondContact O-N 3.04Å; M12-D15 PolarHBondContact O-N 3.47Å; M12-R16 WeakPolarHBondContact O-CB 3.38Å; M12-R16 PolarHBondContact O-N 2.85Å
13	F	71.6	Confident	69.5	Low	123 Å²	123	109.1 Å²	109.1	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-69	-39.8	179.8	-150.3	-86.8	0	0	0	111	Y9 Y10 E11 R16 K17	Y9-F13 HydrophobicContact CE1-CD2 4.02Å; Y9-F13 WeakPolarHBondContact O-CB 3.19Å; Y9-F13 PolarHBondContact O-N 2.98Å; Y10-F13 PolarHBondContact O-N 3.49Å; E11-F13 PolarHBondContact O-N 2.85Å; F13-R16 PolarHBondContact O-N 2.82Å; F13-K17 WeakPolarHBondContact O-CB 3.29Å; F13-K17 PolarHBondContact O-N 3.47Å
14	R	74	Confident	69.7	Low	186 Å²	186	105.7 Å²	105.7	70%	0.702	49%	0.49	S	S	*	.	H	α-helix	trans	-63.9	-43	173.8	-173.1	179.5	-172.4	172.9	3.9	112	Y10 E11 S18	Y10-R14 WeakPolarHBondContact O-CB 3.22Å; Y10-R14 PolarHBondContact O-N 3.26Å; E11-R14 PolarHBondContact O-N 3.12Å; R14-S18 WeakPolarHBondContact O-CB 3.47Å; R14-S18 PolarHBondContact O-N 3.33Å
15	D	65.3	Low	69.9	Low	53 Å²	53	101 Å²	101	28%	0.283	48%	0.477	S	S	.	.	H	α-helix	trans	-68.2	-37.5	176.9	-92.4	-6.6	0	0	0	112.1	E11 M12 L19 R62	E11-D15 WeakPolarHBondContact O-CB 3.49Å; E11-D15 PolarHBondContact O-N 2.8Å; M12-D15 PolarHBondContact O-N 3.47Å; D15-L19 PolarHBondContact O-N 3.21Å; D15-L19 VanDerWaalsContact O-N 3.12Å; D15-R62 IonicContact OD1-CZ 3.24Å; D15-R62 IonicContact OD1-NE 2.98Å; D15-R62 IonicContact OD1-NH1 3.15Å; D15-R62 PolarHBondContact OD1-NH1 3.23Å
16	R	69.5	Low	69.9	Low	183 Å²	183	98.2 Å²	98.2	69%	0.691	46%	0.456	S	S	*	.	H	α-helix	trans	-65.1	-48.9	175.2	-170.4	-179.1	-81.1	-127.9	3.1	110.9	M12 F13 S18 L19 D20	M12-R16 WeakPolarHBondContact O-CB 3.38Å; M12-R16 PolarHBondContact O-N 2.85Å; F13-R16 PolarHBondContact O-N 2.82Å; R16-S18 VanDerWaalsContact C-N 3.31Å; R16-S18 PolarHBondContact O-N 2.81Å; R16-L19 WeakPolarHBondContact O-CA 3.48Å; R16-L19 WeakPolarHBondContact O-CB 3.24Å; R16-L19 PolarHBondContact O-N 3.28Å; R16-D20 VanDerWaalsContact O-CG 3.24Å; R16-D20 PolarHBondContact O-N 3.18Å
17	K	73.2	Confident	69.8	Low	134 Å²	134	99.1 Å²	99.1	58%	0.583	46%	0.458	S	S	*	.	H	α-helix	trans	-60.6	-38.3	177	-164.6	173.9	-175	177.8	0	112.6	F13 L19 D20 I21	F13-K17 WeakPolarHBondContact O-CB 3.29Å; F13-K17 PolarHBondContact O-N 3.47Å; K17-L19 VanDerWaalsContact C-N 3.3Å; K17-L19 PolarHBondContact O-N 2.9Å; K17-D20 PolarHBondContact O-N 3.33Å; K17-I21 HydrophobicContact CG-CD1 4.34Å; K17-I21 WeakPolarHBondContact O-CD1 3.17Å; K17-I21 WeakPolarHBondContact O-CG1 3.37Å; K17-I21 PolarHBondContact O-N 3.04Å
18	S	67.1	Low	69.5	Low	44 Å²	44	101.8 Å²	101.8	31%	0.308	47%	0.465	S	S	.	.	H	α-helix	trans	-62.2	-34.9	173	161.5	0	0	0	0	113	R14 R16 F22 R62	R14-S18 WeakPolarHBondContact O-CB 3.47Å; R14-S18 PolarHBondContact O-N 3.33Å; R16-S18 VanDerWaalsContact C-N 3.31Å; R16-S18 PolarHBondContact O-N 2.81Å; S18-F22 PolarHBondContact O-N 3.44Å; S18-R62 PolarHBondContact OG-NH2 2.91Å
19	L	64.3	Low	69.2	Low	31 Å²	31	99.5 Å²	99.5	16%	0.162	45%	0.452	C	S	.	.	H	α-helix	trans	-77.1	-41.5	178.6	-124	101.8	0	0	0	111.1	D15 R16 K17 I21 F22 E23 L69	D15-L19 PolarHBondContact O-N 3.21Å; D15-L19 VanDerWaalsContact O-N 3.12Å; R16-L19 WeakPolarHBondContact O-CA 3.48Å; R16-L19 WeakPolarHBondContact O-CB 3.24Å; R16-L19 PolarHBondContact O-N 3.28Å; K17-L19 VanDerWaalsContact C-N 3.3Å; K17-L19 PolarHBondContact O-N 2.9Å; L19-I21 VanDerWaalsContact C-N 3.3Å; L19-I21 PolarHBondContact O-N 2.93Å; L19-F22 CarbonylContact O-C 3.58Å; L19-F22 WeakPolarHBondContact O-CB 3.24Å; L19-F22 PolarHBondContact O-N 3.43Å; L19-F22 VanDerWaalsContact O-N 3.12Å; L19-E23 WeakPolarHBondContact O-CB 3.38Å; L19-E23 PolarHBondContact O-N 3.09Å; L19-L69 HydrophobicContact CD2-CD1 3.52Å; L19-L69 HydrophobicContact CG-CD1 4.14Å
20	D	70.1	Confident	68.7	Low	79 Å²	79	95.3 Å²	95.3	42%	0.422	44%	0.439	S	S	.	.	H	α-helix	trans	-62.4	-39.1	177.6	-59.9	-23.9	0	0	0	110.6	R16 K17 E23 T24	R16-D20 VanDerWaalsContact O-CG 3.24Å; R16-D20 PolarHBondContact O-N 3.18Å; K17-D20 PolarHBondContact O-N 3.33Å; D20-E23 PolarHBondContact O-N 2.91Å; D20-T24 WeakPolarHBondContact O-CB 3.36Å; D20-T24 PolarHBondContact O-N 3.22Å; D20-T24 PolarHBondContact O-OG1 2.98Å
21	I	73.3	Confident	68	Low	88 Å²	88	95.9 Å²	95.9	45%	0.451	45%	0.445	S	S	.	.	H	α-helix	trans	-61.5	-46	172.3	-67.7	162.2	0	0	0	110.7	K17 L19 E23 T24 E25	K17-I21 HydrophobicContact CG-CD1 4.34Å; K17-I21 WeakPolarHBondContact O-CD1 3.17Å; K17-I21 WeakPolarHBondContact O-CG1 3.37Å; K17-I21 PolarHBondContact O-N 3.04Å; L19-I21 VanDerWaalsContact C-N 3.3Å; L19-I21 PolarHBondContact O-N 2.93Å; I21-E23 VanDerWaalsContact C-N 3.34Å; I21-E23 PolarHBondContact O-N 3.43Å; I21-T24 PolarHBondContact O-N 3.49Å; I21-E25 WeakPolarHBondContact O-CB 3.31Å; I21-E25 WeakPolarHBondContact O-CG 3.42Å; I21-E25 PolarHBondContact O-N 3.31Å
22	F	68.9	Low	67.5	Low	61 Å²	61	95.7 Å²	95.7	27%	0.268	45%	0.453	S	S	.	.	H	α-helix	trans	-66.1	-35.1	178.5	-172.1	-103.6	0	0	0	112.5	S18 L19 L26	S18-F22 PolarHBondContact O-N 3.44Å; L19-F22 CarbonylContact O-C 3.58Å; L19-F22 WeakPolarHBondContact O-CB 3.24Å; L19-F22 PolarHBondContact O-N 3.43Å; L19-F22 VanDerWaalsContact O-N 3.12Å; F22-L26 HydrophobicContact CD1-CD1 3.93Å; F22-L26 HydrophobicContact CE1-CD1 3.68Å; F22-L26 HydrophobicContact CE1-CG 4.34Å; F22-L26 HydrophobicContact CZ-CD1 4.39Å; F22-L26 VanDerWaalsContact O-CG 3.27Å; F22-L26 WeakPolarHBondContact O-CG 3.15Å; F22-L26 PolarHBondContact O-N 2.76Å; F22-L26 VanDerWaalsContact O-N 3.11Å
23	E	69.5	Low	67.2	Low	77 Å²	77	99 Å²	99	36%	0.36	47%	0.467	S	S	.	.	H	α-helix	trans	-70.2	-40	175	-167.1	158.8	-156.4	0	0	111.1	L19 D20 I21 L26 E27	L19-E23 WeakPolarHBondContact O-CB 3.38Å; L19-E23 PolarHBondContact O-N 3.09Å; D20-E23 PolarHBondContact O-N 2.91Å; I21-E23 VanDerWaalsContact C-N 3.34Å; I21-E23 PolarHBondContact O-N 3.43Å; E23-L26 PolarHBondContact O-N 2.8Å; E23-L26 VanDerWaalsContact O-N 3.15Å; E23-E27 WeakPolarHBondContact O-CG 3.34Å; E23-E27 PolarHBondContact O-N 2.84Å
24	T	70.6	Confident	66.9	Low	69 Å²	69	96 Å²	96	42%	0.423	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-42.3	173.2	-48.9	0	0	0	0	111.1	D20 I21 L26 E27 E28	D20-T24 WeakPolarHBondContact O-CB 3.36Å; D20-T24 PolarHBondContact O-N 3.22Å; D20-T24 PolarHBondContact O-OG1 2.98Å; I21-T24 PolarHBondContact O-N 3.49Å; T24-L26 VanDerWaalsContact C-N 3.27Å; T24-L26 PolarHBondContact O-N 3.5Å; T24-E27 PolarHBondContact O-N 3.14Å; T24-E28 HydrophobicContact CG2-CG 4.34Å; T24-E28 WeakPolarHBondContact O-CB 3.49Å; T24-E28 WeakPolarHBondContact O-CG 3.36Å; T24-E28 PolarHBondContact O-N 3.49Å
25	E	68.7	Low	66.8	Low	105 Å²	105	91.3 Å²	91.3	49%	0.491	45%	0.448	S	S	.	.	H	α-helix	trans	-59.1	-37.8	173.3	-77.5	175.5	179.9	0	0	111.8	I21 E29	I21-E25 WeakPolarHBondContact O-CB 3.31Å; I21-E25 WeakPolarHBondContact O-CG 3.42Å; I21-E25 PolarHBondContact O-N 3.31Å; E25-E29 WeakPolarHBondContact O-CB 3.47Å; E25-E29 VanDerWaalsContact O-CG 3.27Å; E25-E29 WeakPolarHBondContact O-CG 3.33Å; E25-E29 PolarHBondContact O-N 2.98Å
26	L	67.8	Low	66.9	Low	15 Å²	15	95.6 Å²	95.6	8%	0.079	46%	0.46	C	S	.	.	H	α-helix	trans	-72.9	-33.7	176.4	-68.5	171.4	0	0	0	112.9	F22 E23 T24 Y73	F22-L26 HydrophobicContact CD1-CD1 3.93Å; F22-L26 HydrophobicContact CE1-CD1 3.68Å; F22-L26 HydrophobicContact CE1-CG 4.34Å; F22-L26 HydrophobicContact CZ-CD1 4.39Å; F22-L26 VanDerWaalsContact O-CG 3.27Å; F22-L26 WeakPolarHBondContact O-CG 3.15Å; F22-L26 PolarHBondContact O-N 2.76Å; F22-L26 VanDerWaalsContact O-N 3.11Å; E23-L26 PolarHBondContact O-N 2.8Å; E23-L26 VanDerWaalsContact O-N 3.15Å; T24-L26 VanDerWaalsContact C-N 3.27Å; T24-L26 PolarHBondContact O-N 3.5Å; L26-Y73 HydrophobicContact CB-CD2 4.1Å; L26-Y73 HydrophobicContact CB-CE2 4.41Å; L26-Y73 HydrophobicContact CD2-CD1 4.21Å; L26-Y73 HydrophobicContact CD2-CD2 3.64Å; L26-Y73 HydrophobicContact CD2-CE1 4.46Å; L26-Y73 HydrophobicContact CD2-CE2 3.88Å; L26-Y73 HydrophobicContact CD2-CG 3.79Å; L26-Y73 HydrophobicContact CG-CD2 4.34Å
27	E	67.6	Low	67.1	Low	114 Å²	114	94.5 Å²	94.5	53%	0.533	46%	0.463	S	S	.	.	H	α-helix	trans	-78	-36	178.4	-73.4	-173.4	171.2	0	0	113.3	E23 T24 E29 D30	E23-E27 WeakPolarHBondContact O-CG 3.34Å; E23-E27 PolarHBondContact O-N 2.84Å; T24-E27 PolarHBondContact O-N 3.14Å; E27-E29 VanDerWaalsContact C-N 3.3Å; E27-D30 WeakPolarHBondContact O-CB 3.39Å; E27-D30 PolarHBondContact O-N 3.43Å
28	E	66.8	Low	67.1	Low	133 Å²	133	92.5 Å²	92.5	62%	0.621	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-35	174	-73.9	-173.9	171	0	0	111.5	T24 D30 K31	T24-E28 HydrophobicContact CG2-CG 4.34Å; T24-E28 WeakPolarHBondContact O-CB 3.49Å; T24-E28 WeakPolarHBondContact O-CG 3.36Å; T24-E28 PolarHBondContact O-N 3.49Å; E28-D30 PolarHBondContact O-N 2.87Å; E28-K31 PolarHBondContact O-N 2.81Å
29	E	62.3	Low	67.3	Low	56 Å²	56	91.4 Å²	91.4	26%	0.262	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-64	-23.3	174.1	-80.5	-179.2	-178.4	0	0	113.3	E25 E27 K31 K46 Y73	E25-E29 WeakPolarHBondContact O-CB 3.47Å; E25-E29 VanDerWaalsContact O-CG 3.27Å; E25-E29 WeakPolarHBondContact O-CG 3.33Å; E25-E29 PolarHBondContact O-N 2.98Å; E27-E29 VanDerWaalsContact C-N 3.3Å; E29-K31 VanDerWaalsContact C-N 3.35Å; E29-K46 IonicContact OE1-NZ 3.94Å; E29-K46 PolarHBondContact OE1-NZ 3.36Å; E29-K46 WeakPolarHBondContact OE2-CE 3.44Å; E29-K46 IonicContact OE2-NZ 2.74Å; E29-K46 PolarHBondContact OE2-NZ 3.27Å; E29-Y73 PolarHBondContact OE2-OH 2.95Å
30	D	61.5	Low	67.4	Low	58 Å²	58	92.9 Å²	92.9	31%	0.31	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-76.8	-15.8	-178.9	-100.8	-21.3	0	0	0	113.7	E27 E28 Q77 K80	E27-D30 WeakPolarHBondContact O-CB 3.39Å; E27-D30 PolarHBondContact O-N 3.43Å; E28-D30 PolarHBondContact O-N 2.87Å; D30-Q77 PolarHBondContact OD1-NE2 3.39Å; D30-K80 IonicContact OD1-NZ 2.9Å
31	K	58.9	Low	67.8	Low	185 Å²	185	94.6 Å²	94.6	80%	0.804	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-87.3	-2.3	-175	-68.9	179.8	-177.2	171	0	115	E28 E29	E28-K31 PolarHBondContact O-N 2.81Å; E29-K31 VanDerWaalsContact C-N 3.35Å
32	C	59.3	Low	67.8	Low	89 Å²	89	93 Å²	93	60%	0.601	45%	0.449	S	S	*	.	S	Bend	trans	-102.2	127.9	-177.5	-162.9	0	0	0	0	112.1	L34	C32-L34 PolarHBondContact O-N 2.85Å; C32-L34 VanDerWaalsContact O-N 3.07Å
33	H	60.1	Low	67.9	Low	197 Å²	197	90.8 Å²	90.8	91%	0.912	44%	0.439	S	S	*	.			trans	-68.7	101.2	172.4	-84.7	-82.3	0	0	0	110.6
34	L	65.4	Low	68.1	Low	59 Å²	59	94 Å²	94	31%	0.309	45%	0.448	S	S	.	.			trans	-96.3	141.7	179.1	-83.5	147.9	0	0	0	112.4	C32 Q38 K42	C32-L34 PolarHBondContact O-N 2.85Å; C32-L34 VanDerWaalsContact O-N 3.07Å; L34-Q38 HydrophobicContact CD2-CB 3.42Å; L34-Q38 VanDerWaalsContact CD2-CB 3.42Å; L34-Q38 HydrophobicContact CD2-CG 4.28Å; L34-K42 HydrophobicContact CD1-CD 3.95Å
35	T	73.2	Confident	68.4	Low	87 Å²	87	96.3 Å²	96.3	53%	0.534	45%	0.454	S	S	.	.			trans	-67.8	150.9	169.5	-47.3	0	0	0	0	110.5	E37 Q38 L39	T35-E37 PolarHBondContact O-N 3.36Å; T35-E37 VanDerWaalsContact O-N 3.11Å; T35-Q38 PolarHBondContact O-N 2.94Å; T35-Q38 PolarHBondContact OG1-OE1 3.47Å; T35-L39 PolarHBondContact O-N 3.43Å
36	R	67.3	Low	68.5	Low	144 Å²	144	93.5 Å²	93.5	54%	0.543	44%	0.44	S	S	.	.	H	α-helix	trans	-52.5	-35.5	-178.1	-177.6	178	172.5	170.9	-3.3	113.9	M40 S82	R36-M40 VanDerWaalsContact O-CG 3.31Å; R36-M40 WeakPolarHBondContact O-CG 3.35Å; R36-M40 PolarHBondContact O-N 2.81Å; R36-S82 VanDerWaalsContact NH2-CB 3.35Å
37	E	72.6	Confident	69	Low	159 Å²	159	94.3 Å²	94.3	74%	0.743	44%	0.443	S	S	*	.	H	α-helix	trans	-70.5	-44.1	178.3	-63.5	-175.8	162	0	0	112.1	T35 L39 M40 E41	T35-E37 PolarHBondContact O-N 3.36Å; T35-E37 VanDerWaalsContact O-N 3.11Å; E37-L39 VanDerWaalsContact C-N 3.27Å; E37-L39 PolarHBondContact O-N 3.05Å; E37-M40 PolarHBondContact O-N 2.77Å; E37-M40 VanDerWaalsContact O-N 3.14Å; E37-E41 PolarHBondContact O-N 2.82Å
38	Q	74.1	Confident	69.4	Low	92 Å²	92	90.4 Å²	90.4	43%	0.43	43%	0.43	S	S	.	.	H	α-helix	trans	-64.2	-34.5	176.3	-59.7	173.2	-39.1	0	0	111.4	L34 T35 K42	L34-Q38 HydrophobicContact CD2-CB 3.42Å; L34-Q38 VanDerWaalsContact CD2-CB 3.42Å; L34-Q38 HydrophobicContact CD2-CG 4.28Å; T35-Q38 PolarHBondContact O-N 2.94Å; T35-Q38 PolarHBondContact OG1-OE1 3.47Å; Q38-K42 WeakPolarHBondContact O-CG 3.21Å; Q38-K42 PolarHBondContact O-N 2.79Å
39	L	71.4	Confident	69.6	Low	21 Å²	21	88 Å²	88	11%	0.11	42%	0.424	C	S	.	.	H	α-helix	trans	-62.6	-44.9	172.6	-179.9	63.2	0	0	0	111.8	T35 E37 I43 Q77 K80 V81	T35-L39 PolarHBondContact O-N 3.43Å; E37-L39 VanDerWaalsContact C-N 3.27Å; E37-L39 PolarHBondContact O-N 3.05Å; L39-I43 HydrophobicContact CD1-CD1 4.45Å; L39-I43 HydrophobicContact CG-CD1 4.21Å; L39-I43 VanDerWaalsContact O-CG1 3.27Å; L39-I43 WeakPolarHBondContact O-CG1 3.38Å; L39-I43 PolarHBondContact O-N 3.45Å; L39-Q77 HydrophobicContact CD1-CB 4.09Å; L39-Q77 HydrophobicContact CD1-CG 4.34Å; L39-Q77 VanDerWaalsContact CD1-OE1 3.23Å; L39-K80 HydrophobicContact CD2-CB 4.29Å; L39-V81 HydrophobicContact CD2-CG2 3.78Å; L39-V81 HydrophobicContact CG-CG2 4.41Å
40	M	66.7	Low	70.2	Confident	62 Å²	62	87 Å²	87	31%	0.305	42%	0.42	S	S	.	.	H	α-helix	trans	-67.6	-35.3	178.8	-68.4	-69.1	-77.3	0	0	112.6	R36 E37 I43 R44 V81	R36-M40 VanDerWaalsContact O-CG 3.31Å; R36-M40 WeakPolarHBondContact O-CG 3.35Å; R36-M40 PolarHBondContact O-N 2.81Å; E37-M40 PolarHBondContact O-N 2.77Å; E37-M40 VanDerWaalsContact O-N 3.14Å; M40-I43 PolarHBondContact O-N 3.25Å; M40-R44 PolarHBondContact O-N 2.87Å; M40-R44 VanDerWaalsContact O-N 3.13Å; M40-V81 HydrophobicContact SD-CG1 3.94Å; M40-V81 HydrophobicContact SD-CG2 4.21Å
41	E	78.1	Confident	70.6	Confident	115 Å²	115	90.1 Å²	90.1	54%	0.537	43%	0.433	S	S	.	.	H	α-helix	trans	-67.5	-46.6	176.2	-168.8	165.8	-151.9	0	0	111.6	E37 I43 R44 E45	E37-E41 PolarHBondContact O-N 2.82Å; E41-I43 VanDerWaalsContact C-N 3.29Å; E41-I43 PolarHBondContact O-N 3.28Å; E41-R44 WeakPolarHBondContact O-CB 3.42Å; E41-R44 PolarHBondContact O-N 3.48Å; E41-E45 PolarHBondContact O-N 2.88Å
42	K	72.4	Confident	71.2	Confident	56 Å²	56	85.9 Å²	85.9	24%	0.243	42%	0.419	C	S	.	.	H	α-helix	trans	-58.7	-38.9	173.2	-76.3	-167.2	179.3	-164.3	0	112.7	L34 Q38 R44 E45 K46	L34-K42 HydrophobicContact CD1-CD 3.95Å; Q38-K42 WeakPolarHBondContact O-CG 3.21Å; Q38-K42 PolarHBondContact O-N 2.79Å; K42-R44 VanDerWaalsContact C-N 3.32Å; K42-R44 PolarHBondContact O-N 3.47Å; K42-E45 PolarHBondContact O-N 3.4Å; K42-K46 VanDerWaalsContact O-CG 3.3Å; K42-K46 WeakPolarHBondContact O-CG 3.29Å; K42-K46 PolarHBondContact O-N 2.9Å
43	I	71	Confident	71.7	Confident	13 Å²	13	82.4 Å²	82.4	7%	0.067	40%	0.395	C	S	.	.	H	α-helix	trans	-60.5	-42	174.5	-74.4	167.3	0	0	0	110.9	L39 M40 E41 K47 L74 Q77 E78 V81	L39-I43 HydrophobicContact CD1-CD1 4.45Å; L39-I43 HydrophobicContact CG-CD1 4.21Å; L39-I43 VanDerWaalsContact O-CG1 3.27Å; L39-I43 WeakPolarHBondContact O-CG1 3.38Å; L39-I43 PolarHBondContact O-N 3.45Å; M40-I43 PolarHBondContact O-N 3.25Å; E41-I43 VanDerWaalsContact C-N 3.29Å; E41-I43 PolarHBondContact O-N 3.28Å; I43-K47 HydrophobicContact CG2-CD 3.95Å; I43-K47 WeakPolarHBondContact O-CB 3.17Å; I43-K47 WeakPolarHBondContact O-CG 3.45Å; I43-K47 PolarHBondContact O-N 2.92Å; I43-L74 HydrophobicContact CB-CD2 4.35Å; I43-L74 HydrophobicContact CG1-CD2 4.33Å; I43-L74 HydrophobicContact CG2-CD2 3.77Å; I43-Q77 HydrophobicContact CD1-CB 4.23Å; I43-Q77 HydrophobicContact CG1-CB 4.22Å; I43-E78 HydrophobicContact CD1-CG 4.41Å; I43-V81 HydrophobicContact CD1-CG2 4.27Å
44	R	74.8	Confident	71.9	Confident	146 Å²	146	81.7 Å²	81.7	55%	0.551	38%	0.384	S	S	*	.	H	α-helix	trans	-67.2	-43.3	178.2	-169.2	-179.2	-71.5	134.6	-3	111.9	M40 E41 K42 K47 A48	M40-R44 PolarHBondContact O-N 2.87Å; M40-R44 VanDerWaalsContact O-N 3.13Å; E41-R44 WeakPolarHBondContact O-CB 3.42Å; E41-R44 PolarHBondContact O-N 3.48Å; K42-R44 VanDerWaalsContact C-N 3.32Å; K42-R44 PolarHBondContact O-N 3.47Å; R44-K47 PolarHBondContact O-N 3.42Å; R44-A48 PolarHBondContact O-N 2.81Å
45	E	76.7	Confident	71.8	Confident	116 Å²	116	84 Å²	84	54%	0.542	40%	0.404	S	S	.	.	H	α-helix	trans	-59.9	-47.9	176.2	-71	-178.2	162.5	0	0	112	E41 K42 K47 A48 V49	E41-E45 PolarHBondContact O-N 2.88Å; K42-E45 PolarHBondContact O-N 3.4Å; E45-K47 VanDerWaalsContact C-N 3.34Å; E45-K47 PolarHBondContact O-N 3.03Å; E45-A48 PolarHBondContact O-N 3.21Å; E45-V49 WeakPolarHBondContact O-CG2 3.4Å; E45-V49 PolarHBondContact O-N 3.47Å
46	K	71.2	Confident	71.6	Confident	46 Å²	46	83.8 Å²	83.8	20%	0.2	40%	0.397	C	S	.	.	H	α-helix	trans	-67.6	-34.1	179.6	-59.7	-74	-176.3	176.5	0	111.5	E29 K42 V49 I50 Y73	E29-K46 IonicContact OE1-NZ 3.94Å; E29-K46 PolarHBondContact OE1-NZ 3.36Å; E29-K46 WeakPolarHBondContact OE2-CE 3.44Å; E29-K46 IonicContact OE2-NZ 2.74Å; E29-K46 PolarHBondContact OE2-NZ 3.27Å; K42-K46 VanDerWaalsContact O-CG 3.3Å; K42-K46 WeakPolarHBondContact O-CG 3.29Å; K42-K46 PolarHBondContact O-N 2.9Å; K46-V49 PolarHBondContact O-N 2.9Å; K46-I50 VanDerWaalsContact O-CG1 3.31Å; K46-I50 WeakPolarHBondContact O-CG1 3.31Å; K46-I50 PolarHBondContact O-N 3.02Å; K46-Y73 HydrophobicContact CG-CE1 4.28Å
47	K	76.9	Confident	71.8	Confident	32 Å²	32	82.8 Å²	82.8	14%	0.139	41%	0.409	C	S	.	.	H	α-helix	trans	-60.4	-43.6	170.6	-83.5	167.1	170.9	154.9	0	112	I43 R44 E45 V49 I50 E51 L74 E78 E1027	I43-K47 HydrophobicContact CG2-CD 3.95Å; I43-K47 WeakPolarHBondContact O-CB 3.17Å; I43-K47 WeakPolarHBondContact O-CG 3.45Å; I43-K47 PolarHBondContact O-N 2.92Å; R44-K47 PolarHBondContact O-N 3.42Å; E45-K47 VanDerWaalsContact C-N 3.34Å; E45-K47 PolarHBondContact O-N 3.03Å; K47-V49 PolarHBondContact O-N 2.9Å; K47-I50 PolarHBondContact O-N 3.18Å; K47-E51 PolarHBondContact O-N 3.15Å; K47-L74 HydrophobicContact CD-CD2 4.46Å; K47-L74 HydrophobicContact CG-CD1 4.16Å; K47-L74 HydrophobicContact CG-CD2 4.18Å; K47-E78 WeakPolarHBondContact CE-OE1 3.46Å; K47-E78 IonicContact NZ-OE1 3.83Å; K47-E78 PolarHBondContact NZ-OE1 3.05Å; K47-E1027 HydrophobicContact CD-CB 4.32Å; K47-E1027 VanDerWaalsContact CD-O 3.3Å; K47-E1027 WeakPolarHBondContact CD-O 3.4Å; K47-E1027 VanDerWaalsContact CE-CB 3.5Å; K47-E1027 WeakPolarHBondContact CE-O 3.39Å; K47-E1027 IonicContact NZ-OE2 3.12Å; K47-E1027 PolarHBondContact NZ-OE2 3.01Å
48	A	75.7	Confident	71.9	Confident	32 Å²	32	79.3 Å²	79.3	26%	0.264	39%	0.389	S	S	.	.	H	α-helix	trans	-65.9	-35.6	175.8	0	0	0	0	0	113	R44 E45 E51 N52	R44-A48 PolarHBondContact O-N 2.81Å; E45-A48 PolarHBondContact O-N 3.21Å; A48-E51 PolarHBondContact O-N 3.15Å; A48-N52 PolarHBondContact O-N 3.35Å; A48-N52 PolarHBondContact O-ND2 3.31Å; A48-N52 VanDerWaalsContact O-ND2 3.1Å
49	V	72	Confident	72	Confident	83 Å²	83	78.8 Å²	78.8	50%	0.503	39%	0.394	S	S	.	.	H	α-helix	trans	-66.4	-40.3	174.1	174.8	0	0	0	0	111.4	E45 K46 K47 E51 N52 L53	E45-V49 WeakPolarHBondContact O-CG2 3.4Å; E45-V49 PolarHBondContact O-N 3.47Å; K46-V49 PolarHBondContact O-N 2.9Å; K47-V49 PolarHBondContact O-N 2.9Å; V49-E51 VanDerWaalsContact C-N 3.32Å; V49-E51 PolarHBondContact O-N 3.47Å; V49-N52 PolarHBondContact O-N 3.15Å; V49-L53 PolarHBondContact O-N 3.07Å
50	I	74.5	Confident	72	Confident	34 Å²	34	85.4 Å²	85.4	17%	0.174	43%	0.426	C	S	.	.	H	α-helix	trans	-63.2	-39	175.6	-68.6	166.9	0	0	0	111.3	K46 K47 L53 A70 L74	K46-I50 VanDerWaalsContact O-CG1 3.31Å; K46-I50 WeakPolarHBondContact O-CG1 3.31Å; K46-I50 PolarHBondContact O-N 3.02Å; K47-I50 PolarHBondContact O-N 3.18Å; I50-L53 WeakPolarHBondContact O-CB 3.34Å; I50-L53 PolarHBondContact O-N 3.02Å; I50-A70 HydrophobicContact CD1-CB 3.77Å; I50-A70 HydrophobicContact CG1-CB 3.85Å; I50-L74 HydrophobicContact CD1-CD1 3.28Å
51	E	69.3	Low	72.3	Confident	124 Å²	124	89.6 Å²	89.6	58%	0.579	45%	0.445	S	S	*	.	H	α-helix	trans	-63.6	-44.9	175.4	-173.1	167.4	-161.4	0	0	111.5	K47 A48 V49 L53 R54	K47-E51 PolarHBondContact O-N 3.15Å; A48-E51 PolarHBondContact O-N 3.15Å; V49-E51 VanDerWaalsContact C-N 3.32Å; V49-E51 PolarHBondContact O-N 3.47Å; E51-L53 PolarHBondContact O-N 2.91Å; E51-R54 PolarHBondContact O-N 3.06Å
52	N	72.7	Confident	72.2	Confident	96 Å²	96	87.1 Å²	87.1	51%	0.513	43%	0.43	S	S	.	.	H	α-helix	trans	-67.5	-21.5	176.7	-76.4	-42.6	0	0	0	113.8	A48 V49 R54 C55 Q56	A48-N52 PolarHBondContact O-N 3.35Å; A48-N52 PolarHBondContact O-ND2 3.31Å; A48-N52 VanDerWaalsContact O-ND2 3.1Å; V49-N52 PolarHBondContact O-N 3.15Å; N52-R54 PolarHBondContact O-N 3.4Å; N52-C55 PolarHBondContact O-N 3.11Å; N52-Q56 PolarHBondContact O-N 3.23Å
53	L	70.4	Confident	72.4	Confident	17 Å²	17	86.9 Å²	86.9	9%	0.089	43%	0.429	C	S	.	.	H	α-helix	trans	-59.1	-29.1	177.5	-148.7	97.9	0	0	0	112.6	V49 I50 E51 C55 Q56 W58 K63 T66 L67	V49-L53 PolarHBondContact O-N 3.07Å; I50-L53 WeakPolarHBondContact O-CB 3.34Å; I50-L53 PolarHBondContact O-N 3.02Å; E51-L53 PolarHBondContact O-N 2.91Å; L53-C55 VanDerWaalsContact C-N 3.28Å; L53-C55 PolarHBondContact O-N 3.09Å; L53-Q56 PolarHBondContact O-N 3.27Å; L53-W58 HydrophobicContact CD1-CE3 4.4Å; L53-W58 HydrophobicContact CD1-CH2 4.23Å; L53-W58 HydrophobicContact CD1-CZ3 3.61Å; L53-W58 HydrophobicContact CG-CE3 4.47Å; L53-W58 HydrophobicContact CG-CZ3 4.14Å; L53-K63 HydrophobicContact CD2-CB 4.3Å; L53-K63 WeakPolarHBondContact CD2-O 3.23Å; L53-K63 WeakPolarHBondContact O-CE 3.38Å; L53-T66 WeakPolarHBondContact CD2-OG1 3.28Å; L53-L67 HydrophobicContact CD2-CB 4.04Å
54	R	63.9	Low	72.8	Confident	181 Å²	181	89.3 Å²	89.3	68%	0.683	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-35.5	177.8	-58.8	-177.3	90.4	173.8	10	111.3	E51 N52 K63	E51-R54 PolarHBondContact O-N 3.06Å; N52-R54 PolarHBondContact O-N 3.4Å; R54-K63 PolarHBondContact O-NZ 2.92Å
55	C	62.7	Low	73	Confident	109 Å²	109	89.1 Å²	89.1	74%	0.736	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-11.9	-177.6	-61.5	0	0	0	0	113.7	N52 L53	N52-C55 PolarHBondContact O-N 3.11Å; L53-C55 VanDerWaalsContact C-N 3.28Å; L53-C55 PolarHBondContact O-N 3.09Å
56	Q	68.8	Low	72.9	Confident	82 Å²	82	84.3 Å²	84.3	38%	0.383	42%	0.42	S	S	.	.	S	Bend	trans	-71.4	142.3	179.2	-67.3	-63.7	-18.6	0	0	111.9	N52 L53 W58 K63	N52-Q56 PolarHBondContact O-N 3.23Å; L53-Q56 PolarHBondContact O-N 3.27Å; Q56-W58 HydrophobicContact CB-CD2 4Å; Q56-W58 HydrophobicContact CB-CE3 4.48Å; Q56-W58 HydrophobicContact CB-CG 4.12Å; Q56-W58 HydrophobicContact CG-CZ2 4.4Å; Q56-W58 PolarHBondContact O-N 2.57Å; Q56-K63 WeakPolarHBondContact O-CE 3.21Å; Q56-K63 PolarHBondContact O-NZ 3.17Å
57	P	73	Confident	73.3	Confident	123 Å²	123	83.8 Å²	83.8	80%	0.799	42%	0.42	S	S	*	.			trans	-81.7	46.1	178.7	35.1	-36.2	0	0	0	112.3
58	W	72.7	Confident	73.6	Confident	86 Å²	86	88.4 Å²	88.4	33%	0.326	44%	0.436	S	S	.	.			trans	-93.9	149.7	179.7	-63.4	-12.2	0	0	0	112.3	L53 Q56 R62 K63 T66	L53-W58 HydrophobicContact CD1-CE3 4.4Å; L53-W58 HydrophobicContact CD1-CH2 4.23Å; L53-W58 HydrophobicContact CD1-CZ3 3.61Å; L53-W58 HydrophobicContact CG-CE3 4.47Å; L53-W58 HydrophobicContact CG-CZ3 4.14Å; Q56-W58 HydrophobicContact CB-CD2 4Å; Q56-W58 HydrophobicContact CB-CE3 4.48Å; Q56-W58 HydrophobicContact CB-CG 4.12Å; Q56-W58 HydrophobicContact CG-CZ2 4.4Å; Q56-W58 PolarHBondContact O-N 2.57Å; W58-R62 HydrophobicContact CE3-CG 4.4Å; W58-K63 HydrophobicContact CB-CG 3.82Å; W58-K63 HydrophobicContact CE3-CG 4.41Å; W58-K63 WeakPolarHBondContact O-CE 3.44Å; W58-T66 HydrophobicContact CZ3-CG2 4.08Å
59	P	77.5	Confident	73.7	Confident	80 Å²	80	88 Å²	88	52%	0.519	43%	0.429	S	S	.	.			trans	-58.2	144.1	171.1	22.4	-30.2	0	0	0	110.9	Q61 R62 K63	P59-Q61 PolarHBondContact O-N 2.98Å; P59-R62 HydrophobicContact CG-CB 3.86Å; P59-R62 WeakPolarHBondContact O-CB 3.19Å; P59-R62 PolarHBondContact O-N 3.41Å; P59-K63 PolarHBondContact O-N 3.39Å
60	M	70.1	Confident	73.9	Confident	160 Å²	160	84.8 Å²	84.8	79%	0.788	41%	0.411	S	S	*	.	H	α-helix	trans	-55.7	-39.3	-173.8	-176.1	-165.8	-86.3	0	0	112.3	R62 K63 L64	M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 2.93Å; M60-K63 PolarHBondContact O-N 2.88Å; M60-L64 WeakPolarHBondContact O-CB 3.35Å; M60-L64 PolarHBondContact O-N 3Å
61	Q	73.6	Confident	74.2	Confident	151 Å²	151	85.8 Å²	85.8	71%	0.706	42%	0.415	S	S	*	.	H	α-helix	trans	-60.7	-41	178	-67.5	180	-9.6	0	0	112	P59 L64 R65	P59-Q61 PolarHBondContact O-N 2.98Å; Q61-L64 PolarHBondContact O-N 2.9Å; Q61-R65 WeakPolarHBondContact O-CG 3.44Å; Q61-R65 PolarHBondContact O-N 3.46Å
62	R	75.4	Confident	74.6	Confident	62 Å²	62	86.8 Å²	86.8	23%	0.234	41%	0.414	C	S	.	.	H	α-helix	trans	-66.5	-48.2	176.3	-176	171.4	178.1	169.2	-3	111	D15 S18 W58 P59 M60 L64 R65 T66	D15-R62 IonicContact OD1-CZ 3.24Å; D15-R62 IonicContact OD1-NE 2.98Å; D15-R62 IonicContact OD1-NH1 3.15Å; D15-R62 PolarHBondContact OD1-NH1 3.23Å; S18-R62 PolarHBondContact OG-NH2 2.91Å; W58-R62 HydrophobicContact CE3-CG 4.4Å; P59-R62 HydrophobicContact CG-CB 3.86Å; P59-R62 WeakPolarHBondContact O-CB 3.19Å; P59-R62 PolarHBondContact O-N 3.41Å; M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 2.93Å; R62-L64 VanDerWaalsContact C-N 3.28Å; R62-L64 PolarHBondContact O-N 3.28Å; R62-R65 PolarHBondContact O-N 3.21Å; R62-T66 PolarHBondContact O-N 3.32Å; R62-T66 PolarHBondContact O-OG1 3.31Å
63	K	78	Confident	74.6	Confident	51 Å²	51	83 Å²	83	22%	0.222	39%	0.392	C	S	.	.	H	α-helix	trans	-54.7	-44.3	174.8	-70.4	-171.2	177.3	-177.9	0	112.2	L53 R54 Q56 W58 P59 M60 T66 L67	L53-K63 HydrophobicContact CD2-CB 4.3Å; L53-K63 WeakPolarHBondContact CD2-O 3.23Å; L53-K63 WeakPolarHBondContact O-CE 3.38Å; R54-K63 PolarHBondContact O-NZ 2.92Å; Q56-K63 WeakPolarHBondContact O-CE 3.21Å; Q56-K63 PolarHBondContact O-NZ 3.17Å; W58-K63 HydrophobicContact CB-CG 3.82Å; W58-K63 HydrophobicContact CE3-CG 4.41Å; W58-K63 WeakPolarHBondContact O-CE 3.44Å; P59-K63 PolarHBondContact O-N 3.39Å; M60-K63 PolarHBondContact O-N 2.88Å; K63-T66 WeakPolarHBondContact CA-OG1 3.23Å; K63-T66 PolarHBondContact O-OG1 2.82Å; K63-L67 WeakPolarHBondContact O-CB 3.22Å; K63-L67 PolarHBondContact O-N 2.91Å
64	L	78.1	Confident	74.7	Confident	65 Å²	65	82.8 Å²	82.8	34%	0.34	39%	0.391	S	S	.	.	H	α-helix	trans	-68.8	-37.7	-177.9	-162.4	70	0	0	0	111.7	M60 Q61 R62 R68	M60-L64 WeakPolarHBondContact O-CB 3.35Å; M60-L64 PolarHBondContact O-N 3Å; Q61-L64 PolarHBondContact O-N 2.9Å; R62-L64 VanDerWaalsContact C-N 3.28Å; R62-L64 PolarHBondContact O-N 3.28Å; L64-R68 WeakPolarHBondContact O-CB 3.35Å; L64-R68 VanDerWaalsContact O-CG 3.23Å; L64-R68 WeakPolarHBondContact O-CG 3.5Å; L64-R68 PolarHBondContact O-N 2.9Å
65	R	79.8	Confident	75.2	Confident	142 Å²	142	79.6 Å²	79.6	54%	0.536	38%	0.384	S	S	.	.	H	α-helix	trans	-66.8	-48.6	174.7	-74.6	-178.9	-173.1	168.5	3.7	112	Q61 R62 L67 R68 L69	Q61-R65 WeakPolarHBondContact O-CG 3.44Å; Q61-R65 PolarHBondContact O-N 3.46Å; R62-R65 PolarHBondContact O-N 3.21Å; R65-L67 VanDerWaalsContact C-N 3.3Å; R65-L67 PolarHBondContact O-N 3.33Å; R65-R68 PolarHBondContact O-N 3.24Å; R65-L69 PolarHBondContact O-N 3.49Å
66	T	75.3	Confident	75.8	Confident	15 Å²	15	81.6 Å²	81.6	9%	0.092	38%	0.376	C	S	.	.	H	α-helix	trans	-63	-37.9	177.5	50.5	0	0	0	0	111.8	L53 W58 R62 K63 L69 A70	L53-T66 WeakPolarHBondContact CD2-OG1 3.28Å; W58-T66 HydrophobicContact CZ3-CG2 4.08Å; R62-T66 PolarHBondContact O-N 3.32Å; R62-T66 PolarHBondContact O-OG1 3.31Å; K63-T66 WeakPolarHBondContact CA-OG1 3.23Å; K63-T66 PolarHBondContact O-OG1 2.82Å; T66-L69 PolarHBondContact O-N 2.7Å; T66-A70 VanDerWaalsContact O-CB 3.28Å; T66-A70 WeakPolarHBondContact O-CB 3.33Å; T66-A70 PolarHBondContact O-N 2.91Å
67	L	79.6	Confident	75.9	Confident	35 Å²	35	78.2 Å²	78.2	18%	0.183	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-43.3	175.2	-174.8	150	0	0	0	111.6	L53 K63 R65 A70 Q71	L53-L67 HydrophobicContact CD2-CB 4.04Å; K63-L67 WeakPolarHBondContact O-CB 3.22Å; K63-L67 PolarHBondContact O-N 2.91Å; R65-L67 VanDerWaalsContact C-N 3.3Å; R65-L67 PolarHBondContact O-N 3.33Å; L67-A70 PolarHBondContact O-N 3.41Å; L67-Q71 VanDerWaalsContact CD2-CD 3.42Å; L67-Q71 HydrophobicContact CD2-CG 4.14Å; L67-Q71 WeakPolarHBondContact O-CB 3.32Å; L67-Q71 VanDerWaalsContact O-CG 3.3Å; L67-Q71 WeakPolarHBondContact O-CG 3.41Å; L67-Q71 PolarHBondContact O-N 3.24Å
68	R	82.6	Confident	75.6	Confident	129 Å²	129	73.7 Å²	73.7	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-42.2	176.1	-75.1	175.7	-159.3	173.8	2.6	112.6	L64 R65 Q71 R72	L64-R68 WeakPolarHBondContact O-CB 3.35Å; L64-R68 VanDerWaalsContact O-CG 3.23Å; L64-R68 WeakPolarHBondContact O-CG 3.5Å; L64-R68 PolarHBondContact O-N 2.9Å; R65-R68 PolarHBondContact O-N 3.24Å; R68-Q71 PolarHBondContact O-N 2.81Å; R68-R72 WeakPolarHBondContact O-CG 3.36Å; R68-R72 PolarHBondContact O-N 3.45Å
69	L	78.6	Confident	75.3	Confident	23 Å²	23	73.4 Å²	73.4	12%	0.12	34%	0.344	C	S	.	.	H	α-helix	trans	-65.1	-46.4	177.1	-72.8	173.9	0	0	0	111.2	L19 R65 T66 Q71 R72 Y73	L19-L69 HydrophobicContact CD2-CD1 3.52Å; L19-L69 HydrophobicContact CG-CD1 4.14Å; R65-L69 PolarHBondContact O-N 3.49Å; T66-L69 PolarHBondContact O-N 2.7Å; L69-Q71 VanDerWaalsContact C-N 3.33Å; L69-Q71 PolarHBondContact O-N 2.79Å; L69-R72 PolarHBondContact O-N 2.78Å; L69-Y73 PolarHBondContact O-N 2.94Å
70	A	76.4	Confident	74.8	Confident	15 Å²	15	75.9 Å²	75.9	12%	0.124	35%	0.347	C	S	.	.	H	α-helix	trans	-62.8	-37.9	176.8	0	0	0	0	0	112.5	I50 T66 L67 Y73 L74	I50-A70 HydrophobicContact CD1-CB 3.77Å; I50-A70 HydrophobicContact CG1-CB 3.85Å; T66-A70 VanDerWaalsContact O-CB 3.28Å; T66-A70 WeakPolarHBondContact O-CB 3.33Å; T66-A70 PolarHBondContact O-N 2.91Å; L67-A70 PolarHBondContact O-N 3.41Å; A70-Y73 PolarHBondContact O-N 3.32Å; A70-L74 WeakPolarHBondContact O-CB 3.37Å; A70-L74 PolarHBondContact O-N 2.67Å
71	Q	79.1	Confident	74.5	Confident	56 Å²	56	68.9 Å²	68.9	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-43.4	173.6	-80.9	-179.5	-28.7	0	0	112.5	L67 R68 L69 Y73 L74 Q75	L67-Q71 VanDerWaalsContact CD2-CD 3.42Å; L67-Q71 HydrophobicContact CD2-CG 4.14Å; L67-Q71 WeakPolarHBondContact O-CB 3.32Å; L67-Q71 VanDerWaalsContact O-CG 3.3Å; L67-Q71 WeakPolarHBondContact O-CG 3.41Å; L67-Q71 PolarHBondContact O-N 3.24Å; R68-Q71 PolarHBondContact O-N 2.81Å; L69-Q71 VanDerWaalsContact C-N 3.33Å; L69-Q71 PolarHBondContact O-N 2.79Å; Q71-Y73 VanDerWaalsContact C-N 3.32Å; Q71-Y73 PolarHBondContact O-N 3.01Å; Q71-L74 PolarHBondContact O-N 2.99Å; Q71-Q75 WeakPolarHBondContact O-CB 3.47Å; Q71-Q75 VanDerWaalsContact O-CG 3.32Å; Q71-Q75 WeakPolarHBondContact O-CG 3.47Å; Q71-Q75 PolarHBondContact O-N 3.27Å
72	R	78.7	Confident	74.1	Confident	144 Å²	144	63.7 Å²	63.7	54%	0.543	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-40.5	176.4	-74.6	175.8	-174.5	170.4	-1.2	111.8	R68 L69 R76	R68-R72 WeakPolarHBondContact O-CG 3.36Å; R68-R72 PolarHBondContact O-N 3.45Å; L69-R72 PolarHBondContact O-N 2.78Å; R72-R76 WeakPolarHBondContact O-CG 3.48Å; R72-R76 PolarHBondContact O-N 3.28Å; R72-R76 VanDerWaalsContact O-N 3.12Å
73	Y	73.2	Confident	73.4	Confident	16 Å²	16	71.6 Å²	71.6	6%	0.063	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-48.1	174.9	177.9	-91	0	0	0	111.5	L26 E29 K46 L69 A70 Q71 Q75 R76 Q77	L26-Y73 HydrophobicContact CB-CD2 4.1Å; L26-Y73 HydrophobicContact CB-CE2 4.41Å; L26-Y73 HydrophobicContact CD2-CD1 4.21Å; L26-Y73 HydrophobicContact CD2-CD2 3.64Å; L26-Y73 HydrophobicContact CD2-CE1 4.46Å; L26-Y73 HydrophobicContact CD2-CE2 3.88Å; L26-Y73 HydrophobicContact CD2-CG 3.79Å; L26-Y73 HydrophobicContact CG-CD2 4.34Å; E29-Y73 PolarHBondContact OE2-OH 2.95Å; K46-Y73 HydrophobicContact CG-CE1 4.28Å; L69-Y73 PolarHBondContact O-N 2.94Å; A70-Y73 PolarHBondContact O-N 3.32Å; Q71-Y73 VanDerWaalsContact C-N 3.32Å; Q71-Y73 PolarHBondContact O-N 3.01Å; Y73-Q75 VanDerWaalsContact C-N 3.34Å; Y73-Q75 PolarHBondContact O-N 3.4Å; Y73-R76 PolarHBondContact O-N 2.81Å; Y73-R76 VanDerWaalsContact O-N 3.15Å; Y73-Q77 HydrophobicContact CD1-CG 4.21Å; Y73-Q77 HydrophobicContact CE1-CG 3.8Å; Y73-Q77 HydrophobicContact CE2-CG 4.42Å; Y73-Q77 WeakPolarHBondContact O-CG 3.47Å; Y73-Q77 PolarHBondContact O-N 3.06Å
74	L	72.3	Confident	72.6	Confident	14 Å²	14	74.4 Å²	74.4	7%	0.073	35%	0.345	C	S	.	.	H	α-helix	trans	-57.7	-44.7	175.3	-92.8	160.2	0	0	0	112.1	I43 K47 I50 A70 Q71 R76 Q77 E78	I43-L74 HydrophobicContact CB-CD2 4.35Å; I43-L74 HydrophobicContact CG1-CD2 4.33Å; I43-L74 HydrophobicContact CG2-CD2 3.77Å; K47-L74 HydrophobicContact CD-CD2 4.46Å; K47-L74 HydrophobicContact CG-CD1 4.16Å; K47-L74 HydrophobicContact CG-CD2 4.18Å; I50-L74 HydrophobicContact CD1-CD1 3.28Å; A70-L74 WeakPolarHBondContact O-CB 3.37Å; A70-L74 PolarHBondContact O-N 2.67Å; Q71-L74 PolarHBondContact O-N 2.99Å; L74-R76 VanDerWaalsContact C-N 3.31Å; L74-R76 PolarHBondContact O-N 3.46Å; L74-Q77 PolarHBondContact O-N 3.23Å; L74-E78 WeakPolarHBondContact O-CB 3.47Å; L74-E78 WeakPolarHBondContact O-CG 3.34Å; L74-E78 PolarHBondContact O-N 3.17Å
75	Q	72.9	Confident	72	Confident	113 Å²	113	73.7 Å²	73.7	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-39.4	176.5	-76.6	177.9	-21.5	0	0	112.5	Q71 Y73 A79	Q71-Q75 WeakPolarHBondContact O-CB 3.47Å; Q71-Q75 VanDerWaalsContact O-CG 3.32Å; Q71-Q75 WeakPolarHBondContact O-CG 3.47Å; Q71-Q75 PolarHBondContact O-N 3.27Å; Y73-Q75 VanDerWaalsContact C-N 3.34Å; Y73-Q75 PolarHBondContact O-N 3.4Å; Q75-A79 WeakPolarHBondContact O-CB 3.47Å; Q75-A79 PolarHBondContact O-N 2.92Å
76	R	76.3	Confident	71.4	Confident	151 Å²	151	69.9 Å²	69.9	57%	0.57	33%	0.33	S	S	*	.	H	α-helix	trans	-67.8	-37.6	176.2	-73	178.5	-174.8	169.7	1.9	112.7	R72 Y73 L74	R72-R76 WeakPolarHBondContact O-CG 3.48Å; R72-R76 PolarHBondContact O-N 3.28Å; R72-R76 VanDerWaalsContact O-N 3.12Å; Y73-R76 PolarHBondContact O-N 2.81Å; Y73-R76 VanDerWaalsContact O-N 3.15Å; L74-R76 VanDerWaalsContact C-N 3.31Å; L74-R76 PolarHBondContact O-N 3.46Å
77	Q	69.9	Low	71.3	Confident	12 Å²	12	75 Å²	75	6%	0.056	36%	0.356	C	S	.	.	H	α-helix	trans	-78.5	-40.1	-179.9	-63.9	-57.4	-14.6	0	0	112.3	D30 L39 I43 Y73 L74 A79 K80	D30-Q77 PolarHBondContact OD1-NE2 3.39Å; L39-Q77 HydrophobicContact CD1-CB 4.09Å; L39-Q77 HydrophobicContact CD1-CG 4.34Å; L39-Q77 VanDerWaalsContact CD1-OE1 3.23Å; I43-Q77 HydrophobicContact CD1-CB 4.23Å; I43-Q77 HydrophobicContact CG1-CB 4.22Å; Y73-Q77 HydrophobicContact CD1-CG 4.21Å; Y73-Q77 HydrophobicContact CE1-CG 3.8Å; Y73-Q77 HydrophobicContact CE2-CG 4.42Å; Y73-Q77 WeakPolarHBondContact O-CG 3.47Å; Y73-Q77 PolarHBondContact O-N 3.06Å; L74-Q77 PolarHBondContact O-N 3.23Å; Q77-A79 PolarHBondContact O-N 3.45Å; Q77-K80 PolarHBondContact O-N 2.81Å; Q77-K80 VanDerWaalsContact O-N 3.11Å
78	E	67.3	Low	71.1	Confident	28 Å²	28	81.8 Å²	81.8	13%	0.131	38%	0.379	C	S	.	.	H	α-helix	trans	-61.8	-32.8	175.8	-74.4	178.6	-179.1	0	0	111.6	I43 K47 L74 K80 V81	I43-E78 HydrophobicContact CD1-CG 4.41Å; K47-E78 WeakPolarHBondContact CE-OE1 3.46Å; K47-E78 IonicContact NZ-OE1 3.83Å; K47-E78 PolarHBondContact NZ-OE1 3.05Å; L74-E78 WeakPolarHBondContact O-CB 3.47Å; L74-E78 WeakPolarHBondContact O-CG 3.34Å; L74-E78 PolarHBondContact O-N 3.17Å; E78-K80 PolarHBondContact O-N 2.93Å; E78-V81 PolarHBondContact O-N 3.35Å; E78-V81 VanDerWaalsContact O-N 3.16Å
79	A	67.1	Low	70.4	Confident	79 Å²	79	76.2 Å²	76.2	65%	0.653	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.7	175.4	0	0	0	0	0	114.5	Q75 Q77 V81	Q75-A79 WeakPolarHBondContact O-CB 3.47Å; Q75-A79 PolarHBondContact O-N 2.92Å; Q77-A79 PolarHBondContact O-N 3.45Å; A79-V81 VanDerWaalsContact C-N 3.35Å
80	K	67.5	Low	70.1	Confident	133 Å²	133	77.8 Å²	77.8	58%	0.578	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.1	176.8	-64.5	176	-175.4	168.8	0	112.6	D30 L39 Q77 E78	D30-K80 IonicContact OD1-NZ 2.9Å; L39-K80 HydrophobicContact CD2-CB 4.29Å; Q77-K80 PolarHBondContact O-N 2.81Å; Q77-K80 VanDerWaalsContact O-N 3.11Å; E78-K80 PolarHBondContact O-N 2.93Å
81	V	62.3	Low	70.2	Confident	12 Å²	12	82.1 Å²	82.1	7%	0.073	39%	0.392	C	S	.	.	S	Bend	trans	-93.9	142.9	-175.6	-173.6	0	0	0	0	111.4	L39 M40 I43 E78 A79	L39-V81 HydrophobicContact CD2-CG2 3.78Å; L39-V81 HydrophobicContact CG-CG2 4.41Å; M40-V81 HydrophobicContact SD-CG1 3.94Å; M40-V81 HydrophobicContact SD-CG2 4.21Å; I43-V81 HydrophobicContact CD1-CG2 4.27Å; E78-V81 PolarHBondContact O-N 3.35Å; E78-V81 VanDerWaalsContact O-N 3.16Å; A79-V81 VanDerWaalsContact C-N 3.35Å
82	S	65	Low	70.1	Confident	43 Å²	43	82.8 Å²	82.8	30%	0.301	40%	0.395	S	S	.	.			trans	-41.2	137.1	-173.3	-174.4	0	0	0	0	116.7	R36 T84 H85	R36-S82 VanDerWaalsContact NH2-CB 3.35Å; S82-T84 PolarHBondContact O-N 2.9Å; S82-T84 VanDerWaalsContact O-N 3.11Å; S82-T84 PolarHBondContact OG-OG1 3.41Å; S82-H85 WeakPolarHBondContact O-CB 3.15Å; S82-H85 PolarHBondContact O-N 2.98Å; S82-H85 VanDerWaalsContact O-N 3.13Å
83	R	61.6	Low	70	Confident	227 Å²	227	78.2 Å²	78.2	86%	0.857	38%	0.379	S	S	*	.	H	α-helix	trans	-54.8	-28.6	179.7	-69.6	-174.8	175.3	178	-1	115.2	L87	R83-L87 PolarHBondContact O-N 2.86Å
84	T	62.1	Low	70.3	Confident	110 Å²	110	86.9 Å²	86.9	68%	0.675	41%	0.411	S	S	*	.	H	α-helix	trans	-76	-29.8	-179.1	50.6	0	0	0	0	113.1	S82	S82-T84 PolarHBondContact O-N 2.9Å; S82-T84 VanDerWaalsContact O-N 3.11Å; S82-T84 PolarHBondContact OG-OG1 3.41Å
85	H	65.4	Low	70.4	Confident	50 Å²	50	94.4 Å²	94.4	23%	0.231	44%	0.439	C	S	.	.	H	α-helix	trans	-69.1	-42.9	174.3	-163.2	-102.3	0	0	0	110.8	S82 L87 R88 E89	S82-H85 WeakPolarHBondContact O-CB 3.15Å; S82-H85 PolarHBondContact O-N 2.98Å; S82-H85 VanDerWaalsContact O-N 3.13Å; H85-L87 VanDerWaalsContact C-N 3.32Å; H85-L87 PolarHBondContact O-N 3.42Å; H85-R88 PolarHBondContact O-N 3.49Å; H85-R88 VanDerWaalsContact O-N 3.16Å; H85-E89 IonicContact CE1-OE1 3.74Å; H85-E89 PolarHBondContact CE1-OE1 3.03Å; H85-E89 IonicContact CE1-OE2 2.67Å; H85-E89 PolarHBondContact CE1-OE2 2.93Å; H85-E89 IonicContact CG-OE2 3.45Å; H85-E89 IonicContact ND1-OE1 3.28Å; H85-E89 PolarHBondContact ND1-OE1 2.86Å; H85-E89 VanDerWaalsContact ND1-OE1 3.12Å; H85-E89 IonicContact ND1-OE2 3.85Å; H85-E89 PolarHBondContact ND1-OE2 3.44Å; H85-E89 IonicContact NE2-OE1 2.76Å; H85-E89 WeakPolarHBondContact O-CG 3.3Å; H85-E89 PolarHBondContact O-N 2.79Å
86	L	65.5	Low	70.6	Confident	62 Å²	62	94.3 Å²	94.3	33%	0.325	44%	0.437	S	S	.	.	H	α-helix	trans	-58.6	-38.1	178.1	-67.6	171.6	0	0	0	112.8	S90	L86-S90 VanDerWaalsContact O-CB 3.25Å; L86-S90 WeakPolarHBondContact O-CB 3.41Å; L86-S90 PolarHBondContact O-N 3.46Å; L86-S90 PolarHBondContact O-OG 2.82Å
87	L	73.9	Confident	70.7	Confident	123 Å²	123	89.1 Å²	89.1	64%	0.644	43%	0.426	S	S	*	.	H	α-helix	trans	-66.4	-44.2	176.7	-165.9	90	0	0	0	112	R83 H85 S90 I91	R83-L87 PolarHBondContact O-N 2.86Å; H85-L87 VanDerWaalsContact C-N 3.32Å; H85-L87 PolarHBondContact O-N 3.42Å; L87-S90 WeakPolarHBondContact O-CB 3.34Å; L87-S90 PolarHBondContact O-N 3.45Å; L87-I91 WeakPolarHBondContact O-CG1 3.33Å; L87-I91 PolarHBondContact O-N 3.37Å; L87-I91 VanDerWaalsContact O-N 3.09Å
88	R	75.7	Confident	71.1	Confident	178 Å²	178	93.4 Å²	93.4	67%	0.672	45%	0.445	S	S	*	.	H	α-helix	trans	-64.7	-43.6	179.1	-176	177.7	179.8	175.9	-0.5	111.4	H85 I91 Q92	H85-R88 PolarHBondContact O-N 3.49Å; H85-R88 VanDerWaalsContact O-N 3.16Å; R88-I91 PolarHBondContact O-N 3.08Å; R88-Q92 PolarHBondContact O-N 3.23Å; R88-Q92 VanDerWaalsContact O-N 3.08Å
89	E	67.8	Low	71.8	Confident	11 Å²	11	94 Å²	94	5%	0.051	45%	0.452	C	S	.	.	H	α-helix	trans	-66.5	-37.2	175.9	-72.9	176.3	144.8	0	0	111.9	H85 I91 Q92 K93 E1027 Q1028	H85-E89 IonicContact CE1-OE1 3.74Å; H85-E89 PolarHBondContact CE1-OE1 3.03Å; H85-E89 IonicContact CE1-OE2 2.67Å; H85-E89 PolarHBondContact CE1-OE2 2.93Å; H85-E89 IonicContact CG-OE2 3.45Å; H85-E89 IonicContact ND1-OE1 3.28Å; H85-E89 PolarHBondContact ND1-OE1 2.86Å; H85-E89 VanDerWaalsContact ND1-OE1 3.12Å; H85-E89 IonicContact ND1-OE2 3.85Å; H85-E89 PolarHBondContact ND1-OE2 3.44Å; H85-E89 IonicContact NE2-OE1 2.76Å; H85-E89 WeakPolarHBondContact O-CG 3.3Å; H85-E89 PolarHBondContact O-N 2.79Å; E89-I91 PolarHBondContact O-N 2.97Å; E89-Q92 PolarHBondContact O-N 3.1Å; E89-K93 WeakPolarHBondContact O-CB 3.43Å; E89-K93 VanDerWaalsContact O-CG 3.25Å; E89-K93 WeakPolarHBondContact O-CG 3.36Å; E89-K93 PolarHBondContact O-N 2.86Å; E89-E1027 WeakPolarHBondContact CB-OE1 3.45Å; E89-E1027 HydrophobicContact CG-CG 4.42Å; E89-E1027 VanDerWaalsContact OE1-OE1 3.13Å; E89-E1027 VanDerWaalsContact OE1-OE2 3.09Å; E89-Q1028 PolarHBondContact OE1-OE1 3.2Å
90	S	71.8	Confident	72.2	Confident	56 Å²	56	96.7 Å²	96.7	39%	0.392	45%	0.445	S	S	.	.	H	α-helix	trans	-61.1	-43.2	174.9	-63.5	0	0	0	0	112.3	L86 L87 K93 R94	L86-S90 VanDerWaalsContact O-CB 3.25Å; L86-S90 WeakPolarHBondContact O-CB 3.41Å; L86-S90 PolarHBondContact O-N 3.46Å; L86-S90 PolarHBondContact O-OG 2.82Å; L87-S90 WeakPolarHBondContact O-CB 3.34Å; L87-S90 PolarHBondContact O-N 3.45Å; S90-K93 PolarHBondContact O-N 3.41Å; S90-R94 WeakPolarHBondContact O-CG 3.31Å; S90-R94 PolarHBondContact O-N 2.96Å
91	I	78.1	Confident	72.7	Confident	107 Å²	107	97.2 Å²	97.2	55%	0.549	44%	0.443	S	S	.	.	H	α-helix	trans	-66.1	-44.1	176.5	-67.7	170.2	0	0	0	110.7	L87 R88 E89 K93 R94 W95	L87-I91 WeakPolarHBondContact O-CG1 3.33Å; L87-I91 PolarHBondContact O-N 3.37Å; L87-I91 VanDerWaalsContact O-N 3.09Å; R88-I91 PolarHBondContact O-N 3.08Å; E89-I91 PolarHBondContact O-N 2.97Å; I91-K93 PolarHBondContact O-N 3.48Å; I91-R94 PolarHBondContact O-N 2.87Å; I91-W95 WeakPolarHBondContact O-CB 3.46Å; I91-W95 PolarHBondContact O-N 3.44Å
92	Q	78.8	Confident	73.3	Confident	69 Å²	69	102.1 Å²	102.1	32%	0.322	46%	0.464	S	S	.	.	H	α-helix	trans	-64.2	-38.6	175.8	-76.6	-172.3	-16.7	0	0	112.7	R88 E89 W95 K96	R88-Q92 PolarHBondContact O-N 3.23Å; R88-Q92 VanDerWaalsContact O-N 3.08Å; E89-Q92 PolarHBondContact O-N 3.1Å; Q92-W95 PolarHBondContact O-N 2.88Å; Q92-K96 WeakPolarHBondContact O-CB 3.48Å; Q92-K96 WeakPolarHBondContact O-CG 2.98Å; Q92-K96 PolarHBondContact O-N 3.36Å
93	K	76.4	Confident	73.6	Confident	48 Å²	48	101 Å²	101	21%	0.209	46%	0.458	C	S	.	.	H	α-helix	trans	-61.3	-45.3	173	-76.4	175.1	-132.4	-172.3	0	110.7	E89 S90 I91 K96 A97 S1026 E1027	E89-K93 WeakPolarHBondContact O-CB 3.43Å; E89-K93 VanDerWaalsContact O-CG 3.25Å; E89-K93 WeakPolarHBondContact O-CG 3.36Å; E89-K93 PolarHBondContact O-N 2.86Å; S90-K93 PolarHBondContact O-N 3.41Å; I91-K93 PolarHBondContact O-N 3.48Å; K93-K96 PolarHBondContact O-N 3.39Å; K93-A97 VanDerWaalsContact O-CB 3.25Å; K93-A97 WeakPolarHBondContact O-CB 3.36Å; K93-A97 PolarHBondContact O-N 2.91Å; K93-S1026 WeakPolarHBondContact CE-OG 3.4Å; K93-S1026 PolarHBondContact NZ-OG 3.31Å; K93-E1027 WeakPolarHBondContact CE-OE1 3.43Å; K93-E1027 IonicContact NZ-OE1 3.55Å; K93-E1027 PolarHBondContact NZ-OE1 3.31Å
94	R	78	Confident	74.2	Confident	199 Å²	199	93 Å²	93	75%	0.751	43%	0.432	S	S	*	.	H	α-helix	trans	-63	-44.2	175	-76.4	-178.5	179.7	-177.8	0.9	112.4	S90 I91 A97 F98	S90-R94 WeakPolarHBondContact O-CG 3.31Å; S90-R94 PolarHBondContact O-N 2.96Å; I91-R94 PolarHBondContact O-N 2.87Å; R94-A97 WeakPolarHBondContact O-CB 3.34Å; R94-A97 PolarHBondContact O-N 3.16Å; R94-F98 WeakPolarHBondContact O-CB 3.19Å; R94-F98 PolarHBondContact O-N 3.18Å
95	W	75.3	Confident	74.6	Confident	171 Å²	171	90 Å²	90	65%	0.648	41%	0.411	S	S	*	.	H	α-helix	trans	-64.4	-45.3	176.8	-172.3	-103.3	0	0	0	112.1	I91 Q92 A97 F98 C99	I91-W95 WeakPolarHBondContact O-CB 3.46Å; I91-W95 PolarHBondContact O-N 3.44Å; Q92-W95 PolarHBondContact O-N 2.88Å; W95-A97 VanDerWaalsContact C-N 3.33Å; W95-A97 PolarHBondContact O-N 3.24Å; W95-F98 CarbonylContact O-C 3.55Å; W95-F98 WeakPolarHBondContact O-CB 3.43Å; W95-F98 PolarHBondContact O-N 2.81Å; W95-C99 PolarHBondContact O-N 2.74Å; W95-C99 PolarHBondContact O-SG 3.14Å; W95-C99 VanDerWaalsContact O-SG 3.37Å
96	K	77.4	Confident	74.5	Confident	112 Å²	112	89.8 Å²	89.8	49%	0.487	42%	0.415	S	S	.	.	H	α-helix	trans	-63.2	-38.7	173.9	-74	175.8	-179.2	174.1	0	111.6	Q92 K93 R100	Q92-K96 WeakPolarHBondContact O-CB 3.48Å; Q92-K96 WeakPolarHBondContact O-CG 2.98Å; Q92-K96 PolarHBondContact O-N 3.36Å; K93-K96 PolarHBondContact O-N 3.39Å; K96-R100 WeakPolarHBondContact O-CB 3.48Å; K96-R100 VanDerWaalsContact O-CG 3.24Å; K96-R100 WeakPolarHBondContact O-CG 3.41Å; K96-R100 PolarHBondContact O-N 3.48Å; K96-R100 PolarHBondContact O-NE 3.41Å
97	A	78.3	Confident	74.3	Confident	42 Å²	42	89.8 Å²	89.8	35%	0.347	42%	0.415	S	S	.	.	H	α-helix	trans	-62.7	-42.7	172.7	0	0	0	0	0	111.4	K93 R94 W95 R100 W101	K93-A97 VanDerWaalsContact O-CB 3.25Å; K93-A97 WeakPolarHBondContact O-CB 3.36Å; K93-A97 PolarHBondContact O-N 2.91Å; R94-A97 WeakPolarHBondContact O-CB 3.34Å; R94-A97 PolarHBondContact O-N 3.16Å; W95-A97 VanDerWaalsContact C-N 3.33Å; W95-A97 PolarHBondContact O-N 3.24Å; A97-R100 CarbonylContact O-C 3.49Å; A97-R100 WeakPolarHBondContact O-CB 3.33Å; A97-R100 PolarHBondContact O-N 2.89Å; A97-W101 WeakPolarHBondContact O-CB 3.28Å; A97-W101 PolarHBondContact O-N 3.4Å
98	F	78.4	Confident	73.8	Confident	101 Å²	101	93.4 Å²	93.4	44%	0.443	42%	0.421	S	S	.	.	H	α-helix	trans	-63.6	-46.9	174.3	-179.5	-103.3	0	0	0	112.3	R94 W95 R100 W101 F102	R94-F98 WeakPolarHBondContact O-CB 3.19Å; R94-F98 PolarHBondContact O-N 3.18Å; W95-F98 CarbonylContact O-C 3.55Å; W95-F98 WeakPolarHBondContact O-CB 3.43Å; W95-F98 PolarHBondContact O-N 2.81Å; F98-R100 VanDerWaalsContact C-N 3.26Å; F98-R100 PolarHBondContact O-N 3.19Å; F98-W101 HydrophobicContact CD2-CE3 4.07Å; F98-W101 HydrophobicContact CD2-CZ3 4.48Å; F98-W101 AromaticContact CE2-CE3 3.92Å; F98-W101 HydrophobicContact CE2-CE3 3.92Å; F98-W101 AromaticContact CE2-CZ3 3.9Å; F98-W101 HydrophobicContact CE2-CZ3 3.9Å; F98-W101 WeakPolarHBondContact O-CB 3.31Å; F98-W101 PolarHBondContact O-N 3.15Å; F98-W101 VanDerWaalsContact O-N 3.15Å; F98-F102 WeakPolarHBondContact O-CB 3.49Å; F98-F102 PolarHBondContact O-N 2.85Å
99	C	81.2	Confident	73.1	Confident	41 Å²	41	90.9 Å²	90.9	28%	0.277	42%	0.42	S	S	.	.	H	α-helix	trans	-64	-28.4	174.1	-66.1	0	0	0	0	113	W95 A103 R794	W95-C99 PolarHBondContact O-N 2.74Å; W95-C99 PolarHBondContact O-SG 3.14Å; W95-C99 VanDerWaalsContact O-SG 3.37Å; C99-A103 WeakPolarHBondContact O-CB 3.24Å; C99-A103 PolarHBondContact O-N 2.92Å; C99-R794 PolarHBondContact O-NH2 2.71Å
100	R	75	Confident	72.9	Confident	135 Å²	135	92.8 Å²	92.8	51%	0.509	43%	0.43	S	S	.	.	H	α-helix	trans	-74.7	-40.5	171.7	-78.4	-175.1	-68.7	-179.1	0.7	111.3	K96 A97 F98 A103 N104	K96-R100 WeakPolarHBondContact O-CB 3.48Å; K96-R100 VanDerWaalsContact O-CG 3.24Å; K96-R100 WeakPolarHBondContact O-CG 3.41Å; K96-R100 PolarHBondContact O-N 3.48Å; K96-R100 PolarHBondContact O-NE 3.41Å; A97-R100 CarbonylContact O-C 3.49Å; A97-R100 WeakPolarHBondContact O-CB 3.33Å; A97-R100 PolarHBondContact O-N 2.89Å; F98-R100 VanDerWaalsContact C-N 3.26Å; F98-R100 PolarHBondContact O-N 3.19Å; R100-A103 PolarHBondContact O-N 2.85Å; R100-N104 PolarHBondContact O-N 3.28Å; R100-N104 PolarHBondContact O-ND2 2.8Å
101	W	77.9	Confident	72.6	Confident	144 Å²	144	92.8 Å²	92.8	55%	0.545	43%	0.429	S	S	.	.	H	α-helix	trans	-61.5	-47.7	173.3	179.2	82.7	0	0	0	110.7	A97 F98 A103 N104 I105	A97-W101 WeakPolarHBondContact O-CB 3.28Å; A97-W101 PolarHBondContact O-N 3.4Å; F98-W101 HydrophobicContact CD2-CE3 4.07Å; F98-W101 HydrophobicContact CD2-CZ3 4.48Å; F98-W101 AromaticContact CE2-CE3 3.92Å; F98-W101 HydrophobicContact CE2-CE3 3.92Å; F98-W101 AromaticContact CE2-CZ3 3.9Å; F98-W101 HydrophobicContact CE2-CZ3 3.9Å; F98-W101 WeakPolarHBondContact O-CB 3.31Å; F98-W101 PolarHBondContact O-N 3.15Å; F98-W101 VanDerWaalsContact O-N 3.15Å; W101-A103 VanDerWaalsContact C-N 3.31Å; W101-A103 PolarHBondContact O-N 3.05Å; W101-N104 WeakPolarHBondContact O-CB 3.29Å; W101-N104 PolarHBondContact O-N 3.44Å; W101-N104 VanDerWaalsContact O-N 3.14Å; W101-I105 HydrophobicContact CD2-CD1 3.55Å; W101-I105 HydrophobicContact CD2-CG1 4.43Å; W101-I105 HydrophobicContact CE3-CD1 3.76Å; W101-I105 HydrophobicContact CG-CD1 4.37Å; W101-I105 HydrophobicContact CH2-CD1 3.34Å; W101-I105 HydrophobicContact CZ2-CD1 3.12Å; W101-I105 HydrophobicContact CZ2-CG1 4.48Å; W101-I105 HydrophobicContact CZ3-CD1 3.65Å; W101-I105 WeakPolarHBondContact O-CB 3.43Å; W101-I105 PolarHBondContact O-N 2.87Å
102	F	76.8	Confident	72.4	Confident	115 Å²	115	88.8 Å²	88.8	50%	0.504	41%	0.407	S	S	.	.	H	α-helix	trans	-62.5	-34.6	173.6	-162.2	-90.1	0	0	0	112.3	F98 I105 S106	F98-F102 WeakPolarHBondContact O-CB 3.49Å; F98-F102 PolarHBondContact O-N 2.85Å; F102-I105 PolarHBondContact O-N 3.46Å; F102-S106 WeakPolarHBondContact O-CA 3.28Å; F102-S106 WeakPolarHBondContact O-CB 3.36Å; F102-S106 PolarHBondContact O-N 3.44Å
103	A	70.7	Confident	72.4	Confident	21 Å²	21	86.2 Å²	86.2	17%	0.174	40%	0.395	C	S	.	.	H	α-helix	trans	-69.4	-38.6	173.1	0	0	0	0	0	112.8	C99 R100 W101 S106 I107	C99-A103 WeakPolarHBondContact O-CB 3.24Å; C99-A103 PolarHBondContact O-N 2.92Å; R100-A103 PolarHBondContact O-N 2.85Å; W101-A103 VanDerWaalsContact C-N 3.31Å; W101-A103 PolarHBondContact O-N 3.05Å; A103-S106 PolarHBondContact O-N 3.48Å; A103-I107 WeakPolarHBondContact O-CG1 3.39Å; A103-I107 PolarHBondContact O-N 3.41Å
104	N	74.1	Confident	72.4	Confident	59 Å²	59	87.7 Å²	87.7	32%	0.316	42%	0.417	S	S	.	.	H	α-helix	trans	-65.4	-42.2	173	-73.7	-43.8	0	0	0	110.8	R100 W101 I107 Y108 K1020	R100-N104 PolarHBondContact O-N 3.28Å; R100-N104 PolarHBondContact O-ND2 2.8Å; W101-N104 WeakPolarHBondContact O-CB 3.29Å; W101-N104 PolarHBondContact O-N 3.44Å; W101-N104 VanDerWaalsContact O-N 3.14Å; N104-I107 WeakPolarHBondContact O-CB 3.31Å; N104-I107 PolarHBondContact O-N 3.26Å; N104-Y108 WeakPolarHBondContact O-CD2 3.48Å; N104-K1020 PolarHBondContact OD1-NZ 2.98Å
105	I	70	Confident	72.7	Confident	46 Å²	46	83.2 Å²	83.2	24%	0.236	40%	0.402	C	S	.	.	H	α-helix	trans	-66	-39.2	174.3	-77.6	179.6	0	0	0	111.3	W101 F102 I107 Y108 L109	W101-I105 HydrophobicContact CD2-CD1 3.55Å; W101-I105 HydrophobicContact CD2-CG1 4.43Å; W101-I105 HydrophobicContact CE3-CD1 3.76Å; W101-I105 HydrophobicContact CG-CD1 4.37Å; W101-I105 HydrophobicContact CH2-CD1 3.34Å; W101-I105 HydrophobicContact CZ2-CD1 3.12Å; W101-I105 HydrophobicContact CZ2-CG1 4.48Å; W101-I105 HydrophobicContact CZ3-CD1 3.65Å; W101-I105 WeakPolarHBondContact O-CB 3.43Å; W101-I105 PolarHBondContact O-N 2.87Å; F102-I105 PolarHBondContact O-N 3.46Å; I105-I107 PolarHBondContact O-N 3.43Å; I105-Y108 CarbonylContact O-C 3.15Å; I105-Y108 WeakPolarHBondContact O-CA 3.25Å; I105-Y108 WeakPolarHBondContact O-CB 3.46Å; I105-Y108 PolarHBondContact O-N 2.98Å; I105-L109 HydrophobicContact CG2-CD1 3.45Å; I105-L109 VanDerWaalsContact CG2-CD1 3.45Å; I105-L109 HydrophobicContact CG2-CG 3.81Å; I105-L109 PolarHBondContact O-N 3.4Å
106	S	63.1	Low	72.9	Confident	45 Å²	45	75.5 Å²	75.5	32%	0.315	37%	0.374	S	S	.	.	H	α-helix	trans	-57.2	-35.1	176.8	176.7	0	0	0	0	111.1	F102 A103 Y108 L109 I110	F102-S106 WeakPolarHBondContact O-CA 3.28Å; F102-S106 WeakPolarHBondContact O-CB 3.36Å; F102-S106 PolarHBondContact O-N 3.44Å; A103-S106 PolarHBondContact O-N 3.48Å; S106-Y108 VanDerWaalsContact C-N 3.27Å; S106-Y108 PolarHBondContact O-N 3.29Å; S106-L109 PolarHBondContact O-N 2.99Å; S106-I110 WeakPolarHBondContact O-CB 3.44Å; S106-I110 VanDerWaalsContact O-CD1 3.26Å; S106-I110 WeakPolarHBondContact O-CD1 3.5Å; S106-I110 WeakPolarHBondContact O-CG1 3.43Å; S106-I110 PolarHBondContact O-N 3.47Å
107	I	61.9	Low	72.9	Confident	63 Å²	63	74 Å²	74	32%	0.323	37%	0.368	S	S	.	.	H	α-helix	trans	-64.5	-32.1	175.2	-64.5	163.9	0	0	0	112	A103 N104 I105	A103-I107 WeakPolarHBondContact O-CG1 3.39Å; A103-I107 PolarHBondContact O-N 3.41Å; N104-I107 WeakPolarHBondContact O-CB 3.31Å; N104-I107 PolarHBondContact O-N 3.26Å; I105-I107 PolarHBondContact O-N 3.43Å
108	Y	62.6	Low	73	Confident	198 Å²	198	77.9 Å²	77.9	78%	0.776	38%	0.377	S	S	*	.	H	α-helix	trans	-83.5	-36	175.6	-64.1	-73	0	0	0	112.8	N104 I105 S106 I110	N104-Y108 WeakPolarHBondContact O-CD2 3.48Å; I105-Y108 CarbonylContact O-C 3.15Å; I105-Y108 WeakPolarHBondContact O-CA 3.25Å; I105-Y108 WeakPolarHBondContact O-CB 3.46Å; I105-Y108 PolarHBondContact O-N 2.98Å; S106-Y108 VanDerWaalsContact C-N 3.27Å; S106-Y108 PolarHBondContact O-N 3.29Å; Y108-I110 VanDerWaalsContact C-N 3.34Å
109	L	61.6	Low	73	Confident	125 Å²	125	73.3 Å²	73.3	65%	0.654	36%	0.356	S	S	*	.	H	α-helix	trans	-73.5	-24	177	-76.6	175.3	0	0	0	112.8	I105 S106 P111	I105-L109 HydrophobicContact CG2-CD1 3.45Å; I105-L109 VanDerWaalsContact CG2-CD1 3.45Å; I105-L109 HydrophobicContact CG2-CG 3.81Å; I105-L109 PolarHBondContact O-N 3.4Å; S106-L109 PolarHBondContact O-N 2.99Å; L109-P111 WeakPolarHBondContact O-CD 3.48Å; L109-P111 VanDerWaalsContact O-N 3.1Å
110	I	63.4	Low	72.7	Confident	51 Å²	51	73 Å²	73	26%	0.262	35%	0.351	S	S	.	.	S	Bend	trans	-66.4	111.3	169.9	-70	158.1	0	0	0	106.3	S106 Y108 W112 E113	S106-I110 WeakPolarHBondContact O-CB 3.44Å; S106-I110 VanDerWaalsContact O-CD1 3.26Å; S106-I110 WeakPolarHBondContact O-CD1 3.5Å; S106-I110 WeakPolarHBondContact O-CG1 3.43Å; S106-I110 PolarHBondContact O-N 3.47Å; Y108-I110 VanDerWaalsContact C-N 3.34Å; I110-W112 PolarHBondContact O-N 2.99Å; I110-E113 HydrophobicContact CB-CB 4.35Å; I110-E113 VanDerWaalsContact CD1-OE2 3.3Å; I110-E113 WeakPolarHBondContact CD1-OE2 3.28Å; I110-E113 HydrophobicContact CG2-CB 3.99Å; I110-E113 PolarHBondContact O-N 3.35Å
111	P	66.3	Low	72.4	Confident	57 Å²	57	68.6 Å²	68.6	37%	0.37	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	141.8	-175.5	26.5	-34.9	0	0	0	108.4	L109 E113 F138	L109-P111 WeakPolarHBondContact O-CD 3.48Å; L109-P111 VanDerWaalsContact O-N 3.1Å; P111-E113 PolarHBondContact O-N 3.38Å; P111-F138 HydrophobicContact CG-CE1 4.36Å
112	W	74.3	Confident	72	Confident	23 Å²	23	65 Å²	65	9%	0.087	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	11	173.7	52.4	66	0	0	0	118.7	I110 A114 K115 I116 R135 F138 V756 L759	I110-W112 PolarHBondContact O-N 2.99Å; W112-A114 VanDerWaalsContact C-N 3.33Å; W112-A114 PolarHBondContact O-N 2.9Å; W112-K115 PolarHBondContact O-N 3.46Å; W112-K115 VanDerWaalsContact O-N 3.13Å; W112-I116 VanDerWaalsContact CD1-CD1 3.5Å; W112-I116 WeakPolarHBondContact O-CG1 3.28Å; W112-I116 PolarHBondContact O-N 3.42Å; W112-R135 HydrophobicContact CZ2-CB 4.24Å; W112-R135 HydrophobicContact CZ2-CG 4.03Å; W112-R135 VanDerWaalsContact NE1-CB 3.27Å; W112-F138 HydrophobicContact CH2-CB 4.08Å; W112-F138 AromaticContact CH2-CD1 3.33Å; W112-F138 HydrophobicContact CH2-CD1 3.33Å; W112-F138 AromaticContact CH2-CD2 3.75Å; W112-F138 HydrophobicContact CH2-CD2 3.75Å; W112-F138 AromaticContact CH2-CE1 3.55Å; W112-F138 HydrophobicContact CH2-CE1 3.55Å; W112-F138 AromaticContact CH2-CE2 3.94Å; W112-F138 HydrophobicContact CH2-CE2 3.94Å; W112-F138 AromaticContact CH2-CG 3.43Å; W112-F138 HydrophobicContact CH2-CG 3.43Å; W112-F138 VanDerWaalsContact CH2-CG 3.43Å; W112-F138 AromaticContact CH2-CZ 3.85Å; W112-F138 HydrophobicContact CH2-CZ 3.85Å; W112-F138 HydrophobicContact CZ2-CB 4.1Å; W112-F138 AromaticContact CZ2-CD1 3.54Å; W112-F138 HydrophobicContact CZ2-CD1 3.54Å; W112-F138 HydrophobicContact CZ2-CE1 4.06Å; W112-F138 AromaticContact CZ2-CG 3.82Å; W112-F138 HydrophobicContact CZ2-CG 3.82Å; W112-V756 HydrophobicContact CZ3-CG2 4.17Å; W112-L759 HydrophobicContact CB-CD2 3.69Å; W112-L759 HydrophobicContact CD2-CD1 4.33Å; W112-L759 HydrophobicContact CD2-CD2 3.35Å; W112-L759 HydrophobicContact CD2-CG 4.48Å; W112-L759 HydrophobicContact CE3-CD2 3.19Å; W112-L759 HydrophobicContact CE3-CG 4.5Å; W112-L759 HydrophobicContact CG-CD1 4.31Å; W112-L759 HydrophobicContact CG-CD2 3.54Å; W112-L759 HydrophobicContact CZ3-CD2 3.97Å
113	E	77.6	Confident	71.7	Confident	14 Å²	14	61 Å²	61	7%	0.065	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-42.8	-179.3	-175.2	166.3	148.1	0	0	112.9	I110 P111 K115 I116 K117 R135 L796	I110-E113 HydrophobicContact CB-CB 4.35Å; I110-E113 VanDerWaalsContact CD1-OE2 3.3Å; I110-E113 WeakPolarHBondContact CD1-OE2 3.28Å; I110-E113 HydrophobicContact CG2-CB 3.99Å; I110-E113 PolarHBondContact O-N 3.35Å; P111-E113 PolarHBondContact O-N 3.38Å; E113-K115 VanDerWaalsContact C-N 3.35Å; E113-K115 PolarHBondContact O-N 3.05Å; E113-I116 PolarHBondContact O-N 3.08Å; E113-K117 HydrophobicContact CG-CD 4.33Å; E113-K117 WeakPolarHBondContact O-CG 3.42Å; E113-K117 PolarHBondContact O-N 3.27Å; E113-K117 WeakPolarHBondContact OE1-CE 3.29Å; E113-K117 IonicContact OE1-NZ 3.09Å; E113-K117 PolarHBondContact OE1-NZ 2.89Å; E113-R135 IonicContact OE2-NH1 3.96Å; E113-L796 WeakPolarHBondContact OE1-CD2 3.34Å
114	A	76.9	Confident	71.5	Confident	80 Å²	80	61.1 Å²	61.1	66%	0.661	32%	0.316	S	S	*	.	H	α-helix	trans	-61.9	-39.6	176.9	0	0	0	0	0	112.7	W112 K117 K118	W112-A114 VanDerWaalsContact C-N 3.33Å; W112-A114 PolarHBondContact O-N 2.9Å; A114-K117 PolarHBondContact O-N 3.48Å; A114-K118 WeakPolarHBondContact O-CB 3.33Å; A114-K118 PolarHBondContact O-N 2.93Å
115	K	83.1	Confident	71.2	Confident	104 Å²	104	59.2 Å²	59.2	45%	0.452	31%	0.307	S	S	.	.	H	α-helix	trans	-67.6	-42.1	177.2	-73.6	-172.8	-178.3	-115.5	0	111.6	W112 E113 K118 I119 Y760	W112-K115 PolarHBondContact O-N 3.46Å; W112-K115 VanDerWaalsContact O-N 3.13Å; E113-K115 VanDerWaalsContact C-N 3.35Å; E113-K115 PolarHBondContact O-N 3.05Å; K115-K118 PolarHBondContact O-N 2.91Å; K115-I119 WeakPolarHBondContact O-CG1 3.43Å; K115-I119 PolarHBondContact O-N 3.03Å; K115-Y760 HydrophobicContact CD-CD1 4.4Å; K115-Y760 HydrophobicContact CD-CE1 3.92Å; K115-Y760 VanDerWaalsContact CE-CE1 3.49Å
116	I	81.1	Confident	71.3	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-46.3	175.8	-65	-178.3	0	0	0	110.4	W112 E113 K118 I119 E120 S128 F131 I132	W112-I116 VanDerWaalsContact CD1-CD1 3.5Å; W112-I116 WeakPolarHBondContact O-CG1 3.28Å; W112-I116 PolarHBondContact O-N 3.42Å; E113-I116 PolarHBondContact O-N 3.08Å; I116-K118 VanDerWaalsContact C-N 3.32Å; I116-K118 PolarHBondContact O-N 3.35Å; I116-I119 PolarHBondContact O-N 2.93Å; I116-E120 WeakPolarHBondContact O-CB 3.39Å; I116-E120 PolarHBondContact O-N 3.36Å; I116-S128 WeakPolarHBondContact CG2-OG 3.21Å; I116-F131 HydrophobicContact CD1-CB 3.9Å; I116-F131 HydrophobicContact CG1-CB 3.81Å; I116-I132 HydrophobicContact CG2-CG1 4.14Å
117	K	76.8	Confident	72	Confident	81 Å²	81	57.8 Å²	57.8	35%	0.352	30%	0.298	S	S	.	.	H	α-helix	trans	-61.1	-38.9	177.2	-73.8	179.1	-176.5	168.6	0	112.5	E113 A114 E120 S121	E113-K117 HydrophobicContact CG-CD 4.33Å; E113-K117 WeakPolarHBondContact O-CG 3.42Å; E113-K117 PolarHBondContact O-N 3.27Å; E113-K117 WeakPolarHBondContact OE1-CE 3.29Å; E113-K117 IonicContact OE1-NZ 3.09Å; E113-K117 PolarHBondContact OE1-NZ 2.89Å; A114-K117 PolarHBondContact O-N 3.48Å; K117-E120 PolarHBondContact O-N 3.31Å; K117-S121 PolarHBondContact O-N 3.08Å; K117-S121 PolarHBondContact O-OG 3.3Å
118	K	79.8	Confident	72.7	Confident	123 Å²	123	54.8 Å²	54.8	54%	0.535	28%	0.283	S	S	.	.	H	α-helix	trans	-62.9	-45.3	174.1	-174.4	174.5	-177.5	176.3	0	111.9	A114 K115 I116 E120 S121 H122	A114-K118 WeakPolarHBondContact O-CB 3.33Å; A114-K118 PolarHBondContact O-N 2.93Å; K115-K118 PolarHBondContact O-N 2.91Å; I116-K118 VanDerWaalsContact C-N 3.32Å; I116-K118 PolarHBondContact O-N 3.35Å; K118-E120 VanDerWaalsContact C-N 3.31Å; K118-E120 PolarHBondContact O-N 3.21Å; K118-S121 PolarHBondContact O-N 3.29Å; K118-S121 PolarHBondContact O-OG 2.86Å; K118-H122 PolarHBondContact O-CD2 2.64Å; K118-H122 PolarHBondContact O-N 3.01Å
119	I	78.7	Confident	73.4	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-64.3	-40.1	176.6	-65.9	165.1	0	0	0	110.5	K115 I116 S121 H122 F123 V127 F131 A763 V766 M767	K115-I119 WeakPolarHBondContact O-CG1 3.43Å; K115-I119 PolarHBondContact O-N 3.03Å; I116-I119 PolarHBondContact O-N 2.93Å; I119-S121 VanDerWaalsContact C-N 3.34Å; I119-S121 PolarHBondContact O-N 2.82Å; I119-H122 PolarHBondContact O-N 2.83Å; I119-F123 HydrophobicContact CG2-CD2 4.05Å; I119-F123 PolarHBondContact O-N 3.24Å; I119-V127 HydrophobicContact CG2-CG1 3.76Å; I119-F131 HydrophobicContact CD1-CD1 4.48Å; I119-F131 HydrophobicContact CD1-CD2 4.1Å; I119-F131 HydrophobicContact CD1-CE1 4.19Å; I119-F131 HydrophobicContact CD1-CE2 3.78Å; I119-F131 HydrophobicContact CD1-CG 4.45Å; I119-F131 HydrophobicContact CD1-CZ 3.82Å; I119-F131 HydrophobicContact CG2-CD2 4.23Å; I119-F131 HydrophobicContact CG2-CE2 3.94Å; I119-A763 HydrophobicContact CD1-CB 3.89Å; I119-V766 HydrophobicContact CG2-CG1 4.26Å; I119-M767 HydrophobicContact CG1-CG 4.29Å; I119-M767 HydrophobicContact CG1-SD 3.91Å
120	E	75.3	Confident	74.5	Confident	36 Å²	36	40 Å²	40	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-38.4	177	-170.8	166.4	168.8	0	0	112.4	I116 K117 K118 G124 S128 F799	I116-E120 WeakPolarHBondContact O-CB 3.39Å; I116-E120 PolarHBondContact O-N 3.36Å; K117-E120 PolarHBondContact O-N 3.31Å; K118-E120 VanDerWaalsContact C-N 3.31Å; K118-E120 PolarHBondContact O-N 3.21Å; E120-G124 WeakPolarHBondContact O-CA 3.45Å; E120-G124 PolarHBondContact O-N 3.15Å; E120-S128 PolarHBondContact OE2-OG 3.25Å; E120-F799 WeakPolarHBondContact OE1-CD2 3.24Å; E120-F799 WeakPolarHBondContact OE1-CE2 3.36Å
121	S	67.6	Low	75.7	Confident	42 Å²	42	37.7 Å²	37.7	29%	0.294	21%	0.207	S	C	.	.	H	α-helix	trans	-70.9	-27.8	177.1	63.8	0	0	0	0	113.8	K117 K118 I119	K117-S121 PolarHBondContact O-N 3.08Å; K117-S121 PolarHBondContact O-OG 3.3Å; K118-S121 PolarHBondContact O-N 3.29Å; K118-S121 PolarHBondContact O-OG 2.86Å; I119-S121 VanDerWaalsContact C-N 3.34Å; I119-S121 PolarHBondContact O-N 2.82Å
122	H	71	Confident	76.5	Confident	68 Å²	68	35.2 Å²	35.2	32%	0.315	19%	0.19	S	C	.	.	H	α-helix	trans	-87.2	-48.7	178.7	-76	-74.7	0	0	0	113	K118 I119 T281	K118-H122 PolarHBondContact O-CD2 2.64Å; K118-H122 PolarHBondContact O-N 3.01Å; I119-H122 PolarHBondContact O-N 2.83Å; H122-T281 PolarHBondContact O-OG1 3.12Å
123	F	70.2	Confident	77.1	Confident	32 Å²	32	34.1 Å²	34.1	14%	0.14	19%	0.186	C	C	.	.	H	α-helix	trans	-105.8	-9.2	-171.1	-64	-85.2	0	0	0	114	I119 V127 V766 M767 N770 P772	I119-F123 HydrophobicContact CG2-CD2 4.05Å; I119-F123 PolarHBondContact O-N 3.24Å; F123-V127 HydrophobicContact CB-CB 3.86Å; F123-V127 HydrophobicContact CB-CG1 4.22Å; F123-V127 HydrophobicContact CB-CG2 3.77Å; F123-V127 HydrophobicContact CG-CG2 4.49Å; F123-V766 HydrophobicContact CD2-CG1 3.8Å; F123-V766 HydrophobicContact CE1-CG1 4.36Å; F123-V766 HydrophobicContact CE2-CG1 3.55Å; F123-V766 HydrophobicContact CG-CG1 4.33Å; F123-V766 HydrophobicContact CZ-CG1 3.87Å; F123-V766 WeakPolarHBondContact CZ-O 3.47Å; F123-M767 HydrophobicContact CD2-SD 4.44Å; F123-M767 HydrophobicContact CE2-SD 3.77Å; F123-N770 WeakPolarHBondContact CE1-O 2.99Å; F123-P772 HydrophobicContact CD1-CB 3.97Å; F123-P772 HydrophobicContact CD1-CG 4.44Å
124	G	66.4	Low	77.6	Confident	23 Å²	23	33.4 Å²	33.4	24%	0.237	18%	0.183	C	C	.	.			trans	82.1	-179.4	-174.9	0	0	0	0	0	114.1	E120 V126 S128	E120-G124 WeakPolarHBondContact O-CA 3.45Å; E120-G124 PolarHBondContact O-N 3.15Å; G124-V126 VanDerWaalsContact C-N 3.35Å; G124-V126 PolarHBondContact O-N 2.74Å; G124-S128 PolarHBondContact O-N 3.42Å
125	S	68.6	Low	78.1	Confident	19 Å²	19	31.9 Å²	31.9	13%	0.133	16%	0.16	C	C	.	.	H	α-helix	trans	-74.8	-17	-169.6	57.7	0	0	0	0	116	S129 F782	S125-S129 PolarHBondContact O-N 2.98Å; S125-F782 WeakPolarHBondContact OG-CD2 3.27Å; S125-F782 WeakPolarHBondContact OG-CE2 3.24Å
126	V	70.3	Confident	78.4	Confident	52 Å²	52	29 Å²	29	32%	0.315	15%	0.146	S	C	.	.	H	α-helix	trans	-66	-47.9	178.4	178.8	0	0	0	0	109.9	G124 S129 V723	G124-V126 VanDerWaalsContact C-N 3.35Å; G124-V126 PolarHBondContact O-N 2.74Å; V126-S129 WeakPolarHBondContact O-CB 2.95Å; V126-S129 PolarHBondContact O-N 3.26Å; V126-S129 PolarHBondContact O-OG 3.32Å; V126-V723 HydrophobicContact CG1-CG2 4.2Å
127	V	78.6	Confident	78.9	Confident	9 Å²	9	28.6 Å²	28.6	6%	0.055	15%	0.145	C	C	.	.	H	α-helix	trans	-67.7	-42.9	176.4	177.7	0	0	0	0	111	I119 F123 S129 Y130 F131 F721 V766	I119-V127 HydrophobicContact CG2-CG1 3.76Å; F123-V127 HydrophobicContact CB-CB 3.86Å; F123-V127 HydrophobicContact CB-CG1 4.22Å; F123-V127 HydrophobicContact CB-CG2 3.77Å; F123-V127 HydrophobicContact CG-CG2 4.49Å; V127-S129 PolarHBondContact O-N 2.9Å; V127-S129 VanDerWaalsContact O-N 3.15Å; V127-Y130 PolarHBondContact O-N 3.42Å; V127-F131 HydrophobicContact CG1-CE2 4.01Å; V127-F721 HydrophobicContact CB-CD1 4.3Å; V127-F721 HydrophobicContact CG1-CD1 3.65Å; V127-F721 HydrophobicContact CG1-CE1 3.85Å; V127-F721 HydrophobicContact CG1-CG 4.44Å; V127-F721 HydrophobicContact CG2-CD1 4.07Å; V127-V766 HydrophobicContact CG1-CG1 4.11Å
128	S	76.7	Confident	79.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-55.1	-32.7	175.2	-177.5	0	0	0	0	112.8	I116 E120 G124 Y130 F131 I132	I116-S128 WeakPolarHBondContact CG2-OG 3.21Å; E120-S128 PolarHBondContact OE2-OG 3.25Å; G124-S128 PolarHBondContact O-N 3.42Å; S128-Y130 VanDerWaalsContact C-N 3.26Å; S128-Y130 PolarHBondContact O-N 2.98Å; S128-F131 PolarHBondContact O-N 3.36Å; S128-F131 VanDerWaalsContact O-N 3.12Å; S128-I132 WeakPolarHBondContact O-CG1 3.34Å; S128-I132 PolarHBondContact O-N 2.97Å
129	S	77.3	Confident	80.1	Confident	11 Å²	11	21.6 Å²	21.6	8%	0.077	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-32.2	-179.8	79.2	0	0	0	0	114.4	S125 V126 V127 F133	S125-S129 PolarHBondContact O-N 2.98Å; V126-S129 WeakPolarHBondContact O-CB 2.95Å; V126-S129 PolarHBondContact O-N 3.26Å; V126-S129 PolarHBondContact O-OG 3.32Å; V127-S129 PolarHBondContact O-N 2.9Å; V127-S129 VanDerWaalsContact O-N 3.15Å; S129-F133 WeakPolarHBondContact O-CB 3.48Å; S129-F133 PolarHBondContact O-N 3.24Å
130	Y	85.5	Confident	80.7	Confident	2 Å²	2	22 Å²	22	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-65.1	-51	173.4	165.7	-101	0	0	0	111.3	V127 S128 I132 F133 L134 F721 N726 V727 V730 L758 R762	V127-Y130 PolarHBondContact O-N 3.42Å; S128-Y130 VanDerWaalsContact C-N 3.26Å; S128-Y130 PolarHBondContact O-N 2.98Å; Y130-I132 VanDerWaalsContact C-N 3.3Å; Y130-I132 PolarHBondContact O-N 3.44Å; Y130-F133 WeakPolarHBondContact O-CA 3.48Å; Y130-F133 WeakPolarHBondContact O-CB 3.47Å; Y130-F133 PolarHBondContact O-N 3.36Å; Y130-L134 HydrophobicContact CE1-CD1 4.08Å; Y130-L134 PolarHBondContact O-N 3.11Å; Y130-F721 HydrophobicContact CD1-CE1 4.19Å; Y130-F721 AromaticContact CD1-CZ 3.64Å; Y130-F721 HydrophobicContact CD1-CZ 3.64Å; Y130-F721 HydrophobicContact CE1-CZ 4.01Å; Y130-F721 HydrophobicContact CG-CE1 4.24Å; Y130-F721 AromaticContact CG-CZ 3.99Å; Y130-F721 HydrophobicContact CG-CZ 3.99Å; Y130-N726 HydrophobicContact CD2-CB 4.1Å; Y130-N726 HydrophobicContact CE2-CB 3.7Å; Y130-V727 HydrophobicContact CD2-CG2 3.73Å; Y130-V730 HydrophobicContact CE2-CG2 3.88Å; Y130-L758 WeakPolarHBondContact OH-CD2 3.07Å; Y130-R762 HydrophobicContact CE1-CB 4.35Å
131	F	88.1	Confident	81.6	Confident	1 Å²	1	20.2 Å²	20.2	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-66.2	-33.9	-178.8	-64.1	-79.6	0	0	0	112	I116 I119 V127 S128 F133 L134 R135 F721 L759 R762 A763 V766	I116-F131 HydrophobicContact CD1-CB 3.9Å; I116-F131 HydrophobicContact CG1-CB 3.81Å; I119-F131 HydrophobicContact CD1-CD1 4.48Å; I119-F131 HydrophobicContact CD1-CD2 4.1Å; I119-F131 HydrophobicContact CD1-CE1 4.19Å; I119-F131 HydrophobicContact CD1-CE2 3.78Å; I119-F131 HydrophobicContact CD1-CG 4.45Å; I119-F131 HydrophobicContact CD1-CZ 3.82Å; I119-F131 HydrophobicContact CG2-CD2 4.23Å; I119-F131 HydrophobicContact CG2-CE2 3.94Å; V127-F131 HydrophobicContact CG1-CE2 4.01Å; S128-F131 PolarHBondContact O-N 3.36Å; S128-F131 VanDerWaalsContact O-N 3.12Å; F131-F133 VanDerWaalsContact C-N 3.34Å; F131-L134 PolarHBondContact O-N 3.02Å; F131-R135 WeakPolarHBondContact O-CB 3.38Å; F131-R135 PolarHBondContact O-N 2.92Å; F131-F721 HydrophobicContact CE2-CZ 4.46Å; F131-L759 HydrophobicContact CD1-CD1 3.77Å; F131-L759 HydrophobicContact CD1-CG 4.48Å; F131-R762 HydrophobicContact CE1-CB 4.39Å; F131-A763 HydrophobicContact CE1-CB 3.88Å; F131-A763 HydrophobicContact CZ-CB 4.28Å; F131-V766 HydrophobicContact CZ-CG2 4.19Å
132	I	82.8	Confident	82.8	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.026	12%	0.123	C	C	.	.	H	α-helix	trans	-66.1	-36.9	171.9	-65.9	167.4	0	0	0	111.5	I116 S128 Y130 W136 F799 R800	I116-I132 HydrophobicContact CG2-CG1 4.14Å; S128-I132 WeakPolarHBondContact O-CG1 3.34Å; S128-I132 PolarHBondContact O-N 2.97Å; Y130-I132 VanDerWaalsContact C-N 3.3Å; Y130-I132 PolarHBondContact O-N 3.44Å; I132-W136 PolarHBondContact O-N 3.3Å; I132-F799 HydrophobicContact CD1-CB 4.27Å; I132-R800 PolarHBondContact O-NH1 3.11Å
133	F	86.4	Confident	83.8	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.6	-48	174.5	178.1	-98.2	0	0	0	111	S129 Y130 F131 R135 W136 I137 V727 V730 I731	S129-F133 WeakPolarHBondContact O-CB 3.48Å; S129-F133 PolarHBondContact O-N 3.24Å; Y130-F133 WeakPolarHBondContact O-CA 3.48Å; Y130-F133 WeakPolarHBondContact O-CB 3.47Å; Y130-F133 PolarHBondContact O-N 3.36Å; F131-F133 VanDerWaalsContact C-N 3.34Å; F133-R135 PolarHBondContact O-N 3.09Å; F133-W136 WeakPolarHBondContact O-CB 3.49Å; F133-W136 PolarHBondContact O-N 3.21Å; F133-W136 VanDerWaalsContact O-N 3.1Å; F133-I137 HydrophobicContact CD1-CD1 3.88Å; F133-I137 HydrophobicContact CE1-CD1 3.19Å; F133-I137 HydrophobicContact CE1-CG1 4.18Å; F133-I137 HydrophobicContact CE2-CD1 4.27Å; F133-I137 HydrophobicContact CZ-CD1 3.41Å; F133-I137 VanDerWaalsContact CZ-CD1 3.41Å; F133-I137 HydrophobicContact CZ-CG1 4.21Å; F133-I137 PolarHBondContact O-N 2.95Å; F133-V727 HydrophobicContact CD1-CG1 4.1Å; F133-V727 HydrophobicContact CD1-CG2 4.37Å; F133-V727 HydrophobicContact CE1-CG1 3.77Å; F133-V727 HydrophobicContact CZ-CG1 4.21Å; F133-V730 HydrophobicContact CE1-CG1 4.22Å; F133-I731 HydrophobicContact CE1-CD1 4.35Å; F133-I731 HydrophobicContact CE1-CG1 3.95Å; F133-I731 HydrophobicContact CZ-CD1 3.94Å; F133-I731 HydrophobicContact CZ-CG1 3.76Å
134	L	88.6	Confident	84.9	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.3	-47	176.7	-166.9	163	0	0	0	111.5	Y130 F131 W136 I137 F138 L755 L758 L759	Y130-L134 HydrophobicContact CE1-CD1 4.08Å; Y130-L134 PolarHBondContact O-N 3.11Å; F131-L134 PolarHBondContact O-N 3.02Å; L134-W136 PolarHBondContact O-N 3.09Å; L134-I137 PolarHBondContact O-N 2.9Å; L134-I137 VanDerWaalsContact O-N 3.15Å; L134-F138 PolarHBondContact O-N 2.89Å; L134-L755 HydrophobicContact CD2-CB 4.37Å; L134-L755 HydrophobicContact CD2-CD2 4.47Å; L134-L755 HydrophobicContact CG-CD2 4.39Å; L134-L758 HydrophobicContact CD1-CD2 3.61Å; L134-L759 HydrophobicContact CD1-CB 4.26Å; L134-L759 HydrophobicContact CD1-CD1 4.29Å; L134-L759 HydrophobicContact CD2-CB 3.98Å; L134-L759 HydrophobicContact CD2-CD1 3.78Å; L134-L759 HydrophobicContact CD2-CG 4.49Å; L134-L759 HydrophobicContact CG-CD1 4.47Å
135	R	88.3	Confident	86.2	Confident	48 Å²	48	20.3 Å²	20.3	18%	0.181	11%	0.111	C	C	.	.	H	α-helix	trans	-53.1	-40.6	173.9	178.3	169.4	66.1	158.6	-0.7	112.4	W112 E113 F131 F133 G139	W112-R135 HydrophobicContact CZ2-CB 4.24Å; W112-R135 HydrophobicContact CZ2-CG 4.03Å; W112-R135 VanDerWaalsContact NE1-CB 3.27Å; E113-R135 IonicContact OE2-NH1 3.96Å; F131-R135 WeakPolarHBondContact O-CB 3.38Å; F131-R135 PolarHBondContact O-N 2.92Å; F133-R135 PolarHBondContact O-N 3.09Å; R135-G139 PolarHBondContact O-N 3.33Å
136	W	88.6	Confident	87.4	Confident	42 Å²	42	24.1 Å²	24.1	16%	0.159	13%	0.129	C	C	.	.	H	α-helix	trans	-73.6	-38.6	-178.7	179.2	77.8	0	0	0	112.3	I132 F133 L134 G139 I140 I241 K244 R800 Y806 L809	I132-W136 PolarHBondContact O-N 3.3Å; F133-W136 WeakPolarHBondContact O-CB 3.49Å; F133-W136 PolarHBondContact O-N 3.21Å; F133-W136 VanDerWaalsContact O-N 3.1Å; L134-W136 PolarHBondContact O-N 3.09Å; W136-G139 PolarHBondContact O-N 2.99Å; W136-I140 HydrophobicContact CD2-CD1 4.08Å; W136-I140 HydrophobicContact CE3-CD1 3.97Å; W136-I140 HydrophobicContact CH2-CD1 3.22Å; W136-I140 HydrophobicContact CZ2-CD1 3.34Å; W136-I140 HydrophobicContact CZ2-CG1 4.36Å; W136-I140 HydrophobicContact CZ3-CD1 3.55Å; W136-I140 PolarHBondContact O-N 3.33Å; W136-I241 HydrophobicContact CH2-CB 4.38Å; W136-I241 HydrophobicContact CH2-CG1 3.83Å; W136-K244 HydrophobicContact CH2-CB 4.42Å; W136-K244 HydrophobicContact CZ2-CB 3.62Å; W136-K244 HydrophobicContact CZ2-CG 3.86Å; W136-R800 VanDerWaalsContact CB-NH1 3.29Å; W136-Y806 HydrophobicContact CD2-CE1 4.31Å; W136-Y806 HydrophobicContact CE3-CE1 4.06Å; W136-Y806 HydrophobicContact CH2-CD1 4.04Å; W136-Y806 AromaticContact CH2-CE1 3.97Å; W136-Y806 HydrophobicContact CH2-CE1 3.97Å; W136-Y806 HydrophobicContact CZ2-CE1 4.22Å; W136-Y806 HydrophobicContact CZ3-CD1 4.04Å; W136-Y806 AromaticContact CZ3-CE1 3.9Å; W136-Y806 HydrophobicContact CZ3-CE1 3.9Å; W136-L809 HydrophobicContact CH2-CD2 4.25Å; W136-L809 HydrophobicContact CZ3-CD2 3.68Å
137	I	91.2	Very high	88.6	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.015	12%	0.122	C	C	.	.	H	α-helix	trans	-63	-44.7	172.4	-72.6	-177	0	0	0	110.6	F133 L134 G139 I140 N141 V730 Q734 L755	F133-I137 HydrophobicContact CD1-CD1 3.88Å; F133-I137 HydrophobicContact CE1-CD1 3.19Å; F133-I137 HydrophobicContact CE1-CG1 4.18Å; F133-I137 HydrophobicContact CE2-CD1 4.27Å; F133-I137 HydrophobicContact CZ-CD1 3.41Å; F133-I137 VanDerWaalsContact CZ-CD1 3.41Å; F133-I137 HydrophobicContact CZ-CG1 4.21Å; F133-I137 PolarHBondContact O-N 2.95Å; L134-I137 PolarHBondContact O-N 2.9Å; L134-I137 VanDerWaalsContact O-N 3.15Å; I137-G139 VanDerWaalsContact C-N 3.29Å; I137-G139 PolarHBondContact O-N 3.14Å; I137-I140 PolarHBondContact O-N 3.25Å; I137-I140 VanDerWaalsContact O-N 3.12Å; I137-N141 WeakPolarHBondContact CG2-ND2 3.36Å; I137-N141 PolarHBondContact O-N 3.11Å; I137-N141 PolarHBondContact O-ND2 3.33Å; I137-V730 HydrophobicContact CD1-CG1 3.67Å; I137-Q734 VanDerWaalsContact CG2-OE1 3.27Å; I137-L755 HydrophobicContact CG2-CD1 3.87Å
138	F	92.1	Very high	89.2	Confident	29 Å²	29	22.7 Å²	22.7	13%	0.127	12%	0.119	C	C	.	.	H	α-helix	trans	-55.1	-45.9	172.6	171.7	-93.1	0	0	0	111.4	P111 W112 L134 I140 N141 L142 N752 L755 V756	P111-F138 HydrophobicContact CG-CE1 4.36Å; W112-F138 HydrophobicContact CH2-CB 4.08Å; W112-F138 AromaticContact CH2-CD1 3.33Å; W112-F138 HydrophobicContact CH2-CD1 3.33Å; W112-F138 AromaticContact CH2-CD2 3.75Å; W112-F138 HydrophobicContact CH2-CD2 3.75Å; W112-F138 AromaticContact CH2-CE1 3.55Å; W112-F138 HydrophobicContact CH2-CE1 3.55Å; W112-F138 AromaticContact CH2-CE2 3.94Å; W112-F138 HydrophobicContact CH2-CE2 3.94Å; W112-F138 AromaticContact CH2-CG 3.43Å; W112-F138 HydrophobicContact CH2-CG 3.43Å; W112-F138 VanDerWaalsContact CH2-CG 3.43Å; W112-F138 AromaticContact CH2-CZ 3.85Å; W112-F138 HydrophobicContact CH2-CZ 3.85Å; W112-F138 HydrophobicContact CZ2-CB 4.1Å; W112-F138 AromaticContact CZ2-CD1 3.54Å; W112-F138 HydrophobicContact CZ2-CD1 3.54Å; W112-F138 HydrophobicContact CZ2-CE1 4.06Å; W112-F138 AromaticContact CZ2-CG 3.82Å; W112-F138 HydrophobicContact CZ2-CG 3.82Å; L134-F138 PolarHBondContact O-N 2.89Å; F138-I140 VanDerWaalsContact C-N 3.31Å; F138-I140 PolarHBondContact O-N 3.29Å; F138-N141 PolarHBondContact O-N 3.43Å; F138-L142 HydrophobicContact CE1-CD2 4.13Å; F138-L142 HydrophobicContact CZ-CD1 4.43Å; F138-L142 VanDerWaalsContact O-CB 3.28Å; F138-L142 WeakPolarHBondContact O-CB 3.45Å; F138-L142 PolarHBondContact O-N 2.84Å; F138-N752 HydrophobicContact CD2-CB 4.32Å; F138-N752 HydrophobicContact CE2-CB 4.01Å; F138-L755 HydrophobicContact CB-CD1 4.16Å; F138-L755 HydrophobicContact CD2-CB 4.4Å; F138-V756 HydrophobicContact CD2-CG2 4.39Å; F138-V756 HydrophobicContact CE2-CG2 3.84Å
139	G	90	Very high	89.9	Confident	28 Å²	28	25.2 Å²	25.2	29%	0.289	14%	0.135	S	C	.	.	H	α-helix	trans	-59.7	-38.3	176.7	0	0	0	0	0	113.5	R135 W136 I137 I143	R135-G139 PolarHBondContact O-N 3.33Å; W136-G139 PolarHBondContact O-N 2.99Å; I137-G139 VanDerWaalsContact C-N 3.29Å; I137-G139 PolarHBondContact O-N 3.14Å; G139-I143 WeakPolarHBondContact O-CG1 3.33Å; G139-I143 PolarHBondContact O-N 3.01Å
140	I	91.7	Very high	90.6	Very high	11 Å²	11	28.4 Å²	28.4	6%	0.056	15%	0.15	C	C	.	.	H	α-helix	trans	-65.5	-52.3	173.7	-72.6	178.3	0	0	0	110.4	W136 I137 F138 L142 I143 I144 A240	W136-I140 HydrophobicContact CD2-CD1 4.08Å; W136-I140 HydrophobicContact CE3-CD1 3.97Å; W136-I140 HydrophobicContact CH2-CD1 3.22Å; W136-I140 HydrophobicContact CZ2-CD1 3.34Å; W136-I140 HydrophobicContact CZ2-CG1 4.36Å; W136-I140 HydrophobicContact CZ3-CD1 3.55Å; W136-I140 PolarHBondContact O-N 3.33Å; I137-I140 PolarHBondContact O-N 3.25Å; I137-I140 VanDerWaalsContact O-N 3.12Å; F138-I140 VanDerWaalsContact C-N 3.31Å; F138-I140 PolarHBondContact O-N 3.29Å; I140-L142 PolarHBondContact O-N 3.1Å; I140-I143 PolarHBondContact O-N 3.34Å; I140-I143 VanDerWaalsContact O-N 3.1Å; I140-I144 HydrophobicContact CG2-CD1 3.63Å; I140-I144 HydrophobicContact CG2-CG1 4.18Å; I140-I144 VanDerWaalsContact O-CG1 3.31Å; I140-I144 WeakPolarHBondContact O-CG1 3.25Å; I140-I144 PolarHBondContact O-N 3.44Å; I140-A240 HydrophobicContact CD1-CB 4.05Å; I140-A240 HydrophobicContact CG1-CB 4.47Å
141	N	93.3	Very high	90.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-28.6	-177.2	-70.3	-35.4	0	0	0	112.6	I137 F138 I144 S145 Q734 N751 N752	I137-N141 WeakPolarHBondContact CG2-ND2 3.36Å; I137-N141 PolarHBondContact O-N 3.11Å; I137-N141 PolarHBondContact O-ND2 3.33Å; F138-N141 PolarHBondContact O-N 3.43Å; N141-I144 PolarHBondContact O-N 2.77Å; N141-S145 WeakPolarHBondContact O-CB 3.15Å; N141-S145 PolarHBondContact O-N 3.34Å; N141-S145 PolarHBondContact O-OG 2.85Å; N141-S145 VanDerWaalsContact O-OG 3.06Å; N141-Q734 PolarHBondContact ND2-OE1 2.94Å; N141-Q734 PolarHBondContact OD1-NE2 3.24Å; N141-Q734 PolarHBondContact OD1-OE1 2.83Å; N141-N751 PolarHBondContact ND2-ND2 2.88Å; N141-N752 WeakPolarHBondContact CB-OD1 3.38Å; N141-N752 PolarHBondContact O-ND2 2.83Å
142	L	93	Very high	91	Very high	84 Å²	84	33 Å²	33	44%	0.44	17%	0.17	S	C	.	.	H	α-helix	trans	-65.6	-43.5	172.1	-173.8	70.6	0	0	0	111.9	F138 I140 S145 L146 N752	F138-L142 HydrophobicContact CE1-CD2 4.13Å; F138-L142 HydrophobicContact CZ-CD1 4.43Å; F138-L142 VanDerWaalsContact O-CB 3.28Å; F138-L142 WeakPolarHBondContact O-CB 3.45Å; F138-L142 PolarHBondContact O-N 2.84Å; I140-L142 PolarHBondContact O-N 3.1Å; L142-S145 WeakPolarHBondContact CA-OG 3.47Å; L142-S145 PolarHBondContact O-OG 3.45Å; L142-L146 VanDerWaalsContact O-CB 3.29Å; L142-L146 WeakPolarHBondContact O-CB 3.29Å; L142-L146 PolarHBondContact O-N 3.4Å; L142-N752 WeakPolarHBondContact CA-ND2 3.32Å; L142-N752 PolarHBondContact N-ND2 2.87Å; L142-N752 PolarHBondContact N-OD1 2.91Å
143	I	93.3	Very high	91.2	Very high	70 Å²	70	33.4 Å²	33.4	36%	0.359	17%	0.173	S	C	.	.	H	α-helix	trans	-67.6	-42.3	176.1	-67.1	168	0	0	0	110	G139 I140 L146 I147 Y236	G139-I143 WeakPolarHBondContact O-CG1 3.33Å; G139-I143 PolarHBondContact O-N 3.01Å; I140-I143 PolarHBondContact O-N 3.34Å; I140-I143 VanDerWaalsContact O-N 3.1Å; I143-L146 PolarHBondContact O-N 3.03Å; I143-I147 HydrophobicContact CG2-CD1 3.9Å; I143-I147 HydrophobicContact CG2-CG1 4.49Å; I143-I147 VanDerWaalsContact O-CG1 3.32Å; I143-I147 WeakPolarHBondContact O-CG1 3.48Å; I143-I147 PolarHBondContact O-N 3.23Å; I143-Y236 HydrophobicContact CB-CE1 4.27Å; I143-Y236 WeakPolarHBondContact CD1-OH 3.45Å; I143-Y236 HydrophobicContact CG2-CE1 3.83Å; I143-Y236 HydrophobicContact CG2-CE2 4.47Å
144	I	93	Very high	91.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-50.7	175.9	-65.5	178.6	0	0	0	110.3	I140 N141 L146 I147 M148 V233 Y236 P748	I140-I144 HydrophobicContact CG2-CD1 3.63Å; I140-I144 HydrophobicContact CG2-CG1 4.18Å; I140-I144 VanDerWaalsContact O-CG1 3.31Å; I140-I144 WeakPolarHBondContact O-CG1 3.25Å; I140-I144 PolarHBondContact O-N 3.44Å; N141-I144 PolarHBondContact O-N 2.77Å; I144-L146 VanDerWaalsContact C-N 3.28Å; I144-L146 PolarHBondContact O-N 2.85Å; I144-I147 PolarHBondContact O-N 3.25Å; I144-M148 HydrophobicContact CG2-CG 4.25Å; I144-M148 VanDerWaalsContact O-CG 3.29Å; I144-M148 WeakPolarHBondContact O-CG 3.31Å; I144-M148 PolarHBondContact O-N 2.96Å; I144-V233 HydrophobicContact CB-CG1 4.18Å; I144-V233 HydrophobicContact CD1-CG1 3.93Å; I144-V233 HydrophobicContact CG1-CG1 3.81Å; I144-V233 HydrophobicContact CG2-CG1 3.46Å; I144-V233 VanDerWaalsContact CG2-CG1 3.46Å; I144-V233 HydrophobicContact CG2-CG2 4.46Å; I144-Y236 HydrophobicContact CG1-CD1 4.46Å; I144-P748 HydrophobicContact CB-CB 4.4Å; I144-P748 HydrophobicContact CG2-CB 3.81Å; I144-P748 HydrophobicContact CG2-CG 3.68Å
145	S	93.3	Very high	91.2	Very high	11 Å²	11	38.5 Å²	38.5	8%	0.077	20%	0.201	C	C	.	.	H	α-helix	trans	-59.7	-40.3	178.3	58.7	0	0	0	0	111.6	N141 L142 I147 M148 T149 N752	N141-S145 WeakPolarHBondContact O-CB 3.15Å; N141-S145 PolarHBondContact O-N 3.34Å; N141-S145 PolarHBondContact O-OG 2.85Å; N141-S145 VanDerWaalsContact O-OG 3.06Å; L142-S145 WeakPolarHBondContact CA-OG 3.47Å; L142-S145 PolarHBondContact O-OG 3.45Å; S145-I147 PolarHBondContact O-N 2.78Å; S145-M148 PolarHBondContact O-N 3Å; S145-T149 WeakPolarHBondContact O-CB 3.38Å; S145-T149 PolarHBondContact O-N 3.31Å; S145-T149 PolarHBondContact O-OG1 3.06Å; S145-N752 PolarHBondContact OG-ND2 3.47Å
146	L	94	Very high	91	Very high	100 Å²	100	36.2 Å²	36.2	52%	0.524	19%	0.192	S	C	.	.	H	α-helix	trans	-63.3	-41.7	177.4	-179.5	142.7	0	0	0	112	L142 I143 I144 T149 I150	L142-L146 VanDerWaalsContact O-CB 3.29Å; L142-L146 WeakPolarHBondContact O-CB 3.29Å; L142-L146 PolarHBondContact O-N 3.4Å; I143-L146 PolarHBondContact O-N 3.03Å; I144-L146 VanDerWaalsContact C-N 3.28Å; I144-L146 PolarHBondContact O-N 2.85Å; L146-T149 PolarHBondContact O-N 3.09Å; L146-I150 HydrophobicContact CD2-CD1 3.44Å; L146-I150 VanDerWaalsContact CD2-CD1 3.44Å; L146-I150 HydrophobicContact CG-CD1 3.74Å; L146-I150 HydrophobicContact CG-CG1 4.47Å; L146-I150 WeakPolarHBondContact O-CB 3.43Å; L146-I150 VanDerWaalsContact O-CG1 3.22Å; L146-I150 WeakPolarHBondContact O-CG1 3.35Å; L146-I150 PolarHBondContact O-N 3.1Å
147	I	94.2	Very high	90.8	Very high	30 Å²	30	36.8 Å²	36.8	15%	0.154	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-47.8	175.7	-68.5	168	0	0	0	110.5	I143 I144 S145 T149 I150 F151 V229 V233	I143-I147 HydrophobicContact CG2-CD1 3.9Å; I143-I147 HydrophobicContact CG2-CG1 4.49Å; I143-I147 VanDerWaalsContact O-CG1 3.32Å; I143-I147 WeakPolarHBondContact O-CG1 3.48Å; I143-I147 PolarHBondContact O-N 3.23Å; I144-I147 PolarHBondContact O-N 3.25Å; S145-I147 PolarHBondContact O-N 2.78Å; I147-T149 VanDerWaalsContact C-N 3.31Å; I147-T149 PolarHBondContact O-N 3.18Å; I147-I150 PolarHBondContact O-N 3.03Å; I147-F151 HydrophobicContact CG2-CD2 3.94Å; I147-F151 HydrophobicContact CG2-CE2 4.46Å; I147-F151 WeakPolarHBondContact O-CB 3.47Å; I147-F151 WeakPolarHBondContact O-CD2 3.39Å; I147-F151 PolarHBondContact O-N 3.27Å; I147-V229 HydrophobicContact CG2-CG1 3.78Å; I147-V233 HydrophobicContact CB-CG2 4.35Å; I147-V233 HydrophobicContact CG2-CG2 3.81Å
148	M	91.9	Very high	90.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-40.2	178.7	-60	-60.9	-83	0	0	111.2	I144 S145 I152 T153 V229 V233 P745	I144-M148 HydrophobicContact CG2-CG 4.25Å; I144-M148 VanDerWaalsContact O-CG 3.29Å; I144-M148 WeakPolarHBondContact O-CG 3.31Å; I144-M148 PolarHBondContact O-N 2.96Å; S145-M148 PolarHBondContact O-N 3Å; M148-I152 HydrophobicContact CE-CD1 3.46Å; M148-I152 VanDerWaalsContact CE-CD1 3.46Å; M148-I152 WeakPolarHBondContact O-CA 3.49Å; M148-I152 VanDerWaalsContact O-CB 3.3Å; M148-I152 WeakPolarHBondContact O-CB 3.28Å; M148-I152 PolarHBondContact O-N 3.19Å; M148-I152 HydrophobicContact SD-CD1 3.71Å; M148-T153 PolarHBondContact O-N 2.9Å; M148-T153 VanDerWaalsContact O-N 3.14Å; M148-V229 HydrophobicContact SD-CG1 3.65Å; M148-V233 HydrophobicContact SD-CG2 3.99Å; M148-P745 VanDerWaalsContact CE-CA 3.43Å; M148-P745 HydrophobicContact CE-CB 3.32Å; M148-P745 WeakPolarHBondContact CG-O 3.33Å
149	T	91.2	Very high	89.8	Confident	53 Å²	53	38.9 Å²	38.9	33%	0.325	21%	0.214	S	C	.	.	I	π-helix	trans	-65.8	-47.1	177.3	-61.3	0	0	0	0	111.8	S145 L146 I147 T153 L154	S145-T149 WeakPolarHBondContact O-CB 3.38Å; S145-T149 PolarHBondContact O-N 3.31Å; S145-T149 PolarHBondContact O-OG1 3.06Å; L146-T149 PolarHBondContact O-N 3.09Å; I147-T149 VanDerWaalsContact C-N 3.31Å; I147-T149 PolarHBondContact O-N 3.18Å; T149-T153 VanDerWaalsContact CA-OG1 3.22Å; T149-T153 WeakPolarHBondContact CA-OG1 3.41Å; T149-T153 WeakPolarHBondContact CG2-OG1 3.44Å; T149-T153 PolarHBondContact O-N 3.15Å; T149-T153 PolarHBondContact O-OG1 2.98Å; T149-L154 WeakPolarHBondContact O-CB 3.08Å; T149-L154 PolarHBondContact O-N 3.27Å
150	I	92.1	Very high	89.2	Confident	78 Å²	78	40 Å²	40	40%	0.4	21%	0.214	S	C	.	.	I	π-helix	trans	-69.7	-40.5	-176.8	-69.7	172.3	0	0	0	112.4	L146 I147 P155	L146-I150 HydrophobicContact CD2-CD1 3.44Å; L146-I150 VanDerWaalsContact CD2-CD1 3.44Å; L146-I150 HydrophobicContact CG-CD1 3.74Å; L146-I150 HydrophobicContact CG-CG1 4.47Å; L146-I150 WeakPolarHBondContact O-CB 3.43Å; L146-I150 VanDerWaalsContact O-CG1 3.22Å; L146-I150 WeakPolarHBondContact O-CG1 3.35Å; L146-I150 PolarHBondContact O-N 3.1Å; I147-I150 PolarHBondContact O-N 3.03Å; I150-P155 WeakPolarHBondContact O-CD 3.44Å
151	F	91.4	Very high	88.6	Confident	101 Å²	101	43.3 Å²	43.3	44%	0.443	24%	0.243	S	C	.	.	I	π-helix	trans	-99.4	-20	-171.7	-70.2	-82	0	0	0	114.5	I147 Y220 V229	I147-F151 HydrophobicContact CG2-CD2 3.94Å; I147-F151 HydrophobicContact CG2-CE2 4.46Å; I147-F151 WeakPolarHBondContact O-CB 3.47Å; I147-F151 WeakPolarHBondContact O-CD2 3.39Å; I147-F151 PolarHBondContact O-N 3.27Å; F151-Y220 PolarHBondContact O-OH 2.92Å; F151-V229 HydrophobicContact CB-CG1 4.37Å; F151-V229 HydrophobicContact CB-CG2 3.56Å; F151-V229 HydrophobicContact CG-CG2 4.18Å
152	I	89.9	Confident	87.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-115.1	-55.5	-178.2	-59.7	172	0	0	0	110.5	M148 Y208 Y226 V229 P745	M148-I152 HydrophobicContact CE-CD1 3.46Å; M148-I152 VanDerWaalsContact CE-CD1 3.46Å; M148-I152 WeakPolarHBondContact O-CA 3.49Å; M148-I152 VanDerWaalsContact O-CB 3.3Å; M148-I152 WeakPolarHBondContact O-CB 3.28Å; M148-I152 PolarHBondContact O-N 3.19Å; M148-I152 HydrophobicContact SD-CD1 3.71Å; I152-Y208 HydrophobicContact CG2-CD1 4.16Å; I152-Y208 HydrophobicContact CG2-CE1 3.55Å; I152-Y226 HydrophobicContact CD1-CD2 4.12Å; I152-Y226 HydrophobicContact CD1-CE2 4.45Å; I152-Y226 HydrophobicContact CG2-CD2 3.73Å; I152-Y226 HydrophobicContact CG2-CE2 4.09Å; I152-V229 HydrophobicContact CD1-CB 3.99Å; I152-V229 HydrophobicContact CD1-CG1 3.8Å; I152-V229 HydrophobicContact CG1-CB 4.2Å; I152-V229 HydrophobicContact CG1-CG1 4.13Å; I152-V229 HydrophobicContact CG1-CG2 4.38Å; I152-P745 HydrophobicContact CD1-CB 4.36Å; I152-P745 HydrophobicContact CG2-CB 4.48Å
153	T	88.1	Confident	86.2	Confident	13 Å²	13	44.7 Å²	44.7	8%	0.08	27%	0.266	C	S	.	.	I	π-helix	trans	-77.7	-42.4	-171.9	76.1	0	0	0	0	112.3	M148 T149 E156 C157 Y208 L746	M148-T153 PolarHBondContact O-N 2.9Å; M148-T153 VanDerWaalsContact O-N 3.14Å; T149-T153 VanDerWaalsContact CA-OG1 3.22Å; T149-T153 WeakPolarHBondContact CA-OG1 3.41Å; T149-T153 WeakPolarHBondContact CG2-OG1 3.44Å; T149-T153 PolarHBondContact O-N 3.15Å; T149-T153 PolarHBondContact O-OG1 2.98Å; T153-E156 PolarHBondContact O-N 2.95Å; T153-C157 PolarHBondContact O-N 3.41Å; T153-C157 PolarHBondContact O-SG 3.44Å; T153-Y208 WeakPolarHBondContact CG2-OH 3.46Å; T153-L746 HydrophobicContact CG2-CD1 3.95Å
154	L	88.6	Confident	85	Confident	84 Å²	84	45.2 Å²	45.2	44%	0.44	27%	0.27	S	S	.	.	H	α-helix	trans	-65	-46	-176	-173.1	78.8	0	0	0	112.4	T149 E156 C157 I158	T149-L154 WeakPolarHBondContact O-CB 3.08Å; T149-L154 PolarHBondContact O-N 3.27Å; L154-E156 PolarHBondContact O-N 2.9Å; L154-C157 PolarHBondContact O-N 3.02Å; L154-I158 HydrophobicContact CD1-CD1 4.44Å; L154-I158 HydrophobicContact CD2-CD1 4.41Å; L154-I158 HydrophobicContact CG-CD1 3.9Å; L154-I158 WeakPolarHBondContact O-CB 3.33Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.28Å; L154-I158 PolarHBondContact O-N 3.37Å
155	P	86.6	Confident	83.9	Confident	23 Å²	23	52.3 Å²	52.3	15%	0.149	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-35	176.8	-24.8	37.5	0	0	0	112.5	I150 A159 Y220	I150-P155 WeakPolarHBondContact O-CD 3.44Å; P155-A159 VanDerWaalsContact O-CB 3.29Å; P155-A159 WeakPolarHBondContact O-CB 3.26Å; P155-A159 PolarHBondContact O-N 3.26Å; P155-Y220 HydrophobicContact CB-CD1 4.1Å; P155-Y220 HydrophobicContact CB-CE1 3.89Å; P155-Y220 HydrophobicContact CG-CE1 4.16Å
156	E	84.1	Confident	82.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-73.4	-41.6	178	-77	-72.8	122.8	0	0	112.9	T153 L154 I158 A159 D160 R167 K175 Y208 L222	T153-E156 PolarHBondContact O-N 2.95Å; L154-E156 PolarHBondContact O-N 2.9Å; E156-I158 VanDerWaalsContact C-N 3.3Å; E156-I158 PolarHBondContact O-N 3.11Å; E156-A159 PolarHBondContact O-N 3.24Å; E156-D160 VanDerWaalsContact O-CG 3.26Å; E156-D160 PolarHBondContact O-N 3.06Å; E156-R167 VanDerWaalsContact CD-NH2 3.33Å; E156-R167 IonicContact OE1-CZ 3.86Å; E156-R167 IonicContact OE1-NH1 2.87Å; E156-R167 IonicContact OE1-NH2 3.41Å; E156-R167 PolarHBondContact OE1-NH2 3.37Å; E156-R167 VanDerWaalsContact OE1-NH2 3.12Å; E156-R167 IonicContact OE2-NH2 2.74Å; E156-R167 PolarHBondContact OE2-NH2 3.22Å; E156-K175 IonicContact OE2-NZ 2.62Å; E156-Y208 HydrophobicContact CB-CD1 4.34Å; E156-Y208 HydrophobicContact CB-CE1 4.35Å; E156-Y208 HydrophobicContact CG-CD1 3.87Å; E156-Y208 HydrophobicContact CG-CE1 4.23Å; E156-L222 HydrophobicContact CG-CD1 3.34Å; E156-L222 HydrophobicContact CG-CD2 3.59Å; E156-L222 HydrophobicContact CG-CG 4.03Å; E156-L222 WeakPolarHBondContact OE1-CD2 3.37Å
157	C	83.1	Confident	81.8	Confident	53 Å²	53	56.5 Å²	56.5	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-38.9	173	-66.8	0	0	0	0	111.8	T153 L154 D160 A161	T153-C157 PolarHBondContact O-N 3.41Å; T153-C157 PolarHBondContact O-SG 3.44Å; L154-C157 PolarHBondContact O-N 3.02Å; C157-D160 PolarHBondContact O-N 3.44Å; C157-A161 WeakPolarHBondContact O-CB 3.35Å; C157-A161 PolarHBondContact O-N 2.56Å
158	I	83.9	Confident	80.7	Confident	74 Å²	74	61.1 Å²	61.1	38%	0.379	33%	0.33	S	S	.	.	H	α-helix	trans	-66.7	-40.5	175.5	-68.4	167.3	0	0	0	110.3	L154 E156 D160 A161 A162	L154-I158 HydrophobicContact CD1-CD1 4.44Å; L154-I158 HydrophobicContact CD2-CD1 4.41Å; L154-I158 HydrophobicContact CG-CD1 3.9Å; L154-I158 WeakPolarHBondContact O-CB 3.33Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.28Å; L154-I158 PolarHBondContact O-N 3.37Å; E156-I158 VanDerWaalsContact C-N 3.3Å; E156-I158 PolarHBondContact O-N 3.11Å; I158-D160 VanDerWaalsContact C-N 3.31Å; I158-D160 PolarHBondContact O-N 3.07Å; I158-A161 PolarHBondContact O-N 3.22Å; I158-A162 WeakPolarHBondContact O-CB 3.41Å; I158-A162 PolarHBondContact O-N 3.3Å
159	A	79.5	Confident	79.8	Confident	2 Å²	2	66.4 Å²	66.4	2%	0.017	36%	0.359	C	S	.	.	H	α-helix	trans	-65.2	-35.4	177.9	0	0	0	0	0	113	P155 E156 R167 Y213	P155-A159 VanDerWaalsContact O-CB 3.29Å; P155-A159 WeakPolarHBondContact O-CB 3.26Å; P155-A159 PolarHBondContact O-N 3.26Å; E156-A159 PolarHBondContact O-N 3.24Å; A159-R167 VanDerWaalsContact CB-NH2 3.3Å; A159-Y213 HydrophobicContact CB-CD1 4.33Å; A159-Y213 HydrophobicContact CB-CD2 3.32Å; A159-Y213 HydrophobicContact CB-CE1 4.41Å; A159-Y213 HydrophobicContact CB-CE2 3.44Å; A159-Y213 VanDerWaalsContact CB-CE2 3.44Å; A159-Y213 HydrophobicContact CB-CG 3.76Å
160	D	76.4	Confident	78.8	Confident	52 Å²	52	68.3 Å²	68.3	28%	0.278	37%	0.366	S	S	.	.	H	α-helix	trans	-72.9	-33.3	173.3	-64.4	-18.8	0	0	0	112.1	E156 C157 I158 R167 K175 Y207	E156-D160 VanDerWaalsContact O-CG 3.26Å; E156-D160 PolarHBondContact O-N 3.06Å; C157-D160 PolarHBondContact O-N 3.44Å; I158-D160 VanDerWaalsContact C-N 3.31Å; I158-D160 PolarHBondContact O-N 3.07Å; D160-R167 IonicContact OD1-NE 2.72Å; D160-R167 IonicContact OD1-NH2 2.71Å; D160-K175 IonicContact OD1-NZ 2.96Å; D160-K175 PolarHBondContact OD1-NZ 3.15Å; D160-K175 IonicContact OD2-NZ 2.9Å; D160-K175 PolarHBondContact OD2-NZ 2.95Å; D160-Y207 PolarHBondContact OD2-OH 3.43Å
161	A	79.2	Confident	77.8	Confident	81 Å²	81	64.8 Å²	64.8	67%	0.669	35%	0.348	S	S	*	.	H	α-helix	trans	-76.2	-27.3	177.4	0	0	0	0	0	113.7	C157 I158 A163	C157-A161 WeakPolarHBondContact O-CB 3.35Å; C157-A161 PolarHBondContact O-N 2.56Å; I158-A161 PolarHBondContact O-N 3.22Å; A161-A163 PolarHBondContact O-N 3.3Å
162	A	75	Confident	76.6	Confident	45 Å²	45	61 Å²	61	37%	0.372	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-10.9	178.3	0	0	0	0	0	113.5	I158 D164 Y213	I158-A162 WeakPolarHBondContact O-CB 3.41Å; I158-A162 PolarHBondContact O-N 3.3Å; A162-D164 PolarHBondContact O-N 3.18Å; A162-Y213 HydrophobicContact CB-CE2 4.23Å; A162-Y213 WeakPolarHBondContact CB-OH 3.33Å
163	A	61	Low	75.3	Confident	68 Å²	68	63.9 Å²	63.9	56%	0.562	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	39.8	165.2	0	0	0	0	0	116.5	A161 E165	A161-A163 PolarHBondContact O-N 3.3Å; A163-E165 PolarHBondContact O-N 3.27Å
164	D	68.8	Low	74.3	Confident	80 Å²	80	66.3 Å²	66.3	43%	0.428	38%	0.376	S	S	.	.			trans	-63.3	109.1	162.3	-71.3	-30.9	0	0	0	109	A162 Y166 R167 K168	A162-D164 PolarHBondContact O-N 3.18Å; D164-Y166 PolarHBondContact O-N 2.91Å; D164-R167 HydrophobicContact CB-CB 4.17Å; D164-R167 PolarHBondContact O-N 3.42Å; D164-K168 PolarHBondContact O-N 3.19Å
165	E	70.8	Confident	73.5	Confident	150 Å²	150	64 Å²	64	70%	0.701	36%	0.362	S	S	*	.	H	α-helix	trans	-56	-39.2	-174	-169.4	168.6	-160.5	0	0	112.3	A163 R167 K168 N169	A163-E165 PolarHBondContact O-N 3.27Å; E165-R167 PolarHBondContact O-N 3.44Å; E165-K168 PolarHBondContact O-N 3.4Å; E165-N169 PolarHBondContact O-N 2.72Å
166	Y	69.4	Low	72.7	Confident	181 Å²	181	68 Å²	68	71%	0.71	38%	0.379	S	S	*	.	H	α-helix	trans	-58.5	-48.7	175.2	-179.6	-100.9	0	0	0	112.8	D164 K168 L170	D164-Y166 PolarHBondContact O-N 2.91Å; Y166-K168 VanDerWaalsContact C-N 3.35Å; Y166-L170 PolarHBondContact O-N 2.65Å
167	R	72	Confident	72.1	Confident	18 Å²	18	69.8 Å²	69.8	7%	0.068	39%	0.388	C	S	.	.	H	α-helix	trans	-67.2	-38.7	179	176.6	-178.9	160.8	129.2	0.8	111	E156 A159 D160 D164 E165 L170 T171	E156-R167 VanDerWaalsContact CD-NH2 3.33Å; E156-R167 IonicContact OE1-CZ 3.86Å; E156-R167 IonicContact OE1-NH1 2.87Å; E156-R167 IonicContact OE1-NH2 3.41Å; E156-R167 PolarHBondContact OE1-NH2 3.37Å; E156-R167 VanDerWaalsContact OE1-NH2 3.12Å; E156-R167 IonicContact OE2-NH2 2.74Å; E156-R167 PolarHBondContact OE2-NH2 3.22Å; A159-R167 VanDerWaalsContact CB-NH2 3.3Å; D160-R167 IonicContact OD1-NE 2.72Å; D160-R167 IonicContact OD1-NH2 2.71Å; D164-R167 HydrophobicContact CB-CB 4.17Å; D164-R167 PolarHBondContact O-N 3.42Å; E165-R167 PolarHBondContact O-N 3.44Å; R167-L170 PolarHBondContact O-N 2.94Å; R167-T171 WeakPolarHBondContact O-CB 3.44Å; R167-T171 PolarHBondContact O-N 2.98Å; R167-T171 PolarHBondContact O-OG1 3.28Å
168	K	71.9	Confident	71.4	Confident	127 Å²	127	71 Å²	71	55%	0.552	39%	0.394	S	S	*	.	H	α-helix	trans	-62	-47.1	179.6	-171	-178.5	177	-173	0	111	D164 E165 Y166 L170 T171 A172	D164-K168 PolarHBondContact O-N 3.19Å; E165-K168 PolarHBondContact O-N 3.4Å; Y166-K168 VanDerWaalsContact C-N 3.35Å; K168-L170 PolarHBondContact O-N 3.46Å; K168-T171 PolarHBondContact O-N 2.92Å; K168-A172 WeakPolarHBondContact O-CA 3.45Å; K168-A172 WeakPolarHBondContact O-CB 3.42Å; K168-A172 PolarHBondContact O-N 3.28Å
169	N	72.6	Confident	70.8	Confident	112 Å²	112	75.5 Å²	75.5	60%	0.599	41%	0.413	S	S	*	.	H	α-helix	trans	-63.1	-42.2	178	-69.5	-10	0	0	0	111.5	E165 T171 A172	E165-N169 PolarHBondContact O-N 2.72Å; N169-T171 VanDerWaalsContact C-N 3.31Å; N169-T171 PolarHBondContact O-N 3.27Å; N169-A172 WeakPolarHBondContact O-CB 3.28Å; N169-A172 PolarHBondContact O-N 2.95Å
170	L	70.4	Confident	70.1	Confident	92 Å²	92	82.6 Å²	82.6	48%	0.482	44%	0.444	S	S	.	.	H	α-helix	trans	-68.4	-29.7	179.4	-162	69.3	0	0	0	113.4	Y166 R167 K168 Q211	Y166-L170 PolarHBondContact O-N 2.65Å; R167-L170 PolarHBondContact O-N 2.94Å; K168-L170 PolarHBondContact O-N 3.46Å; L170-Q211 HydrophobicContact CD2-CG 3.96Å; L170-Q211 VanDerWaalsContact CD2-NE2 3.28Å
171	T	71.9	Confident	69.7	Low	5 Å²	5	83.6 Å²	83.6	3%	0.031	45%	0.447	C	S	.	.	H	α-helix	trans	-99.2	-5	-178.4	-35.2	0	0	0	0	112.7	R167 K168 N169 G173 H174 K175	R167-T171 WeakPolarHBondContact O-CB 3.44Å; R167-T171 PolarHBondContact O-N 2.98Å; R167-T171 PolarHBondContact O-OG1 3.28Å; K168-T171 PolarHBondContact O-N 2.92Å; N169-T171 VanDerWaalsContact C-N 3.31Å; N169-T171 PolarHBondContact O-N 3.27Å; T171-G173 VanDerWaalsContact C-N 3.33Å; T171-G173 PolarHBondContact O-N 3.12Å; T171-H174 PolarHBondContact O-N 2.86Å; T171-K175 HydrophobicContact CG2-CD 3.57Å; T171-K175 HydrophobicContact CG2-CG 3.99Å; T171-K175 PolarHBondContact O-N 3.22Å
172	A	65.9	Low	69.5	Low	22 Å²	22	83.7 Å²	83.7	18%	0.182	44%	0.436	C	S	.	.	H	α-helix	trans	-57.5	-44.9	-176.1	0	0	0	0	0	111.6	K168 N169 H174 K175 Q176	K168-A172 WeakPolarHBondContact O-CA 3.45Å; K168-A172 WeakPolarHBondContact O-CB 3.42Å; K168-A172 PolarHBondContact O-N 3.28Å; N169-A172 WeakPolarHBondContact O-CB 3.28Å; N169-A172 PolarHBondContact O-N 2.95Å; A172-H174 PolarHBondContact O-N 3.36Å; A172-H174 VanDerWaalsContact O-N 3.11Å; A172-K175 PolarHBondContact O-N 2.9Å; A172-K175 VanDerWaalsContact O-N 3.14Å; A172-Q176 WeakPolarHBondContact O-CB 2.99Å; A172-Q176 PolarHBondContact O-N 2.93Å
173	G	63.3	Low	69.5	Low	60 Å²	60	88.9 Å²	88.9	62%	0.619	45%	0.452	S	S	*	.	H	α-helix	trans	-59.1	-26.8	-179.4	0	0	0	0	0	114.7	T171	T171-G173 VanDerWaalsContact C-N 3.33Å; T171-G173 PolarHBondContact O-N 3.12Å
174	H	66	Low	70.1	Confident	64 Å²	64	88.8 Å²	88.8	30%	0.296	45%	0.445	S	S	.	.	H	α-helix	trans	-96.7	-18.1	-179.9	-58.4	162.1	0	0	0	113.6	T171 A172 T832	T171-H174 PolarHBondContact O-N 2.86Å; A172-H174 PolarHBondContact O-N 3.36Å; A172-H174 VanDerWaalsContact O-N 3.11Å; H174-T832 PolarHBondContact CE1-O 3.13Å
175	K	72.7	Confident	70.2	Confident	34 Å²	34	85 Å²	85	15%	0.148	43%	0.425	C	S	.	.	H	α-helix	trans	-111.7	-28	-173.1	-68.7	-178.6	177.3	179.2	0	113.5	E156 D160 T171 A172 Y207	E156-K175 IonicContact OE2-NZ 2.62Å; D160-K175 IonicContact OD1-NZ 2.96Å; D160-K175 PolarHBondContact OD1-NZ 3.15Å; D160-K175 IonicContact OD2-NZ 2.9Å; D160-K175 PolarHBondContact OD2-NZ 2.95Å; T171-K175 HydrophobicContact CG2-CD 3.57Å; T171-K175 HydrophobicContact CG2-CG 3.99Å; T171-K175 PolarHBondContact O-N 3.22Å; A172-K175 PolarHBondContact O-N 2.9Å; A172-K175 VanDerWaalsContact O-N 3.14Å; K175-Y207 HydrophobicContact CD-CE2 4.1Å; K175-Y207 WeakPolarHBondContact CE-O 3.25Å; K175-Y207 HydrophobicContact CG-CD2 4.11Å; K175-Y207 HydrophobicContact CG-CE2 3.99Å
176	Q	69.2	Low	70.7	Confident	109 Å²	109	83.9 Å²	83.9	51%	0.509	42%	0.423	S	S	.	.	S	Bend	trans	-99.5	136.6	-179.4	-65.9	-176.7	-24.6	0	0	111	A172 R200	A172-Q176 WeakPolarHBondContact O-CB 2.99Å; A172-Q176 PolarHBondContact O-N 2.93Å; Q176-R200 VanDerWaalsContact C-CD 3.5Å; Q176-R200 VanDerWaalsContact O-CZ 3.25Å; Q176-R200 PolarHBondContact O-NE 2.89Å; Q176-R200 PolarHBondContact O-NH2 3.41Å; Q176-R200 VanDerWaalsContact O-NH2 3.08Å
177	L	71	Confident	71.3	Confident	37 Å²	37	82.3 Å²	82.3	19%	0.194	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-77.2	130	179.2	-166.8	64.2	0	0	0	109.3	E181 L182 A185 Y197	L177-E181 HydrophobicContact CD1-CB 3.38Å; L177-E181 HydrophobicContact CD1-CG 4.33Å; L177-E181 HydrophobicContact CG-CB 3.78Å; L177-L182 HydrophobicContact CD2-CB 4.19Å; L177-L182 HydrophobicContact CD2-CD1 3.81Å; L177-A185 HydrophobicContact CD2-CB 3.69Å; L177-Y197 HydrophobicContact CD2-CD1 4.43Å; L177-Y197 HydrophobicContact CD2-CE1 4.24Å
178	T	68.5	Low	71.4	Confident	79 Å²	79	88 Å²	88	49%	0.485	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-67.6	147.9	175.2	-49.5	0	0	0	0	109.3	K180 E181 L182	T178-K180 PolarHBondContact O-N 3.28Å; T178-K180 VanDerWaalsContact O-N 3.13Å; T178-E181 PolarHBondContact N-OE2 2.83Å; T178-E181 PolarHBondContact O-N 3.29Å; T178-L182 PolarHBondContact O-N 3.03Å; T178-L182 VanDerWaalsContact O-N 3.15Å
179	E	71	Confident	71.3	Confident	167 Å²	167	86.2 Å²	86.2	78%	0.78	44%	0.442	S	S	*	.	H	α-helix	trans	-52.3	-40	-176	-65.7	-177.1	165.4	0	0	113.2	E181 L182	E179-E181 VanDerWaalsContact C-N 3.3Å; E179-E181 PolarHBondContact O-N 2.84Å; E179-L182 VanDerWaalsContact O-CB 3.31Å; E179-L182 WeakPolarHBondContact O-CB 3.11Å; E179-L182 PolarHBondContact O-N 3.44Å
180	K	65.4	Low	71.2	Confident	151 Å²	151	81.9 Å²	81.9	66%	0.657	42%	0.419	S	S	*	.	H	α-helix	trans	-63.2	-32.6	176.2	-64.3	-179.8	-179.1	173.6	0	113.8	T178	T178-K180 PolarHBondContact O-N 3.28Å; T178-K180 VanDerWaalsContact O-N 3.13Å
181	E	68.3	Low	71.4	Confident	73 Å²	73	80.6 Å²	80.6	34%	0.341	42%	0.415	S	S	.	.	H	α-helix	trans	-81.9	-23.3	179.6	-63.8	-179.3	112.4	0	0	111.8	L177 T178 E179 E183 T184 A185 R200	L177-E181 HydrophobicContact CD1-CB 3.38Å; L177-E181 HydrophobicContact CD1-CG 4.33Å; L177-E181 HydrophobicContact CG-CB 3.78Å; T178-E181 PolarHBondContact N-OE2 2.83Å; T178-E181 PolarHBondContact O-N 3.29Å; E179-E181 VanDerWaalsContact C-N 3.3Å; E179-E181 PolarHBondContact O-N 2.84Å; E181-E183 VanDerWaalsContact C-N 3.33Å; E181-E183 PolarHBondContact O-N 3.47Å; E181-T184 PolarHBondContact O-N 3.35Å; E181-A185 WeakPolarHBondContact O-CB 3.16Å; E181-A185 PolarHBondContact O-N 2.89Å; E181-R200 IonicContact OE1-NH1 3.96Å; E181-R200 PolarHBondContact OE1-NH1 2.94Å; E181-R200 IonicContact OE2-CZ 2.69Å; E181-R200 IonicContact OE2-NH1 3.91Å; E181-R200 PolarHBondContact OE2-NH1 3.3Å; E181-R200 IonicContact OE2-NH2 2.68Å; E181-R200 PolarHBondContact OE2-NH2 3.48Å
182	L	74.9	Confident	71.4	Confident	83 Å²	83	85.5 Å²	85.5	44%	0.435	43%	0.433	S	S	.	.	H	α-helix	trans	-61.3	-41.5	177.2	-169.1	69.9	0	0	0	111.5	L177 T178 E179 T184 A185 Y197	L177-L182 HydrophobicContact CD2-CB 4.19Å; L177-L182 HydrophobicContact CD2-CD1 3.81Å; T178-L182 PolarHBondContact O-N 3.03Å; T178-L182 VanDerWaalsContact O-N 3.15Å; E179-L182 VanDerWaalsContact O-CB 3.31Å; E179-L182 WeakPolarHBondContact O-CB 3.11Å; E179-L182 PolarHBondContact O-N 3.44Å; L182-T184 PolarHBondContact O-N 2.72Å; L182-A185 PolarHBondContact O-N 3.4Å; L182-Y197 HydrophobicContact CD1-CE1 4.17Å; L182-Y197 WeakPolarHBondContact CD1-OH 3.46Å
183	E	75.1	Confident	71.5	Confident	154 Å²	154	85 Å²	85	72%	0.72	43%	0.427	S	S	*	.	H	α-helix	trans	-61.5	-32.6	178.8	-62.8	-176.8	170.8	0	0	112.9	E181	E181-E183 VanDerWaalsContact C-N 3.33Å; E181-E183 PolarHBondContact O-N 3.47Å
184	T	73.2	Confident	71.9	Confident	67 Å²	67	83 Å²	83	41%	0.411	40%	0.402	S	S	.	.	H	α-helix	trans	-95.4	-10.3	-176.7	-53.9	0	0	0	0	112.4	E181 L182 D186 Y187 T190	E181-T184 PolarHBondContact O-N 3.35Å; L182-T184 PolarHBondContact O-N 2.72Å; T184-D186 PolarHBondContact O-N 2.81Å; T184-Y187 HydrophobicContact CG2-CD2 3.72Å; T184-Y187 HydrophobicContact CG2-CE2 4.14Å; T184-Y187 WeakPolarHBondContact O-CD2 3.47Å; T184-Y187 PolarHBondContact O-N 3.01Å; T184-T190 VanDerWaalsContact O-CB 3.28Å; T184-T190 WeakPolarHBondContact O-CB 3.42Å; T184-T190 PolarHBondContact O-OG1 3.45Å
185	A	71.4	Confident	72	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-71.3	-26.9	-170.2	0	0	0	0	0	114.4	L177 E181 L182 Y197	L177-A185 HydrophobicContact CD2-CB 3.69Å; E181-A185 WeakPolarHBondContact O-CB 3.16Å; E181-A185 PolarHBondContact O-N 2.89Å; L182-A185 PolarHBondContact O-N 3.4Å; A185-Y197 HydrophobicContact CB-CD2 3.64Å; A185-Y197 HydrophobicContact CB-CE2 3.52Å; A185-Y197 HydrophobicContact CB-CG 4.42Å
186	D	80.1	Confident	72.1	Confident	126 Å²	126	83.2 Å²	83.2	67%	0.674	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-13.7	-179.9	-73.7	-23.2	0	0	0	113.6	T184 L188 Y197	T184-D186 PolarHBondContact O-N 2.81Å; D186-L188 PolarHBondContact O-N 3.2Å; D186-Y197 WeakPolarHBondContact OD1-CE2 2.88Å
187	Y	81.8	Confident	72.4	Confident	148 Å²	148	84 Å²	84	58%	0.58	40%	0.403	S	S	*	.	S	Bend	trans	-64.2	130.9	178.3	-65.5	-52	0	0	0	110.9	T184 Q189 T190 V191	T184-Y187 HydrophobicContact CG2-CD2 3.72Å; T184-Y187 HydrophobicContact CG2-CE2 4.14Å; T184-Y187 WeakPolarHBondContact O-CD2 3.47Å; T184-Y187 PolarHBondContact O-N 3.01Å; Y187-Q189 PolarHBondContact O-N 3.36Å; Y187-Q189 VanDerWaalsContact O-N 3.09Å; Y187-T190 WeakPolarHBondContact O-CA 3.4Å; Y187-T190 WeakPolarHBondContact O-CB 3.28Å; Y187-T190 PolarHBondContact O-N 2.88Å; Y187-V191 PolarHBondContact O-N 3.09Å
188	L	75.5	Confident	72.6	Confident	137 Å²	137	85 Å²	85	72%	0.717	41%	0.409	S	S	*	.	H	α-helix	trans	-54.4	-34.7	179.3	-173.1	147.4	0	0	0	112	D186 V191 W192	D186-L188 PolarHBondContact O-N 3.2Å; L188-V191 PolarHBondContact O-N 3.39Å; L188-W192 WeakPolarHBondContact O-CB 3.35Å; L188-W192 PolarHBondContact O-N 2.9Å
189	Q	69.2	Low	72.7	Confident	91 Å²	91	82.5 Å²	82.5	43%	0.425	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-44.8	174.9	-175	175.7	-13.7	0	0	112.1	Y187 W192 D193 A384	Y187-Q189 PolarHBondContact O-N 3.36Å; Y187-Q189 VanDerWaalsContact O-N 3.09Å; Q189-W192 PolarHBondContact O-N 3.31Å; Q189-D193 WeakPolarHBondContact O-CB 3.3Å; Q189-D193 PolarHBondContact O-N 3.18Å; Q189-A384 HydrophobicContact CG-CB 4.19Å
190	T	70.1	Confident	72.7	Confident	20 Å²	20	76.7 Å²	76.7	12%	0.123	37%	0.367	C	S	.	.	H	α-helix	trans	-63.4	-42.9	177.3	-51.2	0	0	0	0	111.3	T184 Y187 D193 F194 K195	T184-T190 VanDerWaalsContact O-CB 3.28Å; T184-T190 WeakPolarHBondContact O-CB 3.42Å; T184-T190 PolarHBondContact O-OG1 3.45Å; Y187-T190 WeakPolarHBondContact O-CA 3.4Å; Y187-T190 WeakPolarHBondContact O-CB 3.28Å; Y187-T190 PolarHBondContact O-N 2.88Å; T190-D193 PolarHBondContact O-N 2.9Å; T190-F194 PolarHBondContact O-N 2.92Å; T190-K195 HydrophobicContact CG2-CB 3.64Å; T190-K195 PolarHBondContact O-N 2.87Å
191	V	75.7	Confident	73.4	Confident	65 Å²	65	70.6 Å²	70.6	39%	0.394	34%	0.344	S	S	.	.	H	α-helix	trans	-64.2	-43.1	175.8	178.7	0	0	0	0	110.9	Y187 L188 D193 F194 L198	Y187-V191 PolarHBondContact O-N 3.09Å; L188-V191 PolarHBondContact O-N 3.39Å; V191-D193 VanDerWaalsContact C-N 3.29Å; V191-D193 PolarHBondContact O-N 3.45Å; V191-F194 PolarHBondContact O-N 2.87Å; V191-L198 HydrophobicContact CG1-CD1 3.85Å; V191-L198 WeakPolarHBondContact O-CD1 3.22Å
192	W	71.9	Confident	74.1	Confident	108 Å²	108	69.1 Å²	69.1	41%	0.409	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-32.3	177.9	-166.1	-95.1	0	0	0	112.5	L188 Q189 F194 M680 V683	L188-W192 WeakPolarHBondContact O-CB 3.35Å; L188-W192 PolarHBondContact O-N 2.9Å; Q189-W192 PolarHBondContact O-N 3.31Å; W192-F194 PolarHBondContact O-N 3.49Å; W192-M680 HydrophobicContact CD2-CE 4.45Å; W192-M680 VanDerWaalsContact CE2-CE 3.5Å; W192-M680 HydrophobicContact CG-CE 4.45Å; W192-M680 HydrophobicContact CZ2-CE 3.95Å; W192-M680 HydrophobicContact CZ2-SD 3.73Å; W192-V683 HydrophobicContact CH2-CG2 3.91Å; W192-V683 HydrophobicContact CZ2-CG2 4.28Å
193	D	66.9	Low	74.3	Confident	11 Å²	11	65.8 Å²	65.8	6%	0.059	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	1.3	172.3	-88.3	-36.2	0	0	0	113.7	Q189 T190 V191 K195 K676	Q189-D193 WeakPolarHBondContact O-CB 3.3Å; Q189-D193 PolarHBondContact O-N 3.18Å; T190-D193 PolarHBondContact O-N 2.9Å; V191-D193 VanDerWaalsContact C-N 3.29Å; V191-D193 PolarHBondContact O-N 3.45Å; D193-K195 HydrophobicContact CB-CB 4.5Å; D193-K195 HydrophobicContact CB-CD 4.48Å; D193-K195 HydrophobicContact CB-CG 4.25Å; D193-K195 PolarHBondContact O-N 3.34Å; D193-K676 WeakPolarHBondContact O-CE 3.42Å; D193-K676 WeakPolarHBondContact OD1-CE 3.41Å; D193-K676 IonicContact OD1-NZ 3.46Å; D193-K676 PolarHBondContact OD1-NZ 3.49Å
194	F	72.2	Confident	74.5	Confident	18 Å²	18	58.4 Å²	58.4	8%	0.079	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	29.7	-171.9	-67.4	-90.7	0	0	0	113.6	T190 V191 W192 L198 A199 L203 F204 Q672 A675 K676 T679 M750	T190-F194 PolarHBondContact O-N 2.92Å; V191-F194 PolarHBondContact O-N 2.87Å; W192-F194 PolarHBondContact O-N 3.49Å; F194-L198 HydrophobicContact CD1-CB 4.4Å; F194-L198 HydrophobicContact CD1-CD1 3.87Å; F194-L198 HydrophobicContact CE1-CD1 4.33Å; F194-A199 PolarHBondContact O-N 2.89Å; F194-L203 HydrophobicContact CD1-CD2 4.34Å; F194-L203 HydrophobicContact CE1-CD2 4.33Å; F194-F204 HydrophobicContact CB-CE2 4.1Å; F194-F204 HydrophobicContact CB-CZ 3.69Å; F194-F204 HydrophobicContact CD1-CE2 4.32Å; F194-F204 AromaticContact CD1-CZ 3.89Å; F194-F204 HydrophobicContact CD1-CZ 3.89Å; F194-F204 HydrophobicContact CG-CZ 4.03Å; F194-Q672 HydrophobicContact CB-CG 4.3Å; F194-Q672 PolarHBondContact O-NE2 3.41Å; F194-A675 HydrophobicContact CD2-CB 4.45Å; F194-A675 HydrophobicContact CE2-CB 4.32Å; F194-A675 HydrophobicContact CZ-CB 4.37Å; F194-K676 HydrophobicContact CD2-CG 3.69Å; F194-K676 HydrophobicContact CE2-CG 4.1Å; F194-T679 HydrophobicContact CE2-CG2 4.13Å; F194-T679 HydrophobicContact CZ-CG2 3.63Å; F194-M750 HydrophobicContact CE1-CE 3.73Å; F194-M750 HydrophobicContact CZ-CE 3.66Å
195	K	68.3	Low	74.7	Confident	96 Å²	96	55.2 Å²	55.2	42%	0.417	27%	0.269	S	S	.	.			trans	-96.8	179.9	173.3	-70.9	-171.9	176.3	-173.4	0	110.6	T190 D193 Y197 L198	T190-K195 HydrophobicContact CG2-CB 3.64Å; T190-K195 PolarHBondContact O-N 2.87Å; D193-K195 HydrophobicContact CB-CB 4.5Å; D193-K195 HydrophobicContact CB-CD 4.48Å; D193-K195 HydrophobicContact CB-CG 4.25Å; D193-K195 PolarHBondContact O-N 3.34Å; K195-Y197 PolarHBondContact O-N 3.43Å; K195-L198 PolarHBondContact O-N 3.11Å
196	G	73.7	Confident	74.7	Confident	8 Å²	8	55.7 Å²	55.7	8%	0.082	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	66	-129.4	-178.5	0	0	0	0	0	112.3	L198 A199	G196-L198 PolarHBondContact O-N 3.26Å; G196-A199 PolarHBondContact O-N 3.22Å
197	Y	75.5	Confident	74.7	Confident	125 Å²	125	51.2 Å²	51.2	49%	0.49	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-56.9	-35.5	179.7	-67	-71	0	0	0	113.7	L177 L182 A185 D186 K195	L177-Y197 HydrophobicContact CD2-CD1 4.43Å; L177-Y197 HydrophobicContact CD2-CE1 4.24Å; L182-Y197 HydrophobicContact CD1-CE1 4.17Å; L182-Y197 WeakPolarHBondContact CD1-OH 3.46Å; A185-Y197 HydrophobicContact CB-CD2 3.64Å; A185-Y197 HydrophobicContact CB-CE2 3.52Å; A185-Y197 HydrophobicContact CB-CG 4.42Å; D186-Y197 WeakPolarHBondContact OD1-CE2 2.88Å; K195-Y197 PolarHBondContact O-N 3.43Å
198	L	76.2	Confident	74.7	Confident	58 Å²	58	44.2 Å²	44.2	30%	0.304	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-72.1	-32.8	-179	-73.1	177.5	0	0	0	112.4	V191 F194 K195 G196 R200 S201 F204	V191-L198 HydrophobicContact CG1-CD1 3.85Å; V191-L198 WeakPolarHBondContact O-CD1 3.22Å; F194-L198 HydrophobicContact CD1-CB 4.4Å; F194-L198 HydrophobicContact CD1-CD1 3.87Å; F194-L198 HydrophobicContact CE1-CD1 4.33Å; K195-L198 PolarHBondContact O-N 3.11Å; G196-L198 PolarHBondContact O-N 3.26Å; L198-R200 PolarHBondContact O-N 3.33Å; L198-S201 VanDerWaalsContact O-CB 3.26Å; L198-S201 WeakPolarHBondContact O-CB 3.5Å; L198-S201 PolarHBondContact O-N 3.33Å; L198-S201 VanDerWaalsContact O-N 3.14Å; L198-S201 PolarHBondContact O-OG 3.27Å; L198-F204 WeakPolarHBondContact O-CD2 3.27Å; L198-F204 WeakPolarHBondContact O-CE2 3.39Å
199	A	69.6	Low	74.8	Confident	27 Å²	27	38.1 Å²	38.1	22%	0.223	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-34.4	178.5	0	0	0	0	0	112.3	F194 G196 S201	F194-A199 PolarHBondContact O-N 2.89Å; G196-A199 PolarHBondContact O-N 3.22Å; A199-S201 VanDerWaalsContact C-N 3.33Å
200	R	72.1	Confident	75.2	Confident	45 Å²	45	37 Å²	37	17%	0.17	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	18.5	179	-68.7	174.4	164.7	93	-18.9	113.3	Q176 E181 L198 Y207	Q176-R200 VanDerWaalsContact C-CD 3.5Å; Q176-R200 VanDerWaalsContact O-CZ 3.25Å; Q176-R200 PolarHBondContact O-NE 2.89Å; Q176-R200 PolarHBondContact O-NH2 3.41Å; Q176-R200 VanDerWaalsContact O-NH2 3.08Å; E181-R200 IonicContact OE1-NH1 3.96Å; E181-R200 PolarHBondContact OE1-NH1 2.94Å; E181-R200 IonicContact OE2-CZ 2.69Å; E181-R200 IonicContact OE2-NH1 3.91Å; E181-R200 PolarHBondContact OE2-NH1 3.3Å; E181-R200 IonicContact OE2-NH2 2.68Å; E181-R200 PolarHBondContact OE2-NH2 3.48Å; L198-R200 PolarHBondContact O-N 3.33Å; R200-Y207 VanDerWaalsContact O-CD2 3.24Å; R200-Y207 WeakPolarHBondContact O-CD2 3.47Å
201	S	80.7	Confident	75.4	Confident	23 Å²	23	39.4 Å²	39.4	16%	0.161	20%	0.196	C	C	.	.	S	Bend	trans	-87.7	157.4	176.3	74.2	0	0	0	0	111.7	L198 A199 L203 F204	L198-S201 VanDerWaalsContact O-CB 3.26Å; L198-S201 WeakPolarHBondContact O-CB 3.5Å; L198-S201 PolarHBondContact O-N 3.33Å; L198-S201 VanDerWaalsContact O-N 3.14Å; L198-S201 PolarHBondContact O-OG 3.27Å; A199-S201 VanDerWaalsContact C-N 3.33Å; S201-L203 PolarHBondContact O-N 3.27Å; S201-L203 VanDerWaalsContact OG-CB 3.27Å; S201-L203 WeakPolarHBondContact OG-CB 3.12Å; S201-L203 PolarHBondContact OG-N 3.04Å; S201-F204 PolarHBondContact O-N 2.95Å
202	P	81.6	Confident	75.4	Confident	41 Å²	41	39.9 Å²	39.9	27%	0.266	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	4.6	174.9	28.8	-37.3	0	0	0	113.6	Y207 Y208	P202-Y207 HydrophobicContact CB-CD1 3.97Å; P202-Y207 HydrophobicContact CB-CE1 4.13Å; P202-Y207 HydrophobicContact CB-CG 4.31Å; P202-Y208 PolarHBondContact O-OH 3.37Å
203	L	80	Confident	75.3	Confident	13 Å²	13	35.3 Å²	35.3	7%	0.068	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-38.6	171.6	-178.9	60.9	0	0	0	111.4	F194 S201 C744 L746 M750	F194-L203 HydrophobicContact CD1-CD2 4.34Å; F194-L203 HydrophobicContact CE1-CD2 4.33Å; S201-L203 PolarHBondContact O-N 3.27Å; S201-L203 VanDerWaalsContact OG-CB 3.27Å; S201-L203 WeakPolarHBondContact OG-CB 3.12Å; S201-L203 PolarHBondContact OG-N 3.04Å; L203-C744 WeakPolarHBondContact CD1-SG 3.32Å; L203-C744 PolarHBondContact O-SG 3.17Å; L203-L746 HydrophobicContact CD1-CB 3.72Å; L203-M750 HydrophobicContact CD1-CG 4.07Å; L203-M750 HydrophobicContact CD1-SD 3.56Å; L203-M750 VanDerWaalsContact CD1-SD 3.56Å; L203-M750 HydrophobicContact CD2-SD 3.47Å; L203-M750 WeakPolarHBondContact CD2-SD 3.33Å; L203-M750 HydrophobicContact CG-SD 4.13Å
204	F	78.5	Confident	75	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-99.6	150.9	-169.8	-65.2	-69.5	0	0	0	113.4	F194 L198 S201 G206 Y207 Y208 L671 Q672 A675	F194-F204 HydrophobicContact CB-CE2 4.1Å; F194-F204 HydrophobicContact CB-CZ 3.69Å; F194-F204 HydrophobicContact CD1-CE2 4.32Å; F194-F204 AromaticContact CD1-CZ 3.89Å; F194-F204 HydrophobicContact CD1-CZ 3.89Å; F194-F204 HydrophobicContact CG-CZ 4.03Å; L198-F204 WeakPolarHBondContact O-CD2 3.27Å; L198-F204 WeakPolarHBondContact O-CE2 3.39Å; S201-F204 PolarHBondContact O-N 2.95Å; F204-G206 PolarHBondContact O-N 3.05Å; F204-Y207 WeakPolarHBondContact O-CB 3.22Å; F204-Y207 PolarHBondContact O-N 2.95Å; F204-Y208 WeakPolarHBondContact O-CD2 3.42Å; F204-L671 HydrophobicContact CD1-CB 4.02Å; F204-L671 HydrophobicContact CE1-CB 4.38Å; F204-Q672 HydrophobicContact CD1-CG 4.25Å; F204-Q672 HydrophobicContact CE1-CB 4.42Å; F204-Q672 HydrophobicContact CE1-CG 3.73Å; F204-Q672 HydrophobicContact CE2-CG 4.44Å; F204-Q672 HydrophobicContact CZ-CG 3.85Å; F204-A675 HydrophobicContact CE1-CB 4.16Å; F204-A675 HydrophobicContact CZ-CB 4.36Å
205	Y	77.4	Confident	74.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-52.1	-37.7	180	-177.1	-106.6	0	0	0	114.2	Y207 Y208 Y226 T667 F743 P835 F836	Y205-Y207 VanDerWaalsContact C-N 3.26Å; Y205-Y207 PolarHBondContact O-N 2.92Å; Y205-Y208 PolarHBondContact O-N 3.29Å; Y205-Y226 HydrophobicContact CD2-CE1 4.47Å; Y205-Y226 HydrophobicContact CE2-CE1 4.33Å; Y205-T667 HydrophobicContact CD1-CG2 3.37Å; Y205-T667 HydrophobicContact CE1-CG2 3.7Å; Y205-T667 HydrophobicContact CG-CG2 3.83Å; Y205-F743 VanDerWaalsContact CB-O 3.27Å; Y205-F743 WeakPolarHBondContact CB-O 3.12Å; Y205-F743 PolarHBondContact N-O 3.48Å; Y205-P835 HydrophobicContact CD2-CG 4.21Å; Y205-P835 HydrophobicContact CE2-CG 3.45Å; Y205-P835 VanDerWaalsContact CE2-CG 3.45Å; Y205-P835 VanDerWaalsContact CZ-CD 3.4Å; Y205-F836 AromaticContact CE2-CD2 3.95Å; Y205-F836 HydrophobicContact CE2-CD2 3.95Å; Y205-F836 HydrophobicContact CE2-CE2 4.32Å; Y205-F836 AromaticContact CZ-CD2 3.95Å; Y205-F836 WeakPolarHBondContact OH-CB 3.46Å; Y205-F836 WeakPolarHBondContact OH-CD2 3.25Å; Y205-F836 PolarHBondContact OH-N 2.83Å
206	G	72.2	Confident	74.2	Confident	10 Å²	10	45.2 Å²	45.2	10%	0.103	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-72	-15.4	-174.3	0	0	0	0	0	114.8	F204 Y208 C668	F204-G206 PolarHBondContact O-N 3.05Å; G206-Y208 PolarHBondContact O-N 3.46Å; G206-C668 WeakPolarHBondContact CA-SG 3.32Å; G206-C668 PolarHBondContact N-SG 3.38Å
207	Y	78.8	Confident	73.6	Confident	31 Å²	31	51.4 Å²	51.4	12%	0.122	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-65.8	-30.9	173.9	-176.2	-90.7	0	0	0	112	D160 K175 R200 P202 F204 Y205	D160-Y207 PolarHBondContact OD2-OH 3.43Å; K175-Y207 HydrophobicContact CD-CE2 4.1Å; K175-Y207 WeakPolarHBondContact CE-O 3.25Å; K175-Y207 HydrophobicContact CG-CD2 4.11Å; K175-Y207 HydrophobicContact CG-CE2 3.99Å; R200-Y207 VanDerWaalsContact O-CD2 3.24Å; R200-Y207 WeakPolarHBondContact O-CD2 3.47Å; P202-Y207 HydrophobicContact CB-CD1 3.97Å; P202-Y207 HydrophobicContact CB-CE1 4.13Å; P202-Y207 HydrophobicContact CB-CG 4.31Å; F204-Y207 WeakPolarHBondContact O-CB 3.22Å; F204-Y207 PolarHBondContact O-N 2.95Å; Y205-Y207 VanDerWaalsContact C-N 3.26Å; Y205-Y207 PolarHBondContact O-N 2.92Å
208	Y	82.4	Confident	73.3	Confident	1 Å²	1	52.8 Å²	52.8	0%	0.004	28%	0.279	C	S	.	.	S	Bend	trans	-84.3	130.4	-172.5	-62.4	-71.4	0	0	0	111.3	I152 T153 E156 P202 F204 Y205 G206 L222 Y226 P745 G834	I152-Y208 HydrophobicContact CG2-CD1 4.16Å; I152-Y208 HydrophobicContact CG2-CE1 3.55Å; T153-Y208 WeakPolarHBondContact CG2-OH 3.46Å; E156-Y208 HydrophobicContact CB-CD1 4.34Å; E156-Y208 HydrophobicContact CB-CE1 4.35Å; E156-Y208 HydrophobicContact CG-CD1 3.87Å; E156-Y208 HydrophobicContact CG-CE1 4.23Å; P202-Y208 PolarHBondContact O-OH 3.37Å; F204-Y208 WeakPolarHBondContact O-CD2 3.42Å; Y205-Y208 PolarHBondContact O-N 3.29Å; G206-Y208 PolarHBondContact O-N 3.46Å; Y208-L222 HydrophobicContact CD1-CD2 4.16Å; Y208-Y226 HydrophobicContact CD2-CE2 4.3Å; Y208-Y226 HydrophobicContact CE2-CE2 4.48Å; Y208-P745 HydrophobicContact CD2-CG 4.38Å; Y208-P745 HydrophobicContact CE2-CG 3.35Å; Y208-P745 VanDerWaalsContact OH-CG 3.31Å; Y208-P745 WeakPolarHBondContact OH-CG 3.46Å; Y208-G834 CarbonylContact O-C 3.59Å; Y208-G834 WeakPolarHBondContact O-CA 3.41Å
209	S	78	Confident	73.3	Confident	10 Å²	10	55.6 Å²	55.6	7%	0.07	29%	0.289	C	S	.	.			trans	-93.5	157.7	-177.3	-174.4	0	0	0	0	112.5	Q211 L222	S209-Q211 VanDerWaalsContact C-N 3.28Å; S209-Q211 PolarHBondContact OG-N 3.09Å; S209-L222 VanDerWaalsContact O-CD2 3.25Å; S209-L222 WeakPolarHBondContact O-CD2 3.19Å
210	N	78.2	Confident	74	Confident	68 Å²	68	57.4 Å²	57.4	36%	0.364	29%	0.29	S	S	.	.	S	Bend	trans	-81.7	-5.7	172.8	66.7	-10.2	0	0	0	113.2	P835 A837	N210-P835 WeakPolarHBondContact CB-O 3.49Å; N210-A837 HydrophobicContact CB-CB 4.47Å; N210-A837 PolarHBondContact ND2-O 2.85Å
211	Q	74.3	Confident	74.6	Confident	69 Å²	69	59.3 Å²	59.3	32%	0.322	30%	0.297	S	S	.	.	S	Bend	trans	-73.9	139.1	-175	-65.2	-63.5	-23.3	0	0	113.1	L170 S209	L170-Q211 HydrophobicContact CD2-CG 3.96Å; L170-Q211 VanDerWaalsContact CD2-NE2 3.28Å; S209-Q211 VanDerWaalsContact C-N 3.28Å; S209-Q211 PolarHBondContact OG-N 3.09Å
212	E	75.6	Confident	74.8	Confident	76 Å²	76	58.2 Å²	58.2	36%	0.355	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-74.6	127.6	175.1	-61.8	-179.1	131.6	0	0	109.5	V214 K219 R221	E212-V214 PolarHBondContact O-N 2.86Å; E212-K219 WeakPolarHBondContact OE1-CE 3.45Å; E212-K219 IonicContact OE1-NZ 3.48Å; E212-K219 WeakPolarHBondContact OE2-CE 3.45Å; E212-K219 IonicContact OE2-NZ 3.87Å; E212-K219 PolarHBondContact OE2-NZ 3.14Å; E212-R221 HydrophobicContact CG-CG 4.29Å; E212-R221 IonicContact OE1-CZ 3.12Å; E212-R221 IonicContact OE1-NE 2.75Å; E212-R221 PolarHBondContact OE1-NE 3.14Å; E212-R221 IonicContact OE1-NH2 2.69Å; E212-R221 PolarHBondContact OE1-NH2 3.04Å
213	Y	68.4	Low	75	Confident	12 Å²	12	57 Å²	57	5%	0.047	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	121.9	174.6	179.9	-122.7	0	0	0	110	A159 A162 Q215 K219 Y220	A159-Y213 HydrophobicContact CB-CD1 4.33Å; A159-Y213 HydrophobicContact CB-CD2 3.32Å; A159-Y213 HydrophobicContact CB-CE1 4.41Å; A159-Y213 HydrophobicContact CB-CE2 3.44Å; A159-Y213 VanDerWaalsContact CB-CE2 3.44Å; A159-Y213 HydrophobicContact CB-CG 3.76Å; A162-Y213 HydrophobicContact CB-CE2 4.23Å; A162-Y213 WeakPolarHBondContact CB-OH 3.33Å; Y213-Q215 HydrophobicContact CE1-CB 3.91Å; Y213-Q215 HydrophobicContact CE1-CG 3.61Å; Y213-Q215 HydrophobicContact CE2-CG 4.26Å; Y213-Q215 VanDerWaalsContact CZ-CD 3.48Å; Y213-Q215 VanDerWaalsContact CZ-CG 3.42Å; Y213-Q215 WeakPolarHBondContact OH-CG 3.33Å; Y213-Q215 PolarHBondContact OH-NE2 3.35Å; Y213-K219 CarbonylContact O-C 3.55Å; Y213-K219 WeakPolarHBondContact O-CA 3.38Å; Y213-Y220 PolarHBondContact N-O 3.2Å; Y213-Y220 PolarHBondContact O-N 3.09Å
214	V	61.1	Low	75.4	Confident	89 Å²	89	57.9 Å²	57.9	54%	0.539	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	88.5	178.4	-174.9	0	0	0	0	108.3	E212	E212-V214 PolarHBondContact O-N 2.86Å
215	Q	62.7	Low	75.9	Confident	90 Å²	90	58.5 Å²	58.5	42%	0.421	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	147.7	156.7	-103.7	175.3	-8.4	0	0	108	Y213 I217 F218	Y213-Q215 HydrophobicContact CE1-CB 3.91Å; Y213-Q215 HydrophobicContact CE1-CG 3.61Å; Y213-Q215 HydrophobicContact CE2-CG 4.26Å; Y213-Q215 VanDerWaalsContact CZ-CD 3.48Å; Y213-Q215 VanDerWaalsContact CZ-CG 3.42Å; Y213-Q215 WeakPolarHBondContact OH-CG 3.33Å; Y213-Q215 PolarHBondContact OH-NE2 3.35Å; Q215-I217 PolarHBondContact O-N 3.48Å; Q215-F218 PolarHBondContact N-O 3.33Å; Q215-F218 PolarHBondContact O-N 2.97Å
216	V	60.5	Low	76.5	Confident	154 Å²	154	58.5 Å²	58.5	93%	0.933	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.4	-25.4	-175.7	-179.9	0	0	0	0	114.4
217	I	62.5	Low	77.3	Confident	137 Å²	137	59.5 Å²	59.5	70%	0.703	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-27.4	-175.8	-48.6	176.5	0	0	0	113.2	Q215	Q215-I217 PolarHBondContact O-N 3.48Å
218	F	68.7	Low	77.8	Confident	154 Å²	154	61.1 Å²	61.1	68%	0.675	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.3	127.3	-172.1	-64	-73.2	0	0	0	112.9	Q215	Q215-F218 PolarHBondContact N-O 3.33Å; Q215-F218 PolarHBondContact O-N 2.97Å
219	K	77.1	Confident	78.3	Confident	118 Å²	118	61.6 Å²	61.6	51%	0.513	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	109.3	171	-179.2	170.9	178.1	158.5	0	109.9	E212 Y213	E212-K219 WeakPolarHBondContact OE1-CE 3.45Å; E212-K219 IonicContact OE1-NZ 3.48Å; E212-K219 WeakPolarHBondContact OE2-CE 3.45Å; E212-K219 IonicContact OE2-NZ 3.87Å; E212-K219 PolarHBondContact OE2-NZ 3.14Å; Y213-K219 CarbonylContact O-C 3.55Å; Y213-K219 WeakPolarHBondContact O-CA 3.38Å
220	Y	82.6	Confident	78.9	Confident	64 Å²	64	61.2 Å²	61.2	25%	0.251	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	114.7	179.7	-164.1	-96.7	0	0	0	111.3	F151 P155 Y213 L222 A225	F151-Y220 PolarHBondContact O-OH 2.92Å; P155-Y220 HydrophobicContact CB-CD1 4.1Å; P155-Y220 HydrophobicContact CB-CE1 3.89Å; P155-Y220 HydrophobicContact CG-CE1 4.16Å; Y213-Y220 PolarHBondContact N-O 3.2Å; Y213-Y220 PolarHBondContact O-N 3.09Å; Y220-L222 HydrophobicContact CE1-CD1 4.14Å; Y220-L222 PolarHBondContact O-N 3.44Å; Y220-A225 HydrophobicContact CE1-CB 3.69Å; Y220-A225 WeakPolarHBondContact OH-CB 3.46Å
221	R	85.7	Confident	79.4	Confident	86 Å²	86	63 Å²	63	33%	0.325	31%	0.312	S	S	.	.			trans	-87.6	89.9	177.9	-70.2	-177.2	162.5	158.5	4.5	110.3	E212 L224 A225	E212-R221 HydrophobicContact CG-CG 4.29Å; E212-R221 IonicContact OE1-CZ 3.12Å; E212-R221 IonicContact OE1-NE 2.75Å; E212-R221 PolarHBondContact OE1-NE 3.14Å; E212-R221 IonicContact OE1-NH2 2.69Å; E212-R221 PolarHBondContact OE1-NH2 3.04Å; R221-L224 HydrophobicContact CB-CB 4.13Å; R221-L224 PolarHBondContact O-N 3.36Å; R221-A225 PolarHBondContact O-N 3.21Å; R221-A225 VanDerWaalsContact O-N 3.08Å
222	L	85	Confident	80.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-54	-46.1	-178.2	-171.7	74.9	0	0	0	113.8	E156 Y208 S209 Y220 L224 A225 Y226	E156-L222 HydrophobicContact CG-CD1 3.34Å; E156-L222 HydrophobicContact CG-CD2 3.59Å; E156-L222 HydrophobicContact CG-CG 4.03Å; E156-L222 WeakPolarHBondContact OE1-CD2 3.37Å; Y208-L222 HydrophobicContact CD1-CD2 4.16Å; S209-L222 VanDerWaalsContact O-CD2 3.25Å; S209-L222 WeakPolarHBondContact O-CD2 3.19Å; Y220-L222 HydrophobicContact CE1-CD1 4.14Å; Y220-L222 PolarHBondContact O-N 3.44Å; L222-L224 VanDerWaalsContact C-N 3.3Å; L222-L224 PolarHBondContact O-N 3.02Å; L222-A225 PolarHBondContact O-N 3.09Å; L222-A225 VanDerWaalsContact O-N 3.16Å; L222-Y226 WeakPolarHBondContact O-CB 3.31Å; L222-Y226 PolarHBondContact O-N 3.09Å
223	P	86.4	Confident	81	Confident	15 Å²	15	61 Å²	61	10%	0.097	31%	0.305	C	S	.	.	H	α-helix	trans	-62.7	-38.3	-175.8	-24.6	36.8	0	0	0	112.8	F227 P835 F836 I845	P223-F227 PolarHBondContact O-N 3.41Å; P223-P835 HydrophobicContact CB-CB 4.23Å; P223-P835 VanDerWaalsContact CB-O 3.27Å; P223-P835 WeakPolarHBondContact CB-O 3.25Å; P223-P835 HydrophobicContact CG-CB 4.27Å; P223-P835 WeakPolarHBondContact CG-O 3.34Å; P223-F836 HydrophobicContact CB-CD1 4.01Å; P223-F836 HydrophobicContact CB-CE1 4.03Å; P223-F836 VanDerWaalsContact O-CE1 3.24Å; P223-F836 WeakPolarHBondContact O-CE1 3.46Å; P223-I845 HydrophobicContact CB-CD1 4.01Å
224	L	86.5	Confident	82	Confident	32 Å²	32	62.2 Å²	62.2	17%	0.168	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-46.8	175.5	178.6	66.8	0	0	0	111.2	R221 L222 Y226 F227 L228 I845 M846 Q849	R221-L224 HydrophobicContact CB-CB 4.13Å; R221-L224 PolarHBondContact O-N 3.36Å; L222-L224 VanDerWaalsContact C-N 3.3Å; L222-L224 PolarHBondContact O-N 3.02Å; L224-Y226 VanDerWaalsContact C-N 3.32Å; L224-Y226 PolarHBondContact O-N 3.1Å; L224-F227 PolarHBondContact O-N 3.16Å; L224-L228 HydrophobicContact CD1-CD1 4.04Å; L224-L228 HydrophobicContact CD1-CG 4.32Å; L224-L228 HydrophobicContact CG-CD1 3.98Å; L224-L228 WeakPolarHBondContact O-CB 2.91Å; L224-L228 PolarHBondContact O-N 3.27Å; L224-I845 HydrophobicContact CB-CG2 4.27Å; L224-I845 HydrophobicContact CD1-CG2 4.41Å; L224-M846 HydrophobicContact CD1-CE 4.2Å; L224-Q849 HydrophobicContact CD1-CB 4.23Å; L224-Q849 HydrophobicContact CD1-CG 3.95Å; L224-Q849 HydrophobicContact CD2-CG 4.1Å; L224-Q849 HydrophobicContact CG-CG 4.44Å
225	A	89.6	Confident	83.4	Confident	12 Å²	12	59.3 Å²	59.3	10%	0.099	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-45	178.3	0	0	0	0	0	111.3	Y220 R221 L222 F227 L228 V229	Y220-A225 HydrophobicContact CE1-CB 3.69Å; Y220-A225 WeakPolarHBondContact OH-CB 3.46Å; R221-A225 PolarHBondContact O-N 3.21Å; R221-A225 VanDerWaalsContact O-N 3.08Å; L222-A225 PolarHBondContact O-N 3.09Å; L222-A225 VanDerWaalsContact O-N 3.16Å; A225-F227 VanDerWaalsContact C-N 3.34Å; A225-F227 PolarHBondContact O-N 3.12Å; A225-L228 PolarHBondContact O-N 3.01Å; A225-V229 VanDerWaalsContact O-CB 3.29Å; A225-V229 WeakPolarHBondContact O-CB 3.46Å; A225-V229 WeakPolarHBondContact O-CG2 3.03Å; A225-V229 PolarHBondContact O-N 3.03Å
226	Y	90.2	Very high	84.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-55.6	-47.8	177.4	-169	-82.2	0	0	0	111.8	I152 Y205 Y208 L222 L224 N230 F742 F743 P745 P835 F836	I152-Y226 HydrophobicContact CD1-CD2 4.12Å; I152-Y226 HydrophobicContact CD1-CE2 4.45Å; I152-Y226 HydrophobicContact CG2-CD2 3.73Å; I152-Y226 HydrophobicContact CG2-CE2 4.09Å; Y205-Y226 HydrophobicContact CD2-CE1 4.47Å; Y205-Y226 HydrophobicContact CE2-CE1 4.33Å; Y208-Y226 HydrophobicContact CD2-CE2 4.3Å; Y208-Y226 HydrophobicContact CE2-CE2 4.48Å; L222-Y226 WeakPolarHBondContact O-CB 3.31Å; L222-Y226 PolarHBondContact O-N 3.09Å; L224-Y226 VanDerWaalsContact C-N 3.32Å; L224-Y226 PolarHBondContact O-N 3.1Å; Y226-N230 WeakPolarHBondContact CE1-ND2 3.25Å; Y226-N230 PolarHBondContact O-N 3.38Å; Y226-N230 PolarHBondContact O-ND2 3.46Å; Y226-F742 HydrophobicContact CE1-CE2 4.48Å; Y226-F742 WeakPolarHBondContact CE1-O 3.25Å; Y226-F742 VanDerWaalsContact CZ-O 3.28Å; Y226-F742 PolarHBondContact OH-O 3.32Å; Y226-F743 PolarHBondContact OH-O 3.14Å; Y226-P745 HydrophobicContact CE2-CB 4.27Å; Y226-P745 HydrophobicContact CE2-CG 4.09Å; Y226-P835 HydrophobicContact CD1-CG 4.31Å; Y226-P835 HydrophobicContact CD2-CG 4.28Å; Y226-P835 HydrophobicContact CG-CG 4.15Å; Y226-F836 AromaticContact CD1-CE2 3.69Å; Y226-F836 HydrophobicContact CD1-CE2 3.69Å; Y226-F836 AromaticContact CD1-CZ 3.72Å; Y226-F836 HydrophobicContact CD1-CZ 3.72Å; Y226-F836 HydrophobicContact CE1-CE2 4.06Å; Y226-F836 HydrophobicContact CG-CZ 4.46Å
227	F	89.4	Confident	86.3	Confident	31 Å²	31	51.5 Å²	51.5	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-47.8	178.4	-172.6	-92.2	0	0	0	112.5	P223 L224 A225 N230 L231 F742 I824 F836 M846	P223-F227 PolarHBondContact O-N 3.41Å; L224-F227 PolarHBondContact O-N 3.16Å; A225-F227 VanDerWaalsContact C-N 3.34Å; A225-F227 PolarHBondContact O-N 3.12Å; F227-N230 PolarHBondContact O-N 2.98Å; F227-L231 PolarHBondContact O-N 2.92Å; F227-L231 VanDerWaalsContact O-N 3.15Å; F227-F742 HydrophobicContact CD2-CE2 4.41Å; F227-I824 HydrophobicContact CE2-CG2 3.94Å; F227-F836 HydrophobicContact CB-CE1 4.37Å; F227-F836 HydrophobicContact CB-CZ 4.01Å; F227-F836 HydrophobicContact CD2-CZ 4.39Å; F227-M846 HydrophobicContact CD1-CE 3.5Å; F227-M846 HydrophobicContact CE1-CB 4.32Å; F227-M846 HydrophobicContact CE1-CE 3.72Å
228	L	89.5	Confident	87.7	Confident	66 Å²	66	47.8 Å²	47.8	35%	0.346	23%	0.229	S	C	.	.	H	α-helix	trans	-66	-42.8	-177.4	-80.2	175.7	0	0	0	112.8	L224 A225 N230 L231 I232 M846	L224-L228 HydrophobicContact CD1-CD1 4.04Å; L224-L228 HydrophobicContact CD1-CG 4.32Å; L224-L228 HydrophobicContact CG-CD1 3.98Å; L224-L228 WeakPolarHBondContact O-CB 2.91Å; L224-L228 PolarHBondContact O-N 3.27Å; A225-L228 PolarHBondContact O-N 3.01Å; L228-N230 VanDerWaalsContact C-N 3.34Å; L228-N230 PolarHBondContact O-N 3.37Å; L228-L231 PolarHBondContact O-N 3.03Å; L228-I232 WeakPolarHBondContact O-CB 3.22Å; L228-I232 VanDerWaalsContact O-CG1 3.27Å; L228-I232 WeakPolarHBondContact O-CG1 3.3Å; L228-I232 PolarHBondContact O-N 2.63Å; L228-M846 HydrophobicContact CD2-CE 3.39Å; L228-M846 HydrophobicContact CG-CE 3.81Å
229	V	92.5	Very high	88.8	Confident	10 Å²	10	47.1 Å²	47.1	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-43.6	-179.9	173.3	0	0	0	0	110.2	I147 M148 F151 I152 A225 L231 I232 V233	I147-V229 HydrophobicContact CG2-CG1 3.78Å; M148-V229 HydrophobicContact SD-CG1 3.65Å; F151-V229 HydrophobicContact CB-CG1 4.37Å; F151-V229 HydrophobicContact CB-CG2 3.56Å; F151-V229 HydrophobicContact CG-CG2 4.18Å; I152-V229 HydrophobicContact CD1-CB 3.99Å; I152-V229 HydrophobicContact CD1-CG1 3.8Å; I152-V229 HydrophobicContact CG1-CB 4.2Å; I152-V229 HydrophobicContact CG1-CG1 4.13Å; I152-V229 HydrophobicContact CG1-CG2 4.38Å; A225-V229 VanDerWaalsContact O-CB 3.29Å; A225-V229 WeakPolarHBondContact O-CB 3.46Å; A225-V229 WeakPolarHBondContact O-CG2 3.03Å; A225-V229 PolarHBondContact O-N 3.03Å; V229-L231 VanDerWaalsContact C-N 3.34Å; V229-L231 PolarHBondContact O-N 3.45Å; V229-I232 PolarHBondContact O-N 3.35Å; V229-V233 HydrophobicContact CG1-CG2 4.27Å; V229-V233 WeakPolarHBondContact O-CB 3.2Å; V229-V233 VanDerWaalsContact O-CG2 3.27Å; V229-V233 WeakPolarHBondContact O-CG2 3.48Å; V229-V233 PolarHBondContact O-N 3.35Å
230	N	90.1	Very high	89.4	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-59.1	-43.4	174.7	-86.3	-71.9	0	0	0	112.3	Y226 F227 L228 V233 L234 M741 F742	Y226-N230 WeakPolarHBondContact CE1-ND2 3.25Å; Y226-N230 PolarHBondContact O-N 3.38Å; Y226-N230 PolarHBondContact O-ND2 3.46Å; F227-N230 PolarHBondContact O-N 2.98Å; L228-N230 VanDerWaalsContact C-N 3.34Å; L228-N230 PolarHBondContact O-N 3.37Å; N230-V233 PolarHBondContact O-N 3.05Å; N230-L234 WeakPolarHBondContact O-CG 3.47Å; N230-L234 PolarHBondContact O-N 3.17Å; N230-M741 PolarHBondContact OD1-O 3.2Å; N230-F742 HydrophobicContact CB-CD2 4.12Å; N230-F742 WeakPolarHBondContact OD1-CA 3.35Å
231	L	88.8	Confident	89.7	Confident	105 Å²	105	39.4 Å²	39.4	55%	0.55	20%	0.198	S	C	.	.	H	α-helix	trans	-63.3	-43.8	175.9	-175.8	65.9	0	0	0	112.2	F227 L228 V229 L234 G235	F227-L231 PolarHBondContact O-N 2.92Å; F227-L231 VanDerWaalsContact O-N 3.15Å; L228-L231 PolarHBondContact O-N 3.03Å; V229-L231 VanDerWaalsContact C-N 3.34Å; V229-L231 PolarHBondContact O-N 3.45Å; L231-L234 PolarHBondContact O-N 3.42Å; L231-G235 PolarHBondContact O-N 3.4Å
232	I	92.1	Very high	89.8	Confident	103 Å²	103	38.1 Å²	38.1	53%	0.528	20%	0.197	S	C	.	.	H	α-helix	trans	-63.8	-41.7	177.7	-70.7	166.6	0	0	0	110.8	L228 V229 G235 Y236	L228-I232 WeakPolarHBondContact O-CB 3.22Å; L228-I232 VanDerWaalsContact O-CG1 3.27Å; L228-I232 WeakPolarHBondContact O-CG1 3.3Å; L228-I232 PolarHBondContact O-N 2.63Å; V229-I232 PolarHBondContact O-N 3.35Å; I232-G235 PolarHBondContact O-N 2.8Å; I232-Y236 VanDerWaalsContact O-CB 3.28Å; I232-Y236 WeakPolarHBondContact O-CB 3.49Å; I232-Y236 PolarHBondContact O-N 3.03Å
233	V	92.4	Very high	89.9	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-65.7	-45.7	179	166.7	0	0	0	0	111.4	I144 I147 M148 V229 N230 G235 Y236 S237 M741	I144-V233 HydrophobicContact CB-CG1 4.18Å; I144-V233 HydrophobicContact CD1-CG1 3.93Å; I144-V233 HydrophobicContact CG1-CG1 3.81Å; I144-V233 HydrophobicContact CG2-CG1 3.46Å; I144-V233 VanDerWaalsContact CG2-CG1 3.46Å; I144-V233 HydrophobicContact CG2-CG2 4.46Å; I147-V233 HydrophobicContact CB-CG2 4.35Å; I147-V233 HydrophobicContact CG2-CG2 3.81Å; M148-V233 HydrophobicContact SD-CG2 3.99Å; V229-V233 HydrophobicContact CG1-CG2 4.27Å; V229-V233 WeakPolarHBondContact O-CB 3.2Å; V229-V233 VanDerWaalsContact O-CG2 3.27Å; V229-V233 WeakPolarHBondContact O-CG2 3.48Å; V229-V233 PolarHBondContact O-N 3.35Å; N230-V233 PolarHBondContact O-N 3.05Å; V233-G235 VanDerWaalsContact C-N 3.34Å; V233-G235 PolarHBondContact O-N 3.43Å; V233-Y236 PolarHBondContact O-N 2.61Å; V233-S237 PolarHBondContact O-N 3.11Å; V233-M741 HydrophobicContact CB-CE 3.85Å; V233-M741 HydrophobicContact CG1-CE 3.26Å; V233-M741 HydrophobicContact CG1-SD 4.14Å
234	L	88.4	Confident	89.7	Confident	37 Å²	37	49 Å²	49	19%	0.194	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-45.8	174.3	-72.7	173.5	0	0	0	110.7	N230 L231 S237 F238 M741 V817	N230-L234 WeakPolarHBondContact O-CG 3.47Å; N230-L234 PolarHBondContact O-N 3.17Å; L231-L234 PolarHBondContact O-N 3.42Å; L234-S237 PolarHBondContact O-N 2.9Å; L234-S237 PolarHBondContact O-OG 3.3Å; L234-F238 PolarHBondContact O-N 3.49Å; L234-F238 VanDerWaalsContact O-N 3.14Å; L234-M741 HydrophobicContact CD2-SD 3.88Å; L234-M741 HydrophobicContact CG-SD 4.41Å; L234-V817 HydrophobicContact CD2-CG2 4.49Å
235	G	90.3	Very high	89.5	Confident	27 Å²	27	49.2 Å²	49.2	28%	0.278	24%	0.238	S	C	.	.	H	α-helix	trans	-60.1	-45	174	0	0	0	0	0	113.3	L231 I232 V233 S237 F238 F239	L231-G235 PolarHBondContact O-N 3.4Å; I232-G235 PolarHBondContact O-N 2.8Å; V233-G235 VanDerWaalsContact C-N 3.34Å; V233-G235 PolarHBondContact O-N 3.43Å; G235-S237 PolarHBondContact O-N 2.82Å; G235-F238 WeakPolarHBondContact O-CB 3.33Å; G235-F238 PolarHBondContact O-N 3.29Å; G235-F239 WeakPolarHBondContact O-CD2 3.35Å; G235-F239 PolarHBondContact O-N 3.28Å
236	Y	93	Very high	89	Confident	81 Å²	81	50.6 Å²	50.6	32%	0.318	25%	0.249	S	C	.	.	H	α-helix	trans	-58.8	-46.5	177.2	171.8	-97.8	0	0	0	111.3	I143 I144 I232 V233 F238 F239 A240	I143-Y236 HydrophobicContact CB-CE1 4.27Å; I143-Y236 WeakPolarHBondContact CD1-OH 3.45Å; I143-Y236 HydrophobicContact CG2-CE1 3.83Å; I143-Y236 HydrophobicContact CG2-CE2 4.47Å; I144-Y236 HydrophobicContact CG1-CD1 4.46Å; I232-Y236 VanDerWaalsContact O-CB 3.28Å; I232-Y236 WeakPolarHBondContact O-CB 3.49Å; I232-Y236 PolarHBondContact O-N 3.03Å; V233-Y236 PolarHBondContact O-N 2.61Å; Y236-F238 VanDerWaalsContact C-N 3.34Å; Y236-F238 PolarHBondContact O-N 3.17Å; Y236-F239 PolarHBondContact O-N 3.46Å; Y236-A240 HydrophobicContact CE1-CB 4.45Å; Y236-A240 VanDerWaalsContact O-CB 3.27Å; Y236-A240 WeakPolarHBondContact O-CB 3.36Å; Y236-A240 PolarHBondContact O-N 3.12Å
237	S	91.4	Very high	88.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-44.7	178.6	75.6	0	0	0	0	111.6	V233 L234 G235 A240 I241	V233-S237 PolarHBondContact O-N 3.11Å; L234-S237 PolarHBondContact O-N 2.9Å; L234-S237 PolarHBondContact O-OG 3.3Å; G235-S237 PolarHBondContact O-N 2.82Å; S237-A240 PolarHBondContact O-N 3.4Å; S237-I241 VanDerWaalsContact O-CD1 3.3Å; S237-I241 WeakPolarHBondContact O-CD1 3.29Å; S237-I241 WeakPolarHBondContact O-CG1 3.29Å; S237-I241 PolarHBondContact O-N 3.33Å
238	F	91.1	Very high	87.1	Confident	59 Å²	59	52.9 Å²	52.9	26%	0.259	27%	0.267	S	S	.	.	H	α-helix	trans	-59.5	-50.6	175.9	176.5	-114.4	0	0	0	112	L234 G235 Y236 A240 I241 L242 L810 M813 F814	L234-F238 PolarHBondContact O-N 3.49Å; L234-F238 VanDerWaalsContact O-N 3.14Å; G235-F238 WeakPolarHBondContact O-CB 3.33Å; G235-F238 PolarHBondContact O-N 3.29Å; Y236-F238 VanDerWaalsContact C-N 3.34Å; Y236-F238 PolarHBondContact O-N 3.17Å; F238-A240 PolarHBondContact O-N 2.93Å; F238-I241 PolarHBondContact O-N 2.89Å; F238-L242 HydrophobicContact CD1-CD1 3.86Å; F238-L242 HydrophobicContact CD2-CD1 4.26Å; F238-L242 HydrophobicContact CD2-CG 4.35Å; F238-L242 HydrophobicContact CE1-CD1 3.34Å; F238-L242 HydrophobicContact CE1-CG 4.38Å; F238-L242 HydrophobicContact CE2-CD1 3.81Å; F238-L242 HydrophobicContact CE2-CG 4.09Å; F238-L242 HydrophobicContact CG-CD1 4.33Å; F238-L242 HydrophobicContact CZ-CD1 3.34Å; F238-L242 HydrophobicContact CZ-CG 4.13Å; F238-L242 WeakPolarHBondContact O-CB 3.4Å; F238-L242 WeakPolarHBondContact O-CG 3.35Å; F238-L242 PolarHBondContact O-N 3.49Å; F238-L810 HydrophobicContact CE2-CD1 4.33Å; F238-M813 HydrophobicContact CB-CE 3.89Å; F238-M813 HydrophobicContact CB-SD 3.69Å; F238-M813 HydrophobicContact CD2-CE 3.36Å; F238-M813 HydrophobicContact CD2-SD 3.99Å; F238-M813 HydrophobicContact CE2-CE 4.18Å; F238-M813 HydrophobicContact CG-CE 3.98Å; F238-M813 HydrophobicContact CG-SD 4.33Å; F238-F814 HydrophobicContact CD2-CZ 4.46Å; F238-F814 HydrophobicContact CE2-CE1 4.46Å; F238-F814 HydrophobicContact CE2-CE2 4.28Å; F238-F814 AromaticContact CE2-CZ 3.7Å; F238-F814 HydrophobicContact CE2-CZ 3.7Å; F238-F814 HydrophobicContact CZ-CZ 4.32Å
239	F	91.7	Very high	86	Confident	140 Å²	140	51 Å²	51	61%	0.614	26%	0.262	S	S	*	.	H	α-helix	trans	-65.4	-37.5	179.3	-79.4	-64.9	0	0	0	112.7	G235 Y236 L242 R243	G235-F239 WeakPolarHBondContact O-CD2 3.35Å; G235-F239 PolarHBondContact O-N 3.28Å; Y236-F239 PolarHBondContact O-N 3.46Å; F239-L242 PolarHBondContact O-N 3.39Å; F239-R243 VanDerWaalsContact O-CB 3.23Å; F239-R243 WeakPolarHBondContact O-CB 3.45Å; F239-R243 PolarHBondContact O-N 2.83Å
240	A	90.5	Very high	84.8	Confident	19 Å²	19	59.1 Å²	59.1	16%	0.157	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-44.9	176.2	0	0	0	0	0	111.2	I140 Y236 S237 F238 K244	I140-A240 HydrophobicContact CD1-CB 4.05Å; I140-A240 HydrophobicContact CG1-CB 4.47Å; Y236-A240 HydrophobicContact CE1-CB 4.45Å; Y236-A240 VanDerWaalsContact O-CB 3.27Å; Y236-A240 WeakPolarHBondContact O-CB 3.36Å; Y236-A240 PolarHBondContact O-N 3.12Å; S237-A240 PolarHBondContact O-N 3.4Å; F238-A240 PolarHBondContact O-N 2.93Å; A240-K244 VanDerWaalsContact O-CB 3.31Å; A240-K244 WeakPolarHBondContact O-CB 3.43Å; A240-K244 PolarHBondContact O-N 2.94Å
241	I	89.4	Confident	83.2	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-48.6	176.2	-63.2	159.6	0	0	0	110.6	W136 S237 F238 K244 M245 W738 L809 L810 M813	W136-I241 HydrophobicContact CH2-CB 4.38Å; W136-I241 HydrophobicContact CH2-CG1 3.83Å; S237-I241 VanDerWaalsContact O-CD1 3.3Å; S237-I241 WeakPolarHBondContact O-CD1 3.29Å; S237-I241 WeakPolarHBondContact O-CG1 3.29Å; S237-I241 PolarHBondContact O-N 3.33Å; F238-I241 PolarHBondContact O-N 2.89Å; I241-K244 PolarHBondContact O-N 3.42Å; I241-M245 WeakPolarHBondContact O-CB 3.15Å; I241-M245 PolarHBondContact O-N 2.86Å; I241-W738 HydrophobicContact CD1-CH2 3.61Å; I241-W738 HydrophobicContact CD1-CZ2 3.99Å; I241-L809 HydrophobicContact CD1-CD2 3.96Å; I241-L809 HydrophobicContact CD1-CG 4Å; I241-L809 HydrophobicContact CG1-CD2 3.84Å; I241-L809 HydrophobicContact CG1-CG 4.38Å; I241-L810 HydrophobicContact CG2-CB 4.02Å; I241-L810 HydrophobicContact CG2-CD1 4.46Å; I241-M813 HydrophobicContact CD1-SD 4.25Å
242	L	87.1	Confident	81.6	Confident	58 Å²	58	59.9 Å²	59.9	30%	0.304	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-48.4	178.5	-79.2	-178.3	0	0	0	112.5	F238 F239 K244 M245 A246 L810	F238-L242 HydrophobicContact CD1-CD1 3.86Å; F238-L242 HydrophobicContact CD2-CD1 4.26Å; F238-L242 HydrophobicContact CD2-CG 4.35Å; F238-L242 HydrophobicContact CE1-CD1 3.34Å; F238-L242 HydrophobicContact CE1-CG 4.38Å; F238-L242 HydrophobicContact CE2-CD1 3.81Å; F238-L242 HydrophobicContact CE2-CG 4.09Å; F238-L242 HydrophobicContact CG-CD1 4.33Å; F238-L242 HydrophobicContact CZ-CD1 3.34Å; F238-L242 HydrophobicContact CZ-CG 4.13Å; F238-L242 WeakPolarHBondContact O-CB 3.4Å; F238-L242 WeakPolarHBondContact O-CG 3.35Å; F238-L242 PolarHBondContact O-N 3.49Å; F239-L242 PolarHBondContact O-N 3.39Å; L242-K244 VanDerWaalsContact C-N 3.26Å; L242-K244 PolarHBondContact O-N 2.84Å; L242-M245 PolarHBondContact O-N 3.39Å; L242-A246 VanDerWaalsContact O-CB 3.27Å; L242-A246 WeakPolarHBondContact O-CB 3.48Å; L242-A246 PolarHBondContact O-N 2.82Å; L242-L810 HydrophobicContact CD2-CD1 3.61Å; L242-L810 HydrophobicContact CG-CD1 4.27Å
243	R	86.9	Confident	79.7	Confident	206 Å²	206	62.6 Å²	62.6	78%	0.777	31%	0.31	S	S	*	.	H	α-helix	trans	-59.1	-41.7	178.9	-176.6	178.5	-179.6	-176.1	1.3	110.7	F239 S247	F239-R243 VanDerWaalsContact O-CB 3.23Å; F239-R243 WeakPolarHBondContact O-CB 3.45Å; F239-R243 PolarHBondContact O-N 2.83Å; R243-S247 WeakPolarHBondContact O-CB 3.29Å; R243-S247 PolarHBondContact O-N 3.03Å
244	K	83.2	Confident	77.6	Confident	37 Å²	37	69.6 Å²	69.6	16%	0.161	35%	0.347	C	S	.	.	H	α-helix	trans	-70	-41.6	179.8	-165.9	69.9	174.2	-177.5	0	112	W136 A240 I241 L242 N248 Y806	W136-K244 HydrophobicContact CH2-CB 4.42Å; W136-K244 HydrophobicContact CZ2-CB 3.62Å; W136-K244 HydrophobicContact CZ2-CG 3.86Å; A240-K244 VanDerWaalsContact O-CB 3.31Å; A240-K244 WeakPolarHBondContact O-CB 3.43Å; A240-K244 PolarHBondContact O-N 2.94Å; I241-K244 PolarHBondContact O-N 3.42Å; L242-K244 VanDerWaalsContact C-N 3.26Å; L242-K244 PolarHBondContact O-N 2.84Å; K244-N248 WeakPolarHBondContact O-CB 3.29Å; K244-N248 VanDerWaalsContact O-CG 3.3Å; K244-N248 PolarHBondContact O-N 3.25Å; K244-N248 PolarHBondContact O-OD1 2.75Å; K244-Y806 HydrophobicContact CB-CE1 4.02Å; K244-Y806 VanDerWaalsContact CE-OH 3.24Å; K244-Y806 WeakPolarHBondContact CE-OH 3.18Å; K244-Y806 HydrophobicContact CG-CD1 4.33Å; K244-Y806 HydrophobicContact CG-CE1 3.41Å; K244-Y806 VanDerWaalsContact CG-CE1 3.41Å; K244-Y806 VanDerWaalsContact CG-CZ 3.49Å; K244-Y806 WeakPolarHBondContact CG-OH 3.48Å
245	M	82.2	Confident	75.6	Confident	37 Å²	37	69.6 Å²	69.6	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-62.1	-45	173	-172.7	-168.8	-60.7	0	0	111.6	I241 L242 N248 A249 N803 V807 L810	I241-M245 WeakPolarHBondContact O-CB 3.15Å; I241-M245 PolarHBondContact O-N 2.86Å; L242-M245 PolarHBondContact O-N 3.39Å; M245-N248 PolarHBondContact O-N 2.92Å; M245-A249 WeakPolarHBondContact O-CB 3.45Å; M245-A249 PolarHBondContact O-N 3.38Å; M245-N803 PolarHBondContact O-OD1 2.82Å; M245-V807 HydrophobicContact CE-CB 4.26Å; M245-V807 HydrophobicContact CE-CG2 3.64Å; M245-V807 HydrophobicContact SD-CG2 3.94Å; M245-L810 HydrophobicContact CE-CB 4.44Å; M245-L810 HydrophobicContact CE-CD1 3.99Å
246	A	78.3	Confident	73.5	Confident	41 Å²	41	70.8 Å²	70.8	34%	0.339	35%	0.354	S	S	.	.	H	α-helix	trans	-64	-43.7	179.3	0	0	0	0	0	111.9	L242 A249 R250	L242-A246 VanDerWaalsContact O-CB 3.27Å; L242-A246 WeakPolarHBondContact O-CB 3.48Å; L242-A246 PolarHBondContact O-N 2.82Å; A246-A249 PolarHBondContact O-N 3.45Å; A246-R250 VanDerWaalsContact O-CG 3.3Å; A246-R250 WeakPolarHBondContact O-CG 3.36Å; A246-R250 PolarHBondContact O-N 3.5Å
247	S	72.1	Confident	71.3	Confident	59 Å²	59	69.3 Å²	69.3	41%	0.413	36%	0.364	S	S	.	.	H	α-helix	trans	-59.6	-48.7	174.7	-176.7	0	0	0	0	111.1	R243 A249 R250 T251	R243-S247 WeakPolarHBondContact O-CB 3.29Å; R243-S247 PolarHBondContact O-N 3.03Å; S247-A249 VanDerWaalsContact C-N 3.32Å; S247-A249 PolarHBondContact O-N 2.95Å; S247-R250 PolarHBondContact O-N 3.49Å; S247-T251 PolarHBondContact O-N 3.15Å; S247-T251 PolarHBondContact O-OG1 3.26Å; S247-T251 VanDerWaalsContact O-OG1 3.12Å
248	N	68.3	Low	69.3	Low	20 Å²	20	77.4 Å²	77.4	11%	0.107	40%	0.399	C	S	.	.	H	α-helix	trans	-62.1	-37.6	177.1	-77.7	11	0	0	0	112.9	K244 M245 S252 N803 Y806	K244-N248 WeakPolarHBondContact O-CB 3.29Å; K244-N248 VanDerWaalsContact O-CG 3.3Å; K244-N248 PolarHBondContact O-N 3.25Å; K244-N248 PolarHBondContact O-OD1 2.75Å; M245-N248 PolarHBondContact O-N 2.92Å; N248-S252 WeakPolarHBondContact O-CB 3.46Å; N248-S252 PolarHBondContact O-N 2.84Å; N248-S252 VanDerWaalsContact O-N 3.16Å; N248-N803 WeakPolarHBondContact CB-OD1 3.29Å; N248-Y806 WeakPolarHBondContact ND2-CE2 3.27Å; N248-Y806 PolarHBondContact ND2-OH 3.46Å
249	A	67	Low	67.3	Low	28 Å²	28	75.6 Å²	75.6	23%	0.231	39%	0.392	C	S	.	.	H	α-helix	trans	-66.9	-42.3	174.5	0	0	0	0	0	112.1	M245 A246 S247 S252 K253	M245-A249 WeakPolarHBondContact O-CB 3.45Å; M245-A249 PolarHBondContact O-N 3.38Å; A246-A249 PolarHBondContact O-N 3.45Å; S247-A249 VanDerWaalsContact C-N 3.32Å; S247-A249 PolarHBondContact O-N 2.95Å; A249-S252 PolarHBondContact O-N 3.25Å; A249-S252 PolarHBondContact O-OG 3Å; A249-K253 WeakPolarHBondContact O-CG 3.46Å; A249-K253 PolarHBondContact O-N 3.33Å
250	R	66.4	Low	65.4	Low	180 Å²	180	74.8 Å²	74.8	68%	0.679	39%	0.39	S	S	*	.	H	α-helix	trans	-61.5	-47.9	177.3	-73.9	175.2	-170.4	-177.7	2.9	111.7	A246 S247 S252 K253 L254	A246-R250 VanDerWaalsContact O-CG 3.3Å; A246-R250 WeakPolarHBondContact O-CG 3.36Å; A246-R250 PolarHBondContact O-N 3.5Å; S247-R250 PolarHBondContact O-N 3.49Å; R250-S252 PolarHBondContact O-N 3.26Å; R250-K253 PolarHBondContact O-N 3Å; R250-K253 VanDerWaalsContact O-N 3.12Å; R250-L254 WeakPolarHBondContact O-CD1 3.44Å; R250-L254 PolarHBondContact O-N 2.98Å
251	T	56.7	Low	63.5	Low	80 Å²	80	79 Å²	79	49%	0.491	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-34.2	176.5	-49.3	0	0	0	0	111.7	S247	S247-T251 PolarHBondContact O-N 3.15Å; S247-T251 PolarHBondContact O-OG1 3.26Å; S247-T251 VanDerWaalsContact O-OG1 3.12Å
252	S	55	Low	62	Low	43 Å²	43	85.5 Å²	85.5	30%	0.301	43%	0.432	S	S	.	.	H	α-helix	trans	-70.8	-34	176.6	79.9	0	0	0	0	113.7	N248 A249 R250	N248-S252 WeakPolarHBondContact O-CB 3.46Å; N248-S252 PolarHBondContact O-N 2.84Å; N248-S252 VanDerWaalsContact O-N 3.16Å; A249-S252 PolarHBondContact O-N 3.25Å; A249-S252 PolarHBondContact O-OG 3Å; R250-S252 PolarHBondContact O-N 3.26Å
253	K	53.3	Low	60.5	Low	161 Å²	161	85.1 Å²	85.1	70%	0.7	43%	0.433	S	S	*	.	H	α-helix	trans	-79.3	-43	-178.9	-73.3	-177.4	-180	-178	0	112.5	A249 R250 S255 S256	A249-K253 WeakPolarHBondContact O-CG 3.46Å; A249-K253 PolarHBondContact O-N 3.33Å; R250-K253 PolarHBondContact O-N 3Å; R250-K253 VanDerWaalsContact O-N 3.12Å; K253-S255 PolarHBondContact O-N 2.98Å; K253-S256 PolarHBondContact O-N 3.05Å; K253-S256 VanDerWaalsContact O-N 3.16Å
254	L	48	Very low	59.1	Low	147 Å²	147	82 Å²	82	77%	0.77	43%	0.425	S	S	*	.	H	α-helix	trans	-60.2	-31.8	177.5	-98.2	81.2	0	0	0	112.4	R250	R250-L254 WeakPolarHBondContact O-CD1 3.44Å; R250-L254 PolarHBondContact O-N 2.98Å
255	S	45.6	Very low	58.1	Low	38 Å²	38	83.3 Å²	83.3	27%	0.266	44%	0.439	S	S	.	.	H	α-helix	trans	-75.5	-29.5	179.8	-169.4	0	0	0	0	112.9	K253 G257 T259	K253-S255 PolarHBondContact O-N 2.98Å; S255-G257 PolarHBondContact O-N 3Å; S255-T259 WeakPolarHBondContact O-CB 3.42Å; S255-T259 WeakPolarHBondContact O-CG2 3.44Å; S255-T259 PolarHBondContact O-N 2.99Å; S255-T259 VanDerWaalsContact O-N 3.11Å; S255-T259 PolarHBondContact O-OG1 2.91Å; S255-T259 WeakPolarHBondContact OG-CG2 3.33Å; S255-T259 PolarHBondContact OG-OG1 3.32Å
256	S	45.8	Very low	56.9	Low	52 Å²	52	85 Å²	85	36%	0.364	44%	0.443	S	S	.	.	H	α-helix	trans	-66.3	-32.7	-172.4	-143.2	0	0	0	0	113.6	K253 E260	K253-S256 PolarHBondContact O-N 3.05Å; K253-S256 VanDerWaalsContact O-N 3.16Å; S256-E260 WeakPolarHBondContact O-CB 3.07Å; S256-E260 VanDerWaalsContact O-CG 3.29Å; S256-E260 WeakPolarHBondContact O-CG 3.24Å
257	G	47.9	Very low	55.8	Low	50 Å²	50	86.1 Å²	86.1	52%	0.515	44%	0.44	S	S	.	.	H	α-helix	trans	-76.7	-38.6	-174.9	0	0	0	0	0	114.7	S255	S255-G257 PolarHBondContact O-N 3Å
258	K	49.1	Very low	55.4	Low	169 Å²	169	86.5 Å²	86.5	74%	0.735	44%	0.44	S	S	*	.	H	α-helix	trans	-101	-33.9	-174.5	-69.8	179.3	-179.7	172.9	0	113.5
259	T	49.3	Very low	54.9	Low	21 Å²	21	89.7 Å²	89.7	13%	0.129	46%	0.46	C	S	.	.	H	α-helix	trans	-82.2	-20.6	-176.1	71	0	0	0	0	113.4	S255 Q261 V263 N784	S255-T259 WeakPolarHBondContact O-CB 3.42Å; S255-T259 WeakPolarHBondContact O-CG2 3.44Å; S255-T259 PolarHBondContact O-N 2.99Å; S255-T259 VanDerWaalsContact O-N 3.11Å; S255-T259 PolarHBondContact O-OG1 2.91Å; S255-T259 WeakPolarHBondContact OG-CG2 3.33Å; S255-T259 PolarHBondContact OG-OG1 3.32Å; T259-Q261 VanDerWaalsContact C-N 3.26Å; T259-Q261 PolarHBondContact O-N 2.91Å; T259-V263 WeakPolarHBondContact O-CG2 3.49Å; T259-N784 HydrophobicContact CG2-CB 4.4Å
260	E	51	Low	54.3	Low	123 Å²	123	89.5 Å²	89.5	58%	0.575	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-73.3	-17.2	175.2	-68.3	-159.8	169.9	0	0	113.3	S256 V263	S256-E260 WeakPolarHBondContact O-CB 3.07Å; S256-E260 VanDerWaalsContact O-CG 3.29Å; S256-E260 WeakPolarHBondContact O-CG 3.24Å; E260-V263 WeakPolarHBondContact O-CG2 3.45Å
261	Q	51.5	Low	53.7	Low	109 Å²	109	82.2 Å²	82.2	51%	0.509	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-73.3	-29.7	178.6	-69.7	-178.7	-5	0	0	113.4	T259	T259-Q261 VanDerWaalsContact C-N 3.26Å; T259-Q261 PolarHBondContact O-N 2.91Å
262	Y	58.2	Low	53.8	Low	136 Å²	136	87.4 Å²	87.4	53%	0.533	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-125.2	35	-173.5	-57	-74	0	0	0	112.9	F264 S265 W266	Y262-F264 PolarHBondContact O-N 2.92Å; Y262-S265 PolarHBondContact O-N 2.85Å; Y262-W266 PolarHBondContact O-N 3.44Å
263	V	54.9	Low	53.8	Low	51 Å²	51	87.7 Å²	87.7	31%	0.309	45%	0.446	S	S	.	.	H	α-helix	trans	-57	-35.5	-176.4	175.9	0	0	0	0	112.1	T259 E260 K267	T259-V263 WeakPolarHBondContact O-CG2 3.49Å; E260-V263 WeakPolarHBondContact O-CG2 3.45Å; V263-K267 HydrophobicContact CG1-CD 3.84Å; V263-K267 HydrophobicContact CG1-CG 4.38Å; V263-K267 VanDerWaalsContact O-CB 3.28Å; V263-K267 WeakPolarHBondContact O-CB 3.04Å; V263-K267 WeakPolarHBondContact O-CD 3.4Å; V263-K267 WeakPolarHBondContact O-CG 3.27Å; V263-K267 PolarHBondContact O-N 3.3Å
264	F	58	Low	53.9	Low	140 Å²	140	89.6 Å²	89.6	61%	0.614	45%	0.45	S	S	*	.	H	α-helix	trans	-68.6	-54	177.8	-179.5	-98.2	0	0	0	111.8	Y262 W266 K267 V268 F293	Y262-F264 PolarHBondContact O-N 2.92Å; F264-W266 VanDerWaalsContact C-N 3.31Å; F264-W266 PolarHBondContact O-N 3.42Å; F264-K267 WeakPolarHBondContact O-CB 3.12Å; F264-K267 PolarHBondContact O-N 3.16Å; F264-V268 HydrophobicContact CD1-CG2 4.32Å; F264-V268 HydrophobicContact CE1-CG2 3.91Å; F264-V268 HydrophobicContact CE2-CG2 4.25Å; F264-V268 HydrophobicContact CZ-CG2 3.87Å; F264-V268 WeakPolarHBondContact O-CG2 3.43Å; F264-V268 PolarHBondContact O-N 2.97Å; F264-F293 HydrophobicContact CD2-CD1 4.37Å; F264-F293 AromaticContact CD2-CE1 3.84Å; F264-F293 HydrophobicContact CD2-CE1 3.84Å; F264-F293 AromaticContact CE2-CD1 3.97Å; F264-F293 HydrophobicContact CE2-CD1 3.97Å; F264-F293 AromaticContact CE2-CE1 3.62Å; F264-F293 HydrophobicContact CE2-CE1 3.62Å
265	S	61.9	Low	54.2	Low	65 Å²	65	86.9 Å²	86.9	46%	0.455	44%	0.44	S	S	.	.	H	α-helix	trans	-57.7	-45.1	-179.6	-49.7	0	0	0	0	111.5	Y262 V268 T269	Y262-S265 PolarHBondContact O-N 2.85Å; S265-V268 PolarHBondContact O-N 3.38Å; S265-T269 WeakPolarHBondContact O-CG2 3.42Å; S265-T269 PolarHBondContact O-N 3.22Å; S265-T269 PolarHBondContact O-OG1 2.91Å
266	W	55.7	Low	54.7	Low	73 Å²	73	87.1 Å²	87.1	28%	0.277	44%	0.438	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175.1	-73.4	117.3	0	0	0	112.3	Y262 F264 V268 T269 T270 N784 V787	Y262-W266 PolarHBondContact O-N 3.44Å; F264-W266 VanDerWaalsContact C-N 3.31Å; F264-W266 PolarHBondContact O-N 3.42Å; W266-V268 PolarHBondContact O-N 2.79Å; W266-T269 WeakPolarHBondContact CA-OG1 3.43Å; W266-T269 PolarHBondContact O-N 2.58Å; W266-T269 PolarHBondContact O-OG1 3.04Å; W266-T269 VanDerWaalsContact O-OG1 3.06Å; W266-T270 WeakPolarHBondContact O-CB 3.24Å; W266-T270 WeakPolarHBondContact O-CG2 3.47Å; W266-T270 PolarHBondContact O-N 2.98Å; W266-T270 VanDerWaalsContact O-N 3.07Å; W266-T270 PolarHBondContact O-OG1 3.34Å; W266-N784 WeakPolarHBondContact CB-OD1 3.33Å; W266-V787 HydrophobicContact CH2-CB 3.96Å; W266-V787 HydrophobicContact CH2-CG1 3.65Å; W266-V787 HydrophobicContact CZ3-CB 3.73Å; W266-V787 HydrophobicContact CZ3-CG1 3.72Å; W266-V787 HydrophobicContact CZ3-CG2 3.86Å
267	K	56.5	Low	55.5	Low	64 Å²	64	87.8 Å²	87.8	28%	0.278	45%	0.453	S	S	.	.	H	α-helix	trans	-61.5	-33.8	176.2	-79.7	169.9	179.7	172.1	0	112.9	V263 F264 T270 G271 F293	V263-K267 HydrophobicContact CG1-CD 3.84Å; V263-K267 HydrophobicContact CG1-CG 4.38Å; V263-K267 VanDerWaalsContact O-CB 3.28Å; V263-K267 WeakPolarHBondContact O-CB 3.04Å; V263-K267 WeakPolarHBondContact O-CD 3.4Å; V263-K267 WeakPolarHBondContact O-CG 3.27Å; V263-K267 PolarHBondContact O-N 3.3Å; F264-K267 WeakPolarHBondContact O-CB 3.12Å; F264-K267 PolarHBondContact O-N 3.16Å; K267-T270 WeakPolarHBondContact CA-OG1 3.39Å; K267-T270 PolarHBondContact O-OG1 2.92Å; K267-G271 PolarHBondContact O-N 2.96Å; K267-F293 HydrophobicContact CB-CE1 4.15Å; K267-F293 HydrophobicContact CB-CZ 3.79Å
268	V	62.7	Low	56.2	Low	67 Å²	67	87.5 Å²	87.5	41%	0.406	44%	0.439	S	S	.	.	H	α-helix	trans	-71.5	-49.9	177.9	174	0	0	0	0	110.5	F264 S265 W266 T270 G271 F293	F264-V268 HydrophobicContact CD1-CG2 4.32Å; F264-V268 HydrophobicContact CE1-CG2 3.91Å; F264-V268 HydrophobicContact CE2-CG2 4.25Å; F264-V268 HydrophobicContact CZ-CG2 3.87Å; F264-V268 WeakPolarHBondContact O-CG2 3.43Å; F264-V268 PolarHBondContact O-N 2.97Å; S265-V268 PolarHBondContact O-N 3.38Å; W266-V268 PolarHBondContact O-N 2.79Å; V268-T270 PolarHBondContact O-N 3.26Å; V268-T270 VanDerWaalsContact O-N 3.12Å; V268-G271 PolarHBondContact O-N 3.12Å; V268-F293 HydrophobicContact CG2-CE1 4.04Å; V268-F293 HydrophobicContact CG2-CZ 3.7Å
269	T	58.2	Low	57.2	Low	87 Å²	87	84.3 Å²	84.3	53%	0.534	44%	0.436	S	S	.	.	H	α-helix	trans	-63.7	-21	179.9	54.3	0	0	0	0	113	S265 W266	S265-T269 WeakPolarHBondContact O-CG2 3.42Å; S265-T269 PolarHBondContact O-N 3.22Å; S265-T269 PolarHBondContact O-OG1 2.91Å; W266-T269 WeakPolarHBondContact CA-OG1 3.43Å; W266-T269 PolarHBondContact O-N 2.58Å; W266-T269 PolarHBondContact O-OG1 3.04Å; W266-T269 VanDerWaalsContact O-OG1 3.06Å
270	T	54.6	Low	57.8	Low	23 Å²	23	89.9 Å²	89.9	14%	0.141	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	1.7	-173.9	65	0	0	0	0	114.3	W266 K267 V268 W272 V783	W266-T270 WeakPolarHBondContact O-CB 3.24Å; W266-T270 WeakPolarHBondContact O-CG2 3.47Å; W266-T270 PolarHBondContact O-N 2.98Å; W266-T270 VanDerWaalsContact O-N 3.07Å; W266-T270 PolarHBondContact O-OG1 3.34Å; K267-T270 WeakPolarHBondContact CA-OG1 3.39Å; K267-T270 PolarHBondContact O-OG1 2.92Å; V268-T270 PolarHBondContact O-N 3.26Å; V268-T270 VanDerWaalsContact O-N 3.12Å; T270-W272 PolarHBondContact O-N 2.85Å; T270-V783 HydrophobicContact CG2-CB 3.28Å; T270-V783 HydrophobicContact CG2-CG1 3.03Å; T270-V783 HydrophobicContact CG2-CG2 4.26Å
271	G	54.6	Low	58.1	Low	27 Å²	27	85.3 Å²	85.3	28%	0.278	44%	0.441	S	S	.	.	S	Bend	trans	-67.8	-10.6	167.5	0	0	0	0	0	113.2	K267 V268	K267-G271 PolarHBondContact O-N 2.96Å; V268-G271 PolarHBondContact O-N 3.12Å
272	W	58.8	Low	58.7	Low	190 Å²	190	81.4 Å²	81.4	72%	0.72	43%	0.428	S	S	*	.			trans	-107.4	80.9	-179.3	-60.3	51.8	0	0	0	107.8	T270	T270-W272 PolarHBondContact O-N 2.85Å
273	D	53.7	Low	59	Low	48 Å²	48	77.6 Å²	77.6	26%	0.257	42%	0.421	S	S	.	.			trans	-101.2	98.5	-176.7	-162.3	-13.7	0	0	0	111.1	T275 I276 F782	D273-T275 PolarHBondContact O-N 3.03Å; D273-T275 WeakPolarHBondContact OD1-CB 3.21Å; D273-T275 PolarHBondContact OD1-N 3.34Å; D273-T275 VanDerWaalsContact OD1-N 3.17Å; D273-T275 PolarHBondContact OD1-OG1 3.16Å; D273-I276 HydrophobicContact CB-CD1 4.2Å; D273-I276 HydrophobicContact CB-CG1 4.44Å; D273-F782 WeakPolarHBondContact OD2-CE1 3.1Å
274	Y	55.8	Low	59.4	Low	201 Å²	201	80 Å²	80	79%	0.788	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-0.9	178.6	-64.3	-76.6	0	0	0	113.9	I276	Y274-I276 VanDerWaalsContact C-N 3.29Å
275	T	53.9	Low	59.7	Low	91 Å²	91	75 Å²	75	56%	0.558	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.4	179.6	66.6	0	0	0	0	113.6	D273	D273-T275 PolarHBondContact O-N 3.03Å; D273-T275 WeakPolarHBondContact OD1-CB 3.21Å; D273-T275 PolarHBondContact OD1-N 3.34Å; D273-T275 VanDerWaalsContact OD1-N 3.17Å; D273-T275 PolarHBondContact OD1-OG1 3.16Å
276	I	56.8	Low	59.8	Low	43 Å²	43	76.4 Å²	76.4	22%	0.221	42%	0.418	C	S	.	.			trans	-86.8	111.9	-180	-55.5	176	0	0	0	109.2	D273 Y274 N278 T281 A282 A285	D273-I276 HydrophobicContact CB-CD1 4.2Å; D273-I276 HydrophobicContact CB-CG1 4.44Å; Y274-I276 VanDerWaalsContact C-N 3.29Å; I276-N278 WeakPolarHBondContact CG2-O 3.27Å; I276-T281 HydrophobicContact CG2-CG2 3.88Å; I276-A282 HydrophobicContact CB-CB 4.43Å; I276-A282 HydrophobicContact CG2-CB 3.98Å; I276-A285 HydrophobicContact CD1-CB 3.88Å
277	G	61.6	Low	60.3	Low	66 Å²	66	78 Å²	78	68%	0.68	43%	0.43	S	S	*	.			trans	-83.1	-14.6	179.7	0	0	0	0	0	114.8
278	N	64.4	Low	60.6	Low	43 Å²	43	76.1 Å²	76.1	23%	0.23	43%	0.427	C	S	.	.			trans	-107.2	123.8	-178.3	-174.1	-8.7	0	0	0	111.1	I276 E280 T281 A282	I276-N278 WeakPolarHBondContact CG2-O 3.27Å; N278-E280 VanDerWaalsContact C-N 3.25Å; N278-E280 PolarHBondContact O-N 2.61Å; N278-E280 PolarHBondContact OD1-N 3.24Å; N278-E280 VanDerWaalsContact OD1-N 3.14Å; N278-T281 PolarHBondContact O-N 2.9Å; N278-A282 PolarHBondContact O-N 3.47Å; N278-A282 VanDerWaalsContact O-N 3.11Å
279	P	69.4	Low	60.5	Low	103 Å²	103	74.7 Å²	74.7	67%	0.669	42%	0.418	S	S	*	.	H	α-helix	trans	-58.4	-32.1	179	23.8	-35.8	0	0	0	114	A282 S283	P279-A282 WeakPolarHBondContact O-CB 3.42Å; P279-A282 PolarHBondContact O-N 2.97Å; P279-S283 PolarHBondContact O-N 3.27Å
280	E	61.2	Low	61	Low	138 Å²	138	73 Å²	73	65%	0.645	41%	0.407	S	S	*	.	H	α-helix	trans	-68.8	-45.5	179.4	-64.4	-177.4	169.5	0	0	111.9	N278 A282 S283 N284	N278-E280 VanDerWaalsContact C-N 3.25Å; N278-E280 PolarHBondContact O-N 2.61Å; N278-E280 PolarHBondContact OD1-N 3.24Å; N278-E280 VanDerWaalsContact OD1-N 3.14Å; E280-A282 PolarHBondContact O-N 3.2Å; E280-S283 WeakPolarHBondContact O-CB 3.2Å; E280-S283 PolarHBondContact O-N 3.03Å; E280-N284 PolarHBondContact O-N 3.15Å
281	T	58.6	Low	61.5	Low	26 Å²	26	75.2 Å²	75.2	16%	0.16	42%	0.421	C	S	.	.	H	α-helix	trans	-61.4	-36.2	174.9	-52.3	0	0	0	0	110.7	H122 I276 N278 A285	H122-T281 PolarHBondContact O-OG1 3.12Å; I276-T281 HydrophobicContact CG2-CG2 3.88Å; N278-T281 PolarHBondContact O-N 2.9Å; T281-A285 WeakPolarHBondContact O-CB 3.28Å; T281-A285 PolarHBondContact O-N 3.49Å
282	A	62.6	Low	61.9	Low	28 Å²	28	77.6 Å²	77.6	23%	0.231	42%	0.424	C	S	.	.	H	α-helix	trans	-66.4	-45.6	175.7	0	0	0	0	0	111.4	I276 N278 P279 E280 N284 A285 I286	I276-A282 HydrophobicContact CB-CB 4.43Å; I276-A282 HydrophobicContact CG2-CB 3.98Å; N278-A282 PolarHBondContact O-N 3.47Å; N278-A282 VanDerWaalsContact O-N 3.11Å; P279-A282 WeakPolarHBondContact O-CB 3.42Å; P279-A282 PolarHBondContact O-N 2.97Å; E280-A282 PolarHBondContact O-N 3.2Å; A282-N284 PolarHBondContact O-N 3.09Å; A282-A285 PolarHBondContact O-N 3.33Å; A282-I286 WeakPolarHBondContact O-CB 3.43Å; A282-I286 WeakPolarHBondContact O-CD1 3.46Å; A282-I286 WeakPolarHBondContact O-CG1 3.25Å; A282-I286 PolarHBondContact O-N 3.39Å
283	S	65.3	Low	62.3	Low	56 Å²	56	71.4 Å²	71.4	39%	0.392	40%	0.402	S	S	.	.	H	α-helix	trans	-58.1	-45.8	175.5	-176	0	0	0	0	111.9	P279 E280 A285 I286 M287	P279-S283 PolarHBondContact O-N 3.27Å; E280-S283 WeakPolarHBondContact O-CB 3.2Å; E280-S283 PolarHBondContact O-N 3.03Å; S283-A285 PolarHBondContact O-N 3.3Å; S283-I286 PolarHBondContact O-N 3.01Å; S283-M287 WeakPolarHBondContact O-CB 3.01Å; S283-M287 WeakPolarHBondContact O-CG 3.11Å; S283-M287 PolarHBondContact O-N 3.01Å
284	N	64.2	Low	63.2	Low	100 Å²	100	76.8 Å²	76.8	54%	0.535	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-40.2	177.6	-72.7	-18	0	0	0	112.5	E280 A282 M287 A288	E280-N284 PolarHBondContact O-N 3.15Å; A282-N284 PolarHBondContact O-N 3.09Å; N284-M287 PolarHBondContact O-N 2.94Å; N284-A288 WeakPolarHBondContact O-CB 3.37Å; N284-A288 PolarHBondContact O-N 3.44Å
285	A	63.2	Low	63.9	Low	37 Å²	37	70.6 Å²	70.6	31%	0.306	40%	0.402	S	S	.	.	H	α-helix	trans	-64.7	-40.7	175.7	0	0	0	0	0	112.2	I276 T281 A282 S283 T289	I276-A285 HydrophobicContact CD1-CB 3.88Å; T281-A285 WeakPolarHBondContact O-CB 3.28Å; T281-A285 PolarHBondContact O-N 3.49Å; A282-A285 PolarHBondContact O-N 3.33Å; S283-A285 PolarHBondContact O-N 3.3Å; A285-T289 WeakPolarHBondContact O-CB 3.1Å; A285-T289 PolarHBondContact O-N 2.88Å; A285-T289 PolarHBondContact O-OG1 3.46Å
286	I	65.2	Low	64.3	Low	93 Å²	93	68.4 Å²	68.4	48%	0.477	39%	0.39	S	S	.	.	H	α-helix	trans	-62.5	-50.7	173.9	-68.4	163.9	0	0	0	109.6	A282 S283 A288 T289 V290	A282-I286 WeakPolarHBondContact O-CB 3.43Å; A282-I286 WeakPolarHBondContact O-CD1 3.46Å; A282-I286 WeakPolarHBondContact O-CG1 3.25Å; A282-I286 PolarHBondContact O-N 3.39Å; S283-I286 PolarHBondContact O-N 3.01Å; I286-A288 VanDerWaalsContact C-N 3.33Å; I286-A288 PolarHBondContact O-N 2.87Å; I286-T289 CarbonylContact O-C 3.6Å; I286-T289 WeakPolarHBondContact O-CA 3.32Å; I286-T289 WeakPolarHBondContact O-CB 3.36Å; I286-T289 PolarHBondContact O-N 3.33Å; I286-V290 HydrophobicContact CG2-CG2 4.31Å; I286-V290 WeakPolarHBondContact O-CG2 3.24Å; I286-V290 PolarHBondContact O-N 2.89Å
287	M	66	Low	64.9	Low	108 Å²	108	73.3 Å²	73.3	53%	0.532	41%	0.409	S	S	.	.	H	α-helix	trans	-59.5	-40.7	178.4	-74.4	-62.7	-176.8	0	0	112.8	S283 N284 T289 V290 T291	S283-M287 WeakPolarHBondContact O-CB 3.01Å; S283-M287 WeakPolarHBondContact O-CG 3.11Å; S283-M287 PolarHBondContact O-N 3.01Å; N284-M287 PolarHBondContact O-N 2.94Å; M287-T289 VanDerWaalsContact C-N 3.31Å; M287-T289 PolarHBondContact O-N 2.8Å; M287-V290 PolarHBondContact O-N 3.35Å; M287-T291 WeakPolarHBondContact O-CB 3.44Å; M287-T291 PolarHBondContact O-N 3.3Å; M287-T291 PolarHBondContact O-OG1 2.68Å
288	A	61.9	Low	65.2	Low	24 Å²	24	76.3 Å²	76.3	20%	0.198	41%	0.406	C	S	.	.	H	α-helix	trans	-64.1	-37.3	174.6	0	0	0	0	0	111.9	N284 I286 K292 V776	N284-A288 WeakPolarHBondContact O-CB 3.37Å; N284-A288 PolarHBondContact O-N 3.44Å; I286-A288 VanDerWaalsContact C-N 3.33Å; I286-A288 PolarHBondContact O-N 2.87Å; A288-K292 VanDerWaalsContact O-CG 3.25Å; A288-K292 WeakPolarHBondContact O-CG 3.11Å; A288-K292 PolarHBondContact O-N 2.95Å; A288-V776 HydrophobicContact CB-CG2 4.23Å
289	T	60.8	Low	65.2	Low	36 Å²	36	78.9 Å²	78.9	22%	0.221	42%	0.419	C	S	.	.	H	α-helix	trans	-70.2	-44.4	177.4	-59.9	0	0	0	0	111.3	A285 I286 M287 T291 K292 F293	A285-T289 WeakPolarHBondContact O-CB 3.1Å; A285-T289 PolarHBondContact O-N 2.88Å; A285-T289 PolarHBondContact O-OG1 3.46Å; I286-T289 CarbonylContact O-C 3.6Å; I286-T289 WeakPolarHBondContact O-CA 3.32Å; I286-T289 WeakPolarHBondContact O-CB 3.36Å; I286-T289 PolarHBondContact O-N 3.33Å; M287-T289 VanDerWaalsContact C-N 3.31Å; M287-T289 PolarHBondContact O-N 2.8Å; T289-T291 VanDerWaalsContact C-N 3.34Å; T289-T291 PolarHBondContact O-N 2.89Å; T289-K292 WeakPolarHBondContact O-CB 3.21Å; T289-K292 PolarHBondContact O-N 2.9Å; T289-F293 HydrophobicContact CG2-CD2 3.8Å; T289-F293 HydrophobicContact CG2-CE2 3.44Å; T289-F293 VanDerWaalsContact CG2-CE2 3.44Å; T289-F293 HydrophobicContact CG2-CZ 4.47Å; T289-F293 WeakPolarHBondContact O-CD2 3.19Å; T289-F293 PolarHBondContact O-N 2.91Å
290	V	68	Low	65	Low	51 Å²	51	79.2 Å²	79.2	31%	0.309	42%	0.415	S	S	.	.	H	α-helix	trans	-58.3	-45.5	172.1	171.5	0	0	0	0	110.9	I286 M287 K292 F293 R294	I286-V290 HydrophobicContact CG2-CG2 4.31Å; I286-V290 WeakPolarHBondContact O-CG2 3.24Å; I286-V290 PolarHBondContact O-N 2.89Å; M287-V290 PolarHBondContact O-N 3.35Å; V290-K292 PolarHBondContact O-N 3.46Å; V290-F293 PolarHBondContact O-N 3.29Å; V290-R294 HydrophobicContact CG1-CG 4.45Å; V290-R294 WeakPolarHBondContact O-CG 3.4Å; V290-R294 PolarHBondContact O-N 3.03Å
291	T	66.6	Low	65.5	Low	71 Å²	71	76.8 Å²	76.8	44%	0.436	41%	0.406	S	S	.	.	H	α-helix	trans	-63.3	-41.7	178.2	-57.3	0	0	0	0	111.4	M287 T289 F293 R294 V295	M287-T291 WeakPolarHBondContact O-CB 3.44Å; M287-T291 PolarHBondContact O-N 3.3Å; M287-T291 PolarHBondContact O-OG1 2.68Å; T289-T291 VanDerWaalsContact C-N 3.34Å; T289-T291 PolarHBondContact O-N 2.89Å; T291-F293 VanDerWaalsContact C-N 3.33Å; T291-F293 PolarHBondContact O-N 3Å; T291-R294 PolarHBondContact O-N 3.23Å; T291-V295 WeakPolarHBondContact O-CG2 3.37Å; T291-V295 PolarHBondContact O-N 3.41Å
292	K	61.3	Low	65.7	Low	77 Å²	77	83 Å²	83	34%	0.335	43%	0.43	S	S	.	.	H	α-helix	trans	-60.9	-41.5	173.2	-74.7	166.7	-170.2	158.4	0	111.9	A288 T289 V290 S296	A288-K292 VanDerWaalsContact O-CG 3.25Å; A288-K292 WeakPolarHBondContact O-CG 3.11Å; A288-K292 PolarHBondContact O-N 2.95Å; T289-K292 WeakPolarHBondContact O-CB 3.21Å; T289-K292 PolarHBondContact O-N 2.9Å; V290-K292 PolarHBondContact O-N 3.46Å; K292-S296 VanDerWaalsContact O-CB 3.32Å; K292-S296 WeakPolarHBondContact O-CB 3.27Å; K292-S296 PolarHBondContact O-N 3.39Å; K292-S296 PolarHBondContact O-OG 3.3Å
293	F	67.5	Low	65.7	Low	60 Å²	60	87.3 Å²	87.3	26%	0.263	45%	0.449	S	S	.	.	H	α-helix	trans	-66.7	-41.1	175.7	-76.2	-59.5	0	0	0	111.8	F264 K267 V268 T289 V290 T291 S296 K297	F264-F293 HydrophobicContact CD2-CD1 4.37Å; F264-F293 AromaticContact CD2-CE1 3.84Å; F264-F293 HydrophobicContact CD2-CE1 3.84Å; F264-F293 AromaticContact CE2-CD1 3.97Å; F264-F293 HydrophobicContact CE2-CD1 3.97Å; F264-F293 AromaticContact CE2-CE1 3.62Å; F264-F293 HydrophobicContact CE2-CE1 3.62Å; K267-F293 HydrophobicContact CB-CE1 4.15Å; K267-F293 HydrophobicContact CB-CZ 3.79Å; V268-F293 HydrophobicContact CG2-CE1 4.04Å; V268-F293 HydrophobicContact CG2-CZ 3.7Å; T289-F293 HydrophobicContact CG2-CD2 3.8Å; T289-F293 HydrophobicContact CG2-CE2 3.44Å; T289-F293 VanDerWaalsContact CG2-CE2 3.44Å; T289-F293 HydrophobicContact CG2-CZ 4.47Å; T289-F293 WeakPolarHBondContact O-CD2 3.19Å; T289-F293 PolarHBondContact O-N 2.91Å; V290-F293 PolarHBondContact O-N 3.29Å; T291-F293 VanDerWaalsContact C-N 3.33Å; T291-F293 PolarHBondContact O-N 3Å; F293-S296 PolarHBondContact O-N 3.44Å; F293-K297 WeakPolarHBondContact O-CB 3.42Å; F293-K297 PolarHBondContact O-N 3.23Å
294	R	73.8	Confident	65.8	Low	161 Å²	161	88.4 Å²	88.4	61%	0.608	45%	0.453	S	S	*	.	H	α-helix	trans	-59.3	-47.4	174	-75.7	-179	-178.8	146.8	-0.1	112.1	V290 T291 K297 Q298	V290-R294 HydrophobicContact CG1-CG 4.45Å; V290-R294 WeakPolarHBondContact O-CG 3.4Å; V290-R294 PolarHBondContact O-N 3.03Å; T291-R294 PolarHBondContact O-N 3.23Å; R294-K297 PolarHBondContact O-N 3.16Å; R294-Q298 PolarHBondContact O-N 3.46Å
295	V	70.4	Confident	65.8	Low	71 Å²	71	90.5 Å²	90.5	43%	0.43	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-41.1	177.3	173.7	0	0	0	0	111.3	T291 K297 Q298 L299	T291-V295 WeakPolarHBondContact O-CG2 3.37Å; T291-V295 PolarHBondContact O-N 3.41Å; V295-K297 VanDerWaalsContact C-N 3.35Å; V295-Q298 PolarHBondContact O-N 2.97Å; V295-L299 HydrophobicContact CG1-CD1 4.28Å; V295-L299 PolarHBondContact O-N 2.85Å
296	S	62.6	Low	65.6	Low	44 Å²	44	92.9 Å²	92.9	31%	0.308	47%	0.472	S	S	.	.	H	α-helix	trans	-64.2	-40.7	176.6	-56.1	0	0	0	0	111.3	K292 F293 L299 L300	K292-S296 VanDerWaalsContact O-CB 3.32Å; K292-S296 WeakPolarHBondContact O-CB 3.27Å; K292-S296 PolarHBondContact O-N 3.39Å; K292-S296 PolarHBondContact O-OG 3.3Å; F293-S296 PolarHBondContact O-N 3.44Å; S296-L299 PolarHBondContact O-N 3.05Å; S296-L300 WeakPolarHBondContact O-CB 3.47Å; S296-L300 PolarHBondContact O-N 3.38Å
297	K	68.7	Low	65.1	Low	146 Å²	146	91.3 Å²	91.3	64%	0.635	48%	0.479	S	S	*	.	H	α-helix	trans	-62	-43.2	173.1	-175.6	178.9	179.2	177.9	0	111.4	F293 R294 V295 L300 L301	F293-K297 WeakPolarHBondContact O-CB 3.42Å; F293-K297 PolarHBondContact O-N 3.23Å; R294-K297 PolarHBondContact O-N 3.16Å; V295-K297 VanDerWaalsContact C-N 3.35Å; K297-L300 PolarHBondContact O-N 3.12Å; K297-L301 HydrophobicContact CG-CD1 4.22Å; K297-L301 WeakPolarHBondContact O-CB 3.46Å; K297-L301 PolarHBondContact O-N 3.21Å
298	Q	67.9	Low	64.6	Low	130 Å²	130	92 Å²	92	61%	0.607	48%	0.484	S	S	*	.	H	α-helix	trans	-64.7	-38.7	175.5	-95.6	171	-18.2	0	0	113.1	R294 V295 L301 K302	R294-Q298 PolarHBondContact O-N 3.46Å; V295-Q298 PolarHBondContact O-N 2.97Å; Q298-L301 PolarHBondContact O-N 2.91Å; Q298-K302 PolarHBondContact O-N 3.18Å
299	L	65	Low	64.1	Low	97 Å²	97	94.3 Å²	94.3	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-43.4	173.9	-93.7	160.3	0	0	0	111.8	V295 S296 L301 K302 L303	V295-L299 HydrophobicContact CG1-CD1 4.28Å; V295-L299 PolarHBondContact O-N 2.85Å; S296-L299 PolarHBondContact O-N 3.05Å; L299-L301 VanDerWaalsContact C-N 3.33Å; L299-K302 PolarHBondContact O-N 3.03Å; L299-L303 WeakPolarHBondContact O-CB 3.16Å; L299-L303 WeakPolarHBondContact O-CG 3.2Å; L299-L303 PolarHBondContact O-N 2.96Å
300	L	65	Low	63.4	Low	110 Å²	110	99.6 Å²	99.6	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-60.4	-43.7	172.1	-99.4	162	0	0	0	111	S296 K297 K302 L303 V304	S296-L300 WeakPolarHBondContact O-CB 3.47Å; S296-L300 PolarHBondContact O-N 3.38Å; K297-L300 PolarHBondContact O-N 3.12Å; L300-K302 PolarHBondContact O-N 3.15Å; L300-L303 PolarHBondContact O-N 2.92Å; L300-V304 VanDerWaalsContact O-CB 3.29Å; L300-V304 WeakPolarHBondContact O-CB 3.31Å; L300-V304 WeakPolarHBondContact O-CG2 3.33Å; L300-V304 PolarHBondContact O-N 2.74Å
301	L	70.6	Confident	62.4	Low	87 Å²	87	102.9 Å²	102.9	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-59.4	-46.5	174	-115.8	115.8	0	0	0	111.1	K297 Q298 L299 L303 V304 F305	K297-L301 HydrophobicContact CG-CD1 4.22Å; K297-L301 WeakPolarHBondContact O-CB 3.46Å; K297-L301 PolarHBondContact O-N 3.21Å; Q298-L301 PolarHBondContact O-N 2.91Å; L299-L301 VanDerWaalsContact C-N 3.33Å; L301-L303 PolarHBondContact O-N 3.29Å; L301-V304 PolarHBondContact O-N 2.99Å; L301-F305 HydrophobicContact CD2-CD2 4.03Å; L301-F305 HydrophobicContact CD2-CE2 3.8Å; L301-F305 VanDerWaalsContact O-CB 3.31Å; L301-F305 WeakPolarHBondContact O-CB 3.48Å; L301-F305 WeakPolarHBondContact O-CD2 3.46Å; L301-F305 PolarHBondContact O-N 3.34Å
302	K	62.7	Low	61.3	Low	156 Å²	156	109 Å²	109	68%	0.678	57%	0.567	S	S	*	*	H	α-helix	trans	-61.6	-42	176.2	-81.7	-174.6	176.3	-177	0	112.6	Q298 L299 L300 S306	Q298-K302 PolarHBondContact O-N 3.18Å; L299-K302 PolarHBondContact O-N 3.03Å; L300-K302 PolarHBondContact O-N 3.15Å; K302-S306 VanDerWaalsContact O-CB 3.31Å; K302-S306 WeakPolarHBondContact O-CB 3.45Å; K302-S306 PolarHBondContact O-N 3.49Å
303	L	62.6	Low	59.8	Low	118 Å²	118	115 Å²	115	62%	0.618	59%	0.593	S	S	*	*	H	α-helix	trans	-70.8	-39.8	179.1	-74.4	171.8	0	0	0	112.1	L299 L300 L301 S306 G307	L299-L303 WeakPolarHBondContact O-CB 3.16Å; L299-L303 WeakPolarHBondContact O-CG 3.2Å; L299-L303 PolarHBondContact O-N 2.96Å; L300-L303 PolarHBondContact O-N 2.92Å; L301-L303 PolarHBondContact O-N 3.29Å; L303-S306 PolarHBondContact O-N 2.88Å; L303-G307 PolarHBondContact O-N 3.2Å
304	V	68	Low	58.6	Low	79 Å²	79	116.9 Å²	116.9	48%	0.479	61%	0.611	S	S	.	*	H	α-helix	trans	-65.4	-43.6	174.4	171.5	0	0	0	0	109.9	L300 L301 L308	L300-V304 VanDerWaalsContact O-CB 3.29Å; L300-V304 WeakPolarHBondContact O-CB 3.31Å; L300-V304 WeakPolarHBondContact O-CG2 3.33Å; L300-V304 PolarHBondContact O-N 2.74Å; L301-V304 PolarHBondContact O-N 2.99Å; V304-L308 HydrophobicContact CG1-CD1 3.81Å; V304-L308 WeakPolarHBondContact O-CB 3.35Å; V304-L308 WeakPolarHBondContact O-CD1 3.33Å; V304-L308 WeakPolarHBondContact O-CG 3.44Å; V304-L308 PolarHBondContact O-N 3.22Å
305	F	63.4	Low	56.8	Low	144 Å²	144	112.9 Å²	112.9	63%	0.632	61%	0.608	S	S	*	*	H	α-helix	trans	-67.9	-40.1	175.4	-92.5	-87.1	0	0	0	112.8	L301 S309	L301-F305 HydrophobicContact CD2-CD2 4.03Å; L301-F305 HydrophobicContact CD2-CE2 3.8Å; L301-F305 VanDerWaalsContact O-CB 3.31Å; L301-F305 WeakPolarHBondContact O-CB 3.48Å; L301-F305 WeakPolarHBondContact O-CD2 3.46Å; L301-F305 PolarHBondContact O-N 3.34Å; F305-S309 WeakPolarHBondContact O-CB 3.48Å; F305-S309 PolarHBondContact O-N 3.22Å
306	S	60.2	Low	55	Low	87 Å²	87	121.3 Å²	121.3	61%	0.608	63%	0.632	S	S	*	*	H	α-helix	trans	-67.5	-40.8	174.3	-97.2	0	0	0	0	112.2	K302 L303 L308 S309	K302-S306 VanDerWaalsContact O-CB 3.31Å; K302-S306 WeakPolarHBondContact O-CB 3.45Å; K302-S306 PolarHBondContact O-N 3.49Å; L303-S306 PolarHBondContact O-N 2.88Å; S306-L308 VanDerWaalsContact C-N 3.33Å; S306-L308 PolarHBondContact O-N 3.26Å; S306-S309 PolarHBondContact O-N 2.94Å
307	G	55.1	Low	54.2	Low	61 Å²	61	123.5 Å²	123.5	63%	0.629	65%	0.647	S	S	*	*	H	α-helix	trans	-70.4	-25.9	178.3	0	0	0	0	0	113.8	L303	L303-G307 PolarHBondContact O-N 3.2Å
308	L	54.4	Low	53.3	Low	121 Å²	121	123 Å²	123	63%	0.634	65%	0.65	S	S	*	*	H	α-helix	trans	-85.5	-20.4	170.7	-75.7	163.6	0	0	0	113	V304 S306	V304-L308 HydrophobicContact CG1-CD1 3.81Å; V304-L308 WeakPolarHBondContact O-CB 3.35Å; V304-L308 WeakPolarHBondContact O-CD1 3.33Å; V304-L308 WeakPolarHBondContact O-CG 3.44Å; V304-L308 PolarHBondContact O-N 3.22Å; S306-L308 VanDerWaalsContact C-N 3.33Å; S306-L308 PolarHBondContact O-N 3.26Å
309	S	51.3	Low	52.2	Low	74 Å²	74	125.2 Å²	125.2	52%	0.517	66%	0.658	S	S	.	*	H	α-helix	trans	-83.7	-13.6	-176	-169.9	0	0	0	0	114.1	F305 S306 S311 R312	F305-S309 WeakPolarHBondContact O-CB 3.48Å; F305-S309 PolarHBondContact O-N 3.22Å; S306-S309 PolarHBondContact O-N 2.94Å; S309-S311 VanDerWaalsContact C-N 3.28Å; S309-S311 PolarHBondContact O-N 2.94Å; S309-R312 PolarHBondContact O-N 2.92Å
310	D	46.5	Very low	51.3	Low	146 Å²	146	128.9 Å²	128.9	78%	0.781	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-16.9	-179.4	-143	11.7	0	0	0	113
311	S	46.1	Very low	50.5	Low	121 Å²	121	127.7 Å²	127.7	85%	0.846	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	4.6	174.4	-67.4	0	0	0	0	114.7	S309	S309-S311 VanDerWaalsContact C-N 3.28Å; S309-S311 PolarHBondContact O-N 2.94Å
312	R	43.7	Very low	49.3	Very low	199 Å²	199	132.5 Å²	132.5	75%	0.751	69%	0.688	S	S	*	*			trans	-131.3	89.9	175.6	-126.5	-174	-69.4	-158.3	-1.3	109.2	S309 P314	S309-R312 PolarHBondContact O-N 2.92Å; R312-P314 VanDerWaalsContact C-CD 3.41Å; R312-P314 WeakPolarHBondContact O-CD 3.47Å
313	K	30.2	Very low	48.7	Very low	203 Å²	203	131 Å²	131	88%	0.883	69%	0.687	S	S	*	*			trans	-84.7	100.4	163.9	-70.4	-174	180	178.4	0	109.7
314	P	42.2	Very low	47.9	Very low	100 Å²	100	136 Å²	136	65%	0.649	70%	0.697	S	S	*	*			trans	-104.5	108.7	157.2	33.4	-29.3	0	0	0	110.2	R312	R312-P314 VanDerWaalsContact C-CD 3.41Å; R312-P314 WeakPolarHBondContact O-CD 3.47Å
315	S	36.8	Very low	47.2	Very low	77 Å²	77	137.9 Å²	137.9	54%	0.538	71%	0.714	S	S	.	*			trans	18.2	99.5	149.2	-167.4	0	0	0	0	117.9	S317	S315-S317 PolarHBondContact O-N 3.41Å
316	W	32	Very low	46.7	Very low	247 Å²	247	134.2 Å²	134.2	94%	0.936	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	9.9	165.6	-79.9	87.8	0	0	0	113.8
317	S	45.6	Very low	46.4	Very low	91 Å²	91	131.9 Å²	131.9	64%	0.636	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-31.5	-177.7	-160.9	0	0	0	0	113.2	S315	S315-S317 PolarHBondContact O-N 3.41Å
318	I	50.1	Low	46.5	Very low	136 Å²	136	139 Å²	139	70%	0.697	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-15.1	-167.9	-63.5	170.4	0	0	0	113.5	S321	I318-S321 PolarHBondContact O-OG 2.91Å
319	K	43.7	Very low	46.5	Very low	175 Å²	175	140 Å²	140	76%	0.761	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-2.7	175.5	-114.4	174.5	-177.5	176	0	114.7
320	K	46.1	Very low	46.7	Very low	174 Å²	174	145 Å²	145	76%	0.757	71%	0.711	S	S	*	*	S	Bend	trans	-84.4	-20.9	-178.5	-147.8	172.9	-176.5	-178.8	0	112.9
321	S	49.7	Very low	47.4	Very low	86 Å²	86	143.6 Å²	143.6	60%	0.601	70%	0.7	S	S	*	*	S	Bend	trans	-81.9	-26.6	179.5	53.5	0	0	0	0	114.1	I318	I318-S321 PolarHBondContact O-OG 2.91Å
322	K	45.7	Very low	48.3	Very low	188 Å²	188	146.4 Å²	146.4	82%	0.817	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-7.1	-178.7	-139.2	163.5	-171.9	170.9	0	114.6
323	L	49.9	Very low	49.4	Very low	124 Å²	124	141.7 Å²	141.7	65%	0.649	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	5	170.8	-91.1	142.7	0	0	0	113.2	S325	L323-S325 VanDerWaalsContact C-N 3.31Å; L323-S325 PolarHBondContact O-N 3.38Å
324	R	46	Very low	51.4	Low	223 Å²	223	136.7 Å²	136.7	84%	0.842	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-5.1	178.5	-135.8	174.7	-158.5	170.1	3.7	114.3
325	S	51.9	Low	52.9	Low	119 Å²	119	140.2 Å²	140.2	83%	0.832	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	5	179.4	-174.6	0	0	0	0	114.3	L323	L323-S325 VanDerWaalsContact C-N 3.31Å; L323-S325 PolarHBondContact O-N 3.38Å
326	S	52.7	Low	54.7	Low	66 Å²	66	142.2 Å²	142.2	46%	0.462	67%	0.668	S	S	.	*			trans	-119.9	27.8	175.7	-138.3	0	0	0	0	112.9	R328 K329 Y330	S326-R328 PolarHBondContact O-N 3.46Å; S326-K329 PolarHBondContact O-N 3.04Å; S326-Y330 PolarHBondContact O-N 3.34Å
327	G	54.6	Low	56.9	Low	38 Å²	38	133.1 Å²	133.1	39%	0.392	64%	0.639	S	S	.	*	H	α-helix	trans	-59.3	-37	-175.9	0	0	0	0	0	114.7	K329 Y330 E331	G327-K329 PolarHBondContact O-N 2.95Å; G327-Y330 PolarHBondContact O-N 3.45Å; G327-E331 PolarHBondContact O-N 3.19Å; G327-E331 VanDerWaalsContact O-N 3.11Å
328	R	57.2	Low	58.6	Low	212 Å²	212	131.5 Å²	131.5	80%	0.8	63%	0.626	S	S	*	*	H	α-helix	trans	-74	-21.1	-178.7	-85	-172.4	-79.4	174.9	-5.8	115.4	S326	S326-R328 PolarHBondContact O-N 3.46Å
329	K	55.3	Low	60.1	Low	141 Å²	141	130.3 Å²	130.3	61%	0.613	62%	0.62	S	S	*	*	H	α-helix	trans	-86.8	-35.6	173	-102.9	-178.7	179.2	176.6	0	111.2	S326 G327 R332 I333	S326-K329 PolarHBondContact O-N 3.04Å; G327-K329 PolarHBondContact O-N 2.95Å; K329-R332 PolarHBondContact O-N 2.75Å; K329-I333 WeakPolarHBondContact O-CB 3.34Å; K329-I333 WeakPolarHBondContact O-CD1 3.19Å; K329-I333 VanDerWaalsContact O-CG1 3.27Å; K329-I333 WeakPolarHBondContact O-CG1 3.31Å; K329-I333 PolarHBondContact O-N 3.47Å
330	Y	54.1	Low	61.9	Low	178 Å²	178	125.8 Å²	125.8	70%	0.698	60%	0.604	S	S	*	*	H	α-helix	trans	-66.7	-38.5	178	-137.3	-93.7	0	0	0	111.9	S326 G327 N334	S326-Y330 PolarHBondContact O-N 3.34Å; G327-Y330 PolarHBondContact O-N 3.45Å; Y330-N334 VanDerWaalsContact O-CB 3.26Å; Y330-N334 WeakPolarHBondContact O-CB 3.33Å; Y330-N334 PolarHBondContact O-N 3.29Å
331	E	62	Low	63.6	Low	117 Å²	117	123.6 Å²	123.6	55%	0.547	59%	0.594	S	S	.	*	H	α-helix	trans	-64.6	-48.2	174	-75.7	176.9	176.8	0	0	112.4	G327 I333 N334 Y335	G327-E331 PolarHBondContact O-N 3.19Å; G327-E331 VanDerWaalsContact O-N 3.11Å; E331-I333 VanDerWaalsContact C-N 3.34Å; E331-I333 PolarHBondContact O-N 3.36Å; E331-N334 PolarHBondContact O-N 2.98Å; E331-N334 VanDerWaalsContact O-N 3.08Å; E331-Y335 HydrophobicContact CB-CD2 4.5Å; E331-Y335 HydrophobicContact CB-CE2 4.34Å; E331-Y335 WeakPolarHBondContact O-CD2 3.18Å; E331-Y335 PolarHBondContact O-N 2.96Å
332	R	64	Low	65.2	Low	181 Å²	181	127.7 Å²	127.7	68%	0.683	60%	0.597	S	S	*	*	H	α-helix	trans	-60.5	-39.6	176.9	-79.2	-166.6	-79.2	-168.5	-3.5	113.1	K329 M336	K329-R332 PolarHBondContact O-N 2.75Å; R332-M336 WeakPolarHBondContact O-CB 3.42Å; R332-M336 PolarHBondContact O-N 2.84Å
333	I	67.6	Low	67.1	Low	100 Å²	100	121.9 Å²	121.9	51%	0.513	58%	0.577	S	S	.	*	H	α-helix	trans	-68.8	-37	174.9	-66.5	166.6	0	0	0	110.6	K329 E331 M336 V337	K329-I333 WeakPolarHBondContact O-CB 3.34Å; K329-I333 WeakPolarHBondContact O-CD1 3.19Å; K329-I333 VanDerWaalsContact O-CG1 3.27Å; K329-I333 WeakPolarHBondContact O-CG1 3.31Å; K329-I333 PolarHBondContact O-N 3.47Å; E331-I333 VanDerWaalsContact C-N 3.34Å; E331-I333 PolarHBondContact O-N 3.36Å; I333-M336 PolarHBondContact O-N 3.21Å; I333-V337 HydrophobicContact CG2-CG2 4.15Å; I333-V337 WeakPolarHBondContact O-CB 3.3Å; I333-V337 WeakPolarHBondContact O-CG2 3.5Å; I333-V337 PolarHBondContact O-N 3.18Å
334	N	72.1	Confident	68.7	Low	97 Å²	97	120.7 Å²	120.7	52%	0.519	56%	0.564	S	S	.	*	H	α-helix	trans	-67.3	-43.4	177.1	-158	20.9	0	0	0	111.4	Y330 E331 M336 V337 V338	Y330-N334 VanDerWaalsContact O-CB 3.26Å; Y330-N334 WeakPolarHBondContact O-CB 3.33Å; Y330-N334 PolarHBondContact O-N 3.29Å; E331-N334 PolarHBondContact O-N 2.98Å; E331-N334 VanDerWaalsContact O-N 3.08Å; N334-M336 PolarHBondContact O-N 3.41Å; N334-V337 PolarHBondContact O-N 3.46Å; N334-V338 VanDerWaalsContact O-CB 3.29Å; N334-V338 WeakPolarHBondContact O-CB 2.86Å; N334-V338 WeakPolarHBondContact O-CG2 3.44Å; N334-V338 PolarHBondContact O-N 3.07Å
335	Y	73.4	Confident	70.6	Confident	174 Å²	174	115.7 Å²	115.7	68%	0.682	55%	0.548	S	S	*	.	H	α-helix	trans	-59.7	-43	171	-74.5	-70.4	0	0	0	111.7	E331 V338 L339	E331-Y335 HydrophobicContact CB-CD2 4.5Å; E331-Y335 HydrophobicContact CB-CE2 4.34Å; E331-Y335 WeakPolarHBondContact O-CD2 3.18Å; E331-Y335 PolarHBondContact O-N 2.96Å; Y335-V338 PolarHBondContact O-N 2.99Å; Y335-L339 WeakPolarHBondContact O-CB 3.2Å; Y335-L339 PolarHBondContact O-N 3.42Å
336	M	76	Confident	72.3	Confident	119 Å²	119	116.4 Å²	116.4	59%	0.586	54%	0.537	S	S	*	.	H	α-helix	trans	-65.8	-40.9	176.7	-167.1	-161.6	-175.5	0	0	112.5	R332 I333 N334 L340	R332-M336 WeakPolarHBondContact O-CB 3.42Å; R332-M336 PolarHBondContact O-N 2.84Å; I333-M336 PolarHBondContact O-N 3.21Å; N334-M336 PolarHBondContact O-N 3.41Å; M336-L340 HydrophobicContact CE-CD1 4.2Å; M336-L340 HydrophobicContact CG-CD1 4.12Å; M336-L340 VanDerWaalsContact O-CB 3.24Å; M336-L340 WeakPolarHBondContact O-CB 3.38Å; M336-L340 WeakPolarHBondContact O-CD1 3.29Å; M336-L340 WeakPolarHBondContact O-CG 3.18Å; M336-L340 PolarHBondContact O-N 3.48Å; M336-L340 HydrophobicContact SD-CD1 4.48Å
337	V	77.7	Confident	73.9	Confident	56 Å²	56	115.2 Å²	115.2	34%	0.339	53%	0.525	S	S	.	.	H	α-helix	trans	-69.1	-39.5	178	169.6	0	0	0	0	111.1	I333 N334 K341	I333-V337 HydrophobicContact CG2-CG2 4.15Å; I333-V337 WeakPolarHBondContact O-CB 3.3Å; I333-V337 WeakPolarHBondContact O-CG2 3.5Å; I333-V337 PolarHBondContact O-N 3.18Å; N334-V337 PolarHBondContact O-N 3.46Å; V337-K341 WeakPolarHBondContact O-CB 3.49Å; V337-K341 VanDerWaalsContact O-CG 3.29Å; V337-K341 WeakPolarHBondContact O-CG 3.4Å; V337-K341 PolarHBondContact O-N 3.31Å
338	V	80.4	Confident	75.4	Confident	57 Å²	57	117.2 Å²	117.2	35%	0.345	52%	0.521	S	S	.	.	H	α-helix	trans	-65.3	-48.8	174	170.5	0	0	0	0	110	N334 Y335 L340 K341 W342	N334-V338 VanDerWaalsContact O-CB 3.29Å; N334-V338 WeakPolarHBondContact O-CB 2.86Å; N334-V338 WeakPolarHBondContact O-CG2 3.44Å; N334-V338 PolarHBondContact O-N 3.07Å; Y335-V338 PolarHBondContact O-N 2.99Å; V338-L340 PolarHBondContact O-N 2.98Å; V338-K341 WeakPolarHBondContact O-CA 3.3Å; V338-K341 WeakPolarHBondContact O-CB 3.49Å; V338-K341 PolarHBondContact O-N 3.32Å; V338-W342 PolarHBondContact O-N 3.1Å
339	L	82.1	Confident	76.9	Confident	112 Å²	112	111.4 Å²	111.4	59%	0.586	50%	0.504	S	S	*	.	H	α-helix	trans	-57.5	-47	174.7	-177	67.6	0	0	0	111.3	Y335 K341 W342 V343	Y335-L339 WeakPolarHBondContact O-CB 3.2Å; Y335-L339 PolarHBondContact O-N 3.42Å; L339-K341 VanDerWaalsContact C-N 3.27Å; L339-K341 PolarHBondContact O-N 3.31Å; L339-W342 PolarHBondContact O-N 2.79Å; L339-V343 HydrophobicContact CD1-CG2 4.25Å; L339-V343 HydrophobicContact CG-CG2 4.24Å; L339-V343 WeakPolarHBondContact O-CB 3.45Å; L339-V343 VanDerWaalsContact O-CG2 3.24Å; L339-V343 WeakPolarHBondContact O-CG2 3.34Å; L339-V343 PolarHBondContact O-N 3.15Å
340	L	80.5	Confident	78.5	Confident	80 Å²	80	107 Å²	107	42%	0.419	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-29.9	175.5	-77.1	167.8	0	0	0	112.8	M336 V338 R344	M336-L340 HydrophobicContact CE-CD1 4.2Å; M336-L340 HydrophobicContact CG-CD1 4.12Å; M336-L340 VanDerWaalsContact O-CB 3.24Å; M336-L340 WeakPolarHBondContact O-CB 3.38Å; M336-L340 WeakPolarHBondContact O-CD1 3.29Å; M336-L340 WeakPolarHBondContact O-CG 3.18Å; M336-L340 PolarHBondContact O-N 3.48Å; M336-L340 HydrophobicContact SD-CD1 4.48Å; V338-L340 PolarHBondContact O-N 2.98Å; L340-R344 VanDerWaalsContact O-CB 3.24Å; L340-R344 WeakPolarHBondContact O-CB 3.48Å; L340-R344 WeakPolarHBondContact O-CG 3.43Å; L340-R344 PolarHBondContact O-N 3.44Å; L340-R344 VanDerWaalsContact O-N 3.09Å; L340-R344 PolarHBondContact O-NE 2.92Å
341	K	82.4	Confident	80.1	Confident	128 Å²	128	98.5 Å²	98.5	56%	0.557	46%	0.456	S	S	*	.	H	α-helix	trans	-70.5	-45.9	172.7	-79.4	175.5	178.7	-179.5	0	110.6	V337 V338 L339 R344 F345	V337-K341 WeakPolarHBondContact O-CB 3.49Å; V337-K341 VanDerWaalsContact O-CG 3.29Å; V337-K341 WeakPolarHBondContact O-CG 3.4Å; V337-K341 PolarHBondContact O-N 3.31Å; V338-K341 WeakPolarHBondContact O-CA 3.3Å; V338-K341 WeakPolarHBondContact O-CB 3.49Å; V338-K341 PolarHBondContact O-N 3.32Å; L339-K341 VanDerWaalsContact C-N 3.27Å; L339-K341 PolarHBondContact O-N 3.31Å; K341-R344 PolarHBondContact O-N 3.26Å; K341-F345 WeakPolarHBondContact O-CB 3.32Å; K341-F345 PolarHBondContact O-N 3.37Å
342	W	84.6	Confident	81.4	Confident	171 Å²	171	96.4 Å²	96.4	65%	0.648	45%	0.449	S	S	*	.	H	α-helix	trans	-64.3	-46	176.6	-77.9	106.7	0	0	0	112.4	V338 L339 R344 F345 F346	V338-W342 PolarHBondContact O-N 3.1Å; L339-W342 PolarHBondContact O-N 2.79Å; W342-R344 VanDerWaalsContact C-N 3.34Å; W342-R344 PolarHBondContact O-N 3.5Å; W342-F345 WeakPolarHBondContact O-CB 3.1Å; W342-F345 PolarHBondContact O-N 2.9Å; W342-F345 VanDerWaalsContact O-N 3.14Å; W342-F346 WeakPolarHBondContact O-CB 3.34Å; W342-F346 PolarHBondContact O-N 2.92Å
343	V	85.4	Confident	82.6	Confident	67 Å²	67	94.7 Å²	94.7	41%	0.406	45%	0.446	S	S	.	.	H	α-helix	trans	-59.2	-44.6	174.4	171.2	0	0	0	0	110.7	L339 F345 F346 L347	L339-V343 HydrophobicContact CD1-CG2 4.25Å; L339-V343 HydrophobicContact CG-CG2 4.24Å; L339-V343 WeakPolarHBondContact O-CB 3.45Å; L339-V343 VanDerWaalsContact O-CG2 3.24Å; L339-V343 WeakPolarHBondContact O-CG2 3.34Å; L339-V343 PolarHBondContact O-N 3.15Å; V343-F345 PolarHBondContact O-N 3.23Å; V343-F346 PolarHBondContact O-N 2.94Å; V343-L347 HydrophobicContact CG1-CD1 3.86Å; V343-L347 HydrophobicContact CG1-CG 4.35Å; V343-L347 WeakPolarHBondContact O-CB 3.41Å; V343-L347 WeakPolarHBondContact O-CG 3.38Å; V343-L347 PolarHBondContact O-N 2.84Å
344	R	82.1	Confident	83.8	Confident	98 Å²	98	93 Å²	93	37%	0.37	44%	0.437	S	S	.	.	H	α-helix	trans	-65.5	-37.2	175.2	-78.5	-178.9	-69.5	169.7	-5.1	112.9	L340 K341 W342 R348	L340-R344 VanDerWaalsContact O-CB 3.24Å; L340-R344 WeakPolarHBondContact O-CB 3.48Å; L340-R344 WeakPolarHBondContact O-CG 3.43Å; L340-R344 PolarHBondContact O-N 3.44Å; L340-R344 VanDerWaalsContact O-N 3.09Å; L340-R344 PolarHBondContact O-NE 2.92Å; K341-R344 PolarHBondContact O-N 3.26Å; W342-R344 VanDerWaalsContact C-N 3.34Å; W342-R344 PolarHBondContact O-N 3.5Å; R344-R348 WeakPolarHBondContact O-CD 3.41Å; R344-R348 WeakPolarHBondContact O-CG 3.42Å; R344-R348 PolarHBondContact O-N 3.41Å; R344-R348 VanDerWaalsContact O-N 3.15Å
345	F	85.7	Confident	84.6	Confident	118 Å²	118	88.6 Å²	88.6	52%	0.518	41%	0.414	S	S	.	.	H	α-helix	trans	-66.1	-46	176.2	-179.3	-105	0	0	0	111	K341 W342 V343 R348 I349	K341-F345 WeakPolarHBondContact O-CB 3.32Å; K341-F345 PolarHBondContact O-N 3.37Å; W342-F345 WeakPolarHBondContact O-CB 3.1Å; W342-F345 PolarHBondContact O-N 2.9Å; W342-F345 VanDerWaalsContact O-N 3.14Å; V343-F345 PolarHBondContact O-N 3.23Å; F345-R348 WeakPolarHBondContact O-CB 3.08Å; F345-R348 PolarHBondContact O-N 3.32Å; F345-I349 HydrophobicContact CD1-CD1 3.76Å; F345-I349 HydrophobicContact CE1-CD1 3.32Å; F345-I349 HydrophobicContact CE1-CG1 4.35Å; F345-I349 HydrophobicContact CZ-CD1 3.75Å; F345-I349 HydrophobicContact CZ-CG1 4.45Å; F345-I349 PolarHBondContact O-N 3.49Å
346	F	87.7	Confident	85.4	Confident	134 Å²	134	85.2 Å²	85.2	59%	0.588	41%	0.407	S	S	*	.	H	α-helix	trans	-60.4	-49	174.7	-177.5	-99.7	0	0	0	112	W342 V343 R348 I349 V350	W342-F346 WeakPolarHBondContact O-CB 3.34Å; W342-F346 PolarHBondContact O-N 2.92Å; V343-F346 PolarHBondContact O-N 2.94Å; F346-R348 PolarHBondContact O-N 2.98Å; F346-I349 PolarHBondContact O-N 2.99Å; F346-V350 HydrophobicContact CD1-CG2 4Å; F346-V350 HydrophobicContact CE1-CG2 3.62Å; F346-V350 HydrophobicContact CE2-CG2 4.26Å; F346-V350 HydrophobicContact CG-CG2 4.48Å; F346-V350 HydrophobicContact CZ-CG2 3.76Å; F346-V350 WeakPolarHBondContact O-CG2 3.32Å; F346-V350 PolarHBondContact O-N 2.98Å
347	L	86.2	Confident	86.1	Confident	41 Å²	41	82.9 Å²	82.9	22%	0.215	40%	0.403	C	S	.	.	H	α-helix	trans	-55.5	-35.3	175.6	-75.9	168.2	0	0	0	112.5	V343 A351 L411	V343-L347 HydrophobicContact CG1-CD1 3.86Å; V343-L347 HydrophobicContact CG1-CG 4.35Å; V343-L347 WeakPolarHBondContact O-CB 3.41Å; V343-L347 WeakPolarHBondContact O-CG 3.38Å; V343-L347 PolarHBondContact O-N 2.84Å; L347-A351 VanDerWaalsContact O-CB 3.23Å; L347-A351 WeakPolarHBondContact O-CB 3.35Å; L347-A351 PolarHBondContact O-N 2.8Å; L347-L411 HydrophobicContact CD2-CD1 3.77Å; L347-L411 HydrophobicContact CD2-CD2 4.28Å; L347-L411 HydrophobicContact CD2-CG 3.95Å
348	R	86.8	Confident	86.7	Confident	80 Å²	80	81.4 Å²	81.4	30%	0.302	39%	0.393	S	S	.	.	H	α-helix	trans	-73.1	-37.8	175.8	-71.9	167.1	-178.4	-176.7	1	112.8	R344 F345 F346 N352 E412 F414	R344-R348 WeakPolarHBondContact O-CD 3.41Å; R344-R348 WeakPolarHBondContact O-CG 3.42Å; R344-R348 PolarHBondContact O-N 3.41Å; R344-R348 VanDerWaalsContact O-N 3.15Å; F345-R348 WeakPolarHBondContact O-CB 3.08Å; F345-R348 PolarHBondContact O-N 3.32Å; F346-R348 PolarHBondContact O-N 2.98Å; R348-N352 WeakPolarHBondContact O-CB 3.39Å; R348-N352 PolarHBondContact O-N 3.24Å; R348-N352 PolarHBondContact O-ND2 2.81Å; R348-E412 HydrophobicContact CG-CB 4.46Å; R348-E412 PolarHBondContact NE-O 3.3Å; R348-F414 HydrophobicContact CG-CZ 4.49Å
349	I	87.9	Confident	87.2	Confident	90 Å²	90	80 Å²	80	46%	0.462	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-49.1	174	-69.4	170	0	0	0	109.2	F345 F346 A351 N352 F353	F345-I349 HydrophobicContact CD1-CD1 3.76Å; F345-I349 HydrophobicContact CE1-CD1 3.32Å; F345-I349 HydrophobicContact CE1-CG1 4.35Å; F345-I349 HydrophobicContact CZ-CD1 3.75Å; F345-I349 HydrophobicContact CZ-CG1 4.45Å; F345-I349 PolarHBondContact O-N 3.49Å; F346-I349 PolarHBondContact O-N 2.99Å; I349-A351 PolarHBondContact O-N 3.41Å; I349-N352 PolarHBondContact O-N 2.87Å; I349-F353 WeakPolarHBondContact O-CB 3.45Å; I349-F353 PolarHBondContact O-N 2.9Å
350	V	89.8	Confident	87.6	Confident	48 Å²	48	77.3 Å²	77.3	29%	0.291	38%	0.376	S	S	.	.	H	α-helix	trans	-57.9	-49	177.2	173.9	0	0	0	0	111	F346 N352 F353 I354	F346-V350 HydrophobicContact CD1-CG2 4Å; F346-V350 HydrophobicContact CE1-CG2 3.62Å; F346-V350 HydrophobicContact CE2-CG2 4.26Å; F346-V350 HydrophobicContact CG-CG2 4.48Å; F346-V350 HydrophobicContact CZ-CG2 3.76Å; F346-V350 WeakPolarHBondContact O-CG2 3.32Å; F346-V350 PolarHBondContact O-N 2.98Å; V350-N352 PolarHBondContact O-N 2.89Å; V350-F353 PolarHBondContact O-N 3.46Å; V350-I354 HydrophobicContact CG1-CD1 3.84Å; V350-I354 HydrophobicContact CG1-CG1 4.47Å; V350-I354 VanDerWaalsContact O-CG1 3.3Å; V350-I354 WeakPolarHBondContact O-CG1 3.35Å; V350-I354 PolarHBondContact O-N 2.82Å
351	A	88.6	Confident	88.1	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-59.3	-46	178.4	0	0	0	0	0	112.8	L347 I349 F353 I354 I355 V408 L411 E412	L347-A351 VanDerWaalsContact O-CB 3.23Å; L347-A351 WeakPolarHBondContact O-CB 3.35Å; L347-A351 PolarHBondContact O-N 2.8Å; I349-A351 PolarHBondContact O-N 3.41Å; A351-F353 VanDerWaalsContact C-N 3.34Å; A351-F353 PolarHBondContact O-N 3.42Å; A351-I354 PolarHBondContact O-N 3.25Å; A351-I355 WeakPolarHBondContact O-CD1 3.22Å; A351-I355 VanDerWaalsContact O-CG1 3.31Å; A351-I355 WeakPolarHBondContact O-CG1 3.35Å; A351-I355 PolarHBondContact O-N 2.86Å; A351-V408 HydrophobicContact CB-CG1 3.65Å; A351-L411 HydrophobicContact CB-CD2 4.5Å; A351-E412 HydrophobicContact CB-CG 3.46Å; A351-E412 VanDerWaalsContact CB-CG 3.46Å; A351-E412 WeakPolarHBondContact CB-OE1 3.45Å
352	N	88.1	Confident	88.5	Confident	74 Å²	74	70 Å²	70	40%	0.396	35%	0.348	S	S	.	.	H	α-helix	trans	-68	-33.3	177.9	-74.1	-63.9	0	0	0	112.6	R348 I349 V350 I355 L356 R426	R348-N352 WeakPolarHBondContact O-CB 3.39Å; R348-N352 PolarHBondContact O-N 3.24Å; R348-N352 PolarHBondContact O-ND2 2.81Å; I349-N352 PolarHBondContact O-N 2.87Å; V350-N352 PolarHBondContact O-N 2.89Å; N352-I355 PolarHBondContact O-N 2.79Å; N352-L356 WeakPolarHBondContact O-CB 3.3Å; N352-L356 PolarHBondContact O-N 3.32Å; N352-R426 PolarHBondContact OD1-NH2 3.49Å
353	F	90.4	Very high	88.6	Confident	144 Å²	144	64 Å²	64	63%	0.632	33%	0.33	S	S	*	.	H	α-helix	trans	-65.3	-44.7	173.3	-175.3	-95.4	0	0	0	111.5	I349 V350 A351 I355 L356 S357	I349-F353 WeakPolarHBondContact O-CB 3.45Å; I349-F353 PolarHBondContact O-N 2.9Å; V350-F353 PolarHBondContact O-N 3.46Å; A351-F353 VanDerWaalsContact C-N 3.34Å; A351-F353 PolarHBondContact O-N 3.42Å; F353-I355 VanDerWaalsContact C-N 3.31Å; F353-I355 PolarHBondContact O-N 2.87Å; F353-L356 PolarHBondContact O-N 2.81Å; F353-S357 WeakPolarHBondContact O-CB 3.23Å; F353-S357 PolarHBondContact O-N 3.44Å
354	I	91.2	Very high	88.8	Confident	64 Å²	64	68.6 Å²	68.6	33%	0.328	34%	0.341	S	S	.	.	H	α-helix	trans	-57.2	-46.7	173.7	-67.7	165.5	0	0	0	110	V350 A351 L356 S357 M358 V408	V350-I354 HydrophobicContact CG1-CD1 3.84Å; V350-I354 HydrophobicContact CG1-CG1 4.47Å; V350-I354 VanDerWaalsContact O-CG1 3.3Å; V350-I354 WeakPolarHBondContact O-CG1 3.35Å; V350-I354 PolarHBondContact O-N 2.82Å; A351-I354 PolarHBondContact O-N 3.25Å; I354-L356 PolarHBondContact O-N 3.08Å; I354-S357 PolarHBondContact O-N 3.28Å; I354-M358 HydrophobicContact CG2-CG 4.45Å; I354-M358 HydrophobicContact CG2-SD 4.19Å; I354-M358 WeakPolarHBondContact O-CB 3.45Å; I354-M358 VanDerWaalsContact O-CG 3.28Å; I354-M358 WeakPolarHBondContact O-CG 3.06Å; I354-M358 PolarHBondContact O-N 3.24Å; I354-V408 HydrophobicContact CG2-CG2 3.91Å
355	I	90	Very high	89.2	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-62.7	-44.4	179.5	-70.3	156.5	0	0	0	111.7	A351 N352 F353 M358 M359 F405 V408 R426	A351-I355 WeakPolarHBondContact O-CD1 3.22Å; A351-I355 VanDerWaalsContact O-CG1 3.31Å; A351-I355 WeakPolarHBondContact O-CG1 3.35Å; A351-I355 PolarHBondContact O-N 2.86Å; N352-I355 PolarHBondContact O-N 2.79Å; F353-I355 VanDerWaalsContact C-N 3.31Å; F353-I355 PolarHBondContact O-N 2.87Å; I355-M358 WeakPolarHBondContact O-CB 3.37Å; I355-M358 PolarHBondContact O-N 3.23Å; I355-M359 HydrophobicContact CG2-CG 4.48Å; I355-M359 HydrophobicContact CG2-SD 3.92Å; I355-M359 VanDerWaalsContact O-CG 3.28Å; I355-M359 WeakPolarHBondContact O-CG 3.44Å; I355-M359 PolarHBondContact O-N 3.46Å; I355-F405 HydrophobicContact CB-CE1 4.49Å; I355-F405 HydrophobicContact CG1-CD1 4.13Å; I355-F405 HydrophobicContact CG1-CE1 4.3Å; I355-F405 HydrophobicContact CG2-CE1 4.07Å; I355-F405 HydrophobicContact CG2-CZ 4.43Å; I355-V408 HydrophobicContact CD1-CG1 3.72Å; I355-V408 HydrophobicContact CG1-CB 4.49Å; I355-V408 HydrophobicContact CG1-CG1 3.88Å; I355-R426 VanDerWaalsContact CD1-NH1 3.32Å; I355-R426 HydrophobicContact CG2-CG 4.34Å
356	L	89.6	Confident	89.1	Confident	102 Å²	102	59.8 Å²	59.8	53%	0.534	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-41.7	178.5	-173.7	66.5	0	0	0	111.5	N352 F353 I354 M358 M359 A360	N352-L356 WeakPolarHBondContact O-CB 3.3Å; N352-L356 PolarHBondContact O-N 3.32Å; F353-L356 PolarHBondContact O-N 2.81Å; I354-L356 PolarHBondContact O-N 3.08Å; L356-M358 VanDerWaalsContact C-N 3.32Å; L356-M358 PolarHBondContact O-N 2.9Å; L356-M359 PolarHBondContact O-N 3.15Å; L356-A360 PolarHBondContact O-N 3.04Å
357	S	91.2	Very high	88.9	Confident	70 Å²	70	57.9 Å²	57.9	49%	0.49	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-42.9	174.5	-174.4	0	0	0	0	111.5	F353 I354 A360 S361	F353-S357 WeakPolarHBondContact O-CB 3.23Å; F353-S357 PolarHBondContact O-N 3.44Å; I354-S357 PolarHBondContact O-N 3.28Å; S357-A360 PolarHBondContact O-N 2.99Å; S357-S361 WeakPolarHBondContact O-CB 3.38Å; S357-S361 PolarHBondContact O-N 3.21Å; S357-S361 PolarHBondContact O-OG 2.67Å
358	M	90.9	Very high	88.8	Confident	26 Å²	26	58.1 Å²	58.1	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-46.3	175.5	-74.4	-176.8	71	0	0	111.4	I354 I355 L356 A360 S361 S362 F401 L404 F405	I354-M358 HydrophobicContact CG2-CG 4.45Å; I354-M358 HydrophobicContact CG2-SD 4.19Å; I354-M358 WeakPolarHBondContact O-CB 3.45Å; I354-M358 VanDerWaalsContact O-CG 3.28Å; I354-M358 WeakPolarHBondContact O-CG 3.06Å; I354-M358 PolarHBondContact O-N 3.24Å; I355-M358 WeakPolarHBondContact O-CB 3.37Å; I355-M358 PolarHBondContact O-N 3.23Å; L356-M358 VanDerWaalsContact C-N 3.32Å; L356-M358 PolarHBondContact O-N 2.9Å; M358-A360 PolarHBondContact O-N 3.31Å; M358-S361 WeakPolarHBondContact CA-OG 3.31Å; M358-S361 PolarHBondContact O-N 3.16Å; M358-S361 PolarHBondContact O-OG 2.96Å; M358-S362 PolarHBondContact O-N 3.22Å; M358-S362 PolarHBondContact O-OG 3.04Å; M358-F401 HydrophobicContact CB-CE2 4.37Å; M358-F401 HydrophobicContact CE-CB 4.39Å; M358-F401 HydrophobicContact CE-CD1 4.25Å; M358-F401 HydrophobicContact CE-CD2 4.09Å; M358-F401 HydrophobicContact CE-CE2 4.41Å; M358-F401 HydrophobicContact CE-CG 3.99Å; M358-F401 WeakPolarHBondContact O-CE2 3.49Å; M358-L404 HydrophobicContact CE-CB 3.55Å; M358-L404 HydrophobicContact CE-CD1 3.42Å; M358-L404 VanDerWaalsContact CE-CD1 3.42Å; M358-L404 HydrophobicContact CE-CG 4.14Å; M358-L404 HydrophobicContact SD-CB 4.3Å; M358-F405 HydrophobicContact CB-CE1 4.07Å; M358-F405 HydrophobicContact CE-CD1 4.25Å; M358-F405 HydrophobicContact CE-CE1 3.99Å; M358-F405 HydrophobicContact SD-CD1 4.12Å; M358-F405 HydrophobicContact SD-CE1 3.92Å
359	M	90.1	Very high	88.6	Confident	28 Å²	28	54.9 Å²	54.9	14%	0.138	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-42.3	178.5	-69.1	172.8	74.5	0	0	112.3	I355 L356 S362 T363 F405 V429 L433	I355-M359 HydrophobicContact CG2-CG 4.48Å; I355-M359 HydrophobicContact CG2-SD 3.92Å; I355-M359 VanDerWaalsContact O-CG 3.28Å; I355-M359 WeakPolarHBondContact O-CG 3.44Å; I355-M359 PolarHBondContact O-N 3.46Å; L356-M359 PolarHBondContact O-N 3.15Å; M359-S362 WeakPolarHBondContact CA-OG 3.36Å; M359-S362 PolarHBondContact O-N 3.39Å; M359-S362 PolarHBondContact O-OG 3.32Å; M359-T363 PolarHBondContact O-N 3.29Å; M359-T363 PolarHBondContact O-OG1 2.83Å; M359-F405 HydrophobicContact CG-CZ 4.19Å; M359-V429 HydrophobicContact CE-CB 3.93Å; M359-V429 HydrophobicContact CE-CG1 3.31Å; M359-L433 HydrophobicContact CE-CD1 3.48Å; M359-L433 VanDerWaalsContact CE-CD1 3.48Å
360	A	90.9	Very high	87.9	Confident	54 Å²	54	50.8 Å²	50.8	45%	0.446	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-43.1	174	0	0	0	0	0	111.5	L356 S357 M358 S362 T363 Y364	L356-A360 PolarHBondContact O-N 3.04Å; S357-A360 PolarHBondContact O-N 2.99Å; M358-A360 PolarHBondContact O-N 3.31Å; A360-S362 VanDerWaalsContact C-N 3.35Å; A360-S362 PolarHBondContact O-N 3.36Å; A360-T363 PolarHBondContact O-N 3.35Å; A360-Y364 WeakPolarHBondContact O-CB 3.34Å; A360-Y364 PolarHBondContact O-N 3.02Å
361	S	90.6	Very high	87.2	Confident	55 Å²	55	51.9 Å²	51.9	39%	0.385	27%	0.274	S	S	.	.	H	α-helix	trans	-63.5	-36.2	177.5	71.3	0	0	0	0	113.2	S357 M358 A365	S357-S361 WeakPolarHBondContact O-CB 3.38Å; S357-S361 PolarHBondContact O-N 3.21Å; S357-S361 PolarHBondContact O-OG 2.67Å; M358-S361 WeakPolarHBondContact CA-OG 3.31Å; M358-S361 PolarHBondContact O-N 3.16Å; M358-S361 PolarHBondContact O-OG 2.96Å; S361-A365 VanDerWaalsContact O-CB 3.22Å; S361-A365 WeakPolarHBondContact O-CB 3.28Å; S361-A365 PolarHBondContact O-N 3.12Å
362	S	90.6	Very high	86.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-44.4	174.9	37.6	0	0	0	0	111.9	M358 M359 A360 Y364 A365 I366 F401 L430	M358-S362 PolarHBondContact O-N 3.22Å; M358-S362 PolarHBondContact O-OG 3.04Å; M359-S362 WeakPolarHBondContact CA-OG 3.36Å; M359-S362 PolarHBondContact O-N 3.39Å; M359-S362 PolarHBondContact O-OG 3.32Å; A360-S362 VanDerWaalsContact C-N 3.35Å; A360-S362 PolarHBondContact O-N 3.36Å; S362-Y364 VanDerWaalsContact C-N 3.35Å; S362-A365 PolarHBondContact O-N 3.15Å; S362-I366 VanDerWaalsContact O-CG1 3.27Å; S362-I366 WeakPolarHBondContact O-CG1 3.05Å; S362-I366 PolarHBondContact O-N 2.89Å; S362-F401 VanDerWaalsContact CB-CE2 3.46Å; S362-L430 VanDerWaalsContact OG-CD1 3.28Å; S362-L430 WeakPolarHBondContact OG-CD1 3.16Å
363	T	87.2	Confident	85.5	Confident	45 Å²	45	56.3 Å²	56.3	28%	0.276	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-43.7	178.7	-66.8	0	0	0	0	111.1	M359 A360 Y367 T437	M359-T363 PolarHBondContact O-N 3.29Å; M359-T363 PolarHBondContact O-OG1 2.83Å; A360-T363 PolarHBondContact O-N 3.35Å; T363-Y367 WeakPolarHBondContact O-CB 3.21Å; T363-Y367 PolarHBondContact O-N 3.18Å; T363-Y367 VanDerWaalsContact O-N 3.09Å; T363-T437 HydrophobicContact CG2-CG2 3.52Å
364	Y	90	Very high	84.2	Confident	163 Å²	163	51 Å²	51	64%	0.639	26%	0.264	S	S	*	.	H	α-helix	trans	-62.1	-50.1	175.8	-179	-102	0	0	0	111.8	A360 S362 I366 Y367 T368	A360-Y364 WeakPolarHBondContact O-CB 3.34Å; A360-Y364 PolarHBondContact O-N 3.02Å; S362-Y364 VanDerWaalsContact C-N 3.35Å; Y364-I366 VanDerWaalsContact C-N 3.34Å; Y364-I366 PolarHBondContact O-N 2.89Å; Y364-Y367 PolarHBondContact O-N 3.11Å; Y364-Y367 VanDerWaalsContact O-N 3.14Å; Y364-T368 HydrophobicContact CD1-CG2 4.14Å; Y364-T368 HydrophobicContact CD2-CG2 4.15Å; Y364-T368 HydrophobicContact CE1-CG2 3.72Å; Y364-T368 HydrophobicContact CE2-CG2 3.73Å; Y364-T368 HydrophobicContact CG-CG2 4.35Å; Y364-T368 VanDerWaalsContact CZ-CG2 3.5Å; Y364-T368 WeakPolarHBondContact O-CG2 3.48Å; Y364-T368 PolarHBondContact O-N 3.38Å; Y364-T368 PolarHBondContact O-OG1 3.12Å
365	A	88.8	Confident	82.8	Confident	29 Å²	29	53.1 Å²	53.1	24%	0.24	28%	0.276	C	S	.	.	H	α-helix	trans	-58.7	-43.3	-179.9	0	0	0	0	0	112.4	S361 S362 T368 V369 V393 I397	S361-A365 VanDerWaalsContact O-CB 3.22Å; S361-A365 WeakPolarHBondContact O-CB 3.28Å; S361-A365 PolarHBondContact O-N 3.12Å; S362-A365 PolarHBondContact O-N 3.15Å; A365-T368 PolarHBondContact O-OG1 3.07Å; A365-T368 VanDerWaalsContact O-OG1 3.09Å; A365-V369 VanDerWaalsContact O-CB 3.24Å; A365-V369 WeakPolarHBondContact O-CB 3.27Å; A365-V369 WeakPolarHBondContact O-CG2 3.22Å; A365-V369 PolarHBondContact O-N 3.14Å; A365-V393 HydrophobicContact CB-CG1 4.46Å; A365-I397 HydrophobicContact CB-CD1 4.26Å
366	I	84.9	Confident	81.3	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-44.2	177	-66.5	168.5	0	0	0	110.5	S362 Y364 V370 V394 I397 N434	S362-I366 VanDerWaalsContact O-CG1 3.27Å; S362-I366 WeakPolarHBondContact O-CG1 3.05Å; S362-I366 PolarHBondContact O-N 2.89Å; Y364-I366 VanDerWaalsContact C-N 3.34Å; Y364-I366 PolarHBondContact O-N 2.89Å; I366-V370 HydrophobicContact CG2-CG2 4.4Å; I366-V370 WeakPolarHBondContact O-CB 3.05Å; I366-V370 WeakPolarHBondContact O-CG2 3.32Å; I366-V370 PolarHBondContact O-N 3.21Å; I366-V394 HydrophobicContact CD1-CG2 4.35Å; I366-V394 HydrophobicContact CG1-CG2 4.1Å; I366-V394 HydrophobicContact CG2-CG2 4.46Å; I366-I397 HydrophobicContact CD1-CD1 4.38Å; I366-I397 HydrophobicContact CG1-CD1 4.01Å; I366-N434 HydrophobicContact CD1-CB 3.78Å; I366-N434 WeakPolarHBondContact CD1-OD1 3.19Å
367	Y	83.9	Confident	79.6	Confident	95 Å²	95	52.6 Å²	52.6	37%	0.373	27%	0.271	S	S	.	.	H	α-helix	trans	-62.1	-50.5	179.5	-179.9	-96.8	0	0	0	112.1	T363 Y364 V369 V370 E371	T363-Y367 WeakPolarHBondContact O-CB 3.21Å; T363-Y367 PolarHBondContact O-N 3.18Å; T363-Y367 VanDerWaalsContact O-N 3.09Å; Y364-Y367 PolarHBondContact O-N 3.11Å; Y364-Y367 VanDerWaalsContact O-N 3.14Å; Y367-V369 VanDerWaalsContact C-N 3.34Å; Y367-V369 PolarHBondContact O-N 3.37Å; Y367-V370 PolarHBondContact O-N 3.4Å; Y367-E371 WeakPolarHBondContact CE1-OE2 3.34Å; Y367-E371 WeakPolarHBondContact O-CB 3.29Å; Y367-E371 PolarHBondContact O-N 3.06Å
368	T	83.9	Confident	77.7	Confident	45 Å²	45	53.9 Å²	53.9	28%	0.276	27%	0.269	S	S	.	.	H	α-helix	trans	-64.4	-38.2	-178.6	55.5	0	0	0	0	112.6	Y364 A365 E371 R372	Y364-T368 HydrophobicContact CD1-CG2 4.14Å; Y364-T368 HydrophobicContact CD2-CG2 4.15Å; Y364-T368 HydrophobicContact CE1-CG2 3.72Å; Y364-T368 HydrophobicContact CE2-CG2 3.73Å; Y364-T368 HydrophobicContact CG-CG2 4.35Å; Y364-T368 VanDerWaalsContact CZ-CG2 3.5Å; Y364-T368 WeakPolarHBondContact O-CG2 3.48Å; Y364-T368 PolarHBondContact O-N 3.38Å; Y364-T368 PolarHBondContact O-OG1 3.12Å; A365-T368 PolarHBondContact O-OG1 3.07Å; A365-T368 VanDerWaalsContact O-OG1 3.09Å; T368-E371 PolarHBondContact O-N 2.73Å; T368-R372 WeakPolarHBondContact O-CB 3.22Å; T368-R372 PolarHBondContact O-N 2.8Å
369	V	81.5	Confident	76	Confident	12 Å²	12	56.6 Å²	56.6	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-70.5	-37.8	179.9	172.9	0	0	0	0	110.4	A365 Y367 S373 E389 V390 V393	A365-V369 VanDerWaalsContact O-CB 3.24Å; A365-V369 WeakPolarHBondContact O-CB 3.27Å; A365-V369 WeakPolarHBondContact O-CG2 3.22Å; A365-V369 PolarHBondContact O-N 3.14Å; Y367-V369 VanDerWaalsContact C-N 3.34Å; Y367-V369 PolarHBondContact O-N 3.37Å; V369-S373 WeakPolarHBondContact O-CB 3.4Å; V369-S373 PolarHBondContact O-N 2.92Å; V369-E389 HydrophobicContact CG1-CB 3.99Å; V369-E389 HydrophobicContact CG1-CG 3.57Å; V369-E389 HydrophobicContact CG2-CG 4.49Å; V369-V390 HydrophobicContact CG1-CB 4.24Å; V369-V390 HydrophobicContact CG1-CG2 3.67Å; V369-V393 HydrophobicContact CG1-CB 4.49Å; V369-V393 HydrophobicContact CG1-CG2 4.29Å; V369-V393 HydrophobicContact CG2-CB 4.49Å; V369-V393 HydrophobicContact CG2-CG1 4.31Å; V369-V393 HydrophobicContact CG2-CG2 4.08Å
370	V	73.5	Confident	74	Confident	4 Å²	4	63.6 Å²	63.6	2%	0.024	32%	0.321	C	S	.	.	H	α-helix	trans	-70.4	-38.1	175	177.4	0	0	0	0	111.5	I366 Y367 S373 R374 V390 A441	I366-V370 HydrophobicContact CG2-CG2 4.4Å; I366-V370 WeakPolarHBondContact O-CB 3.05Å; I366-V370 WeakPolarHBondContact O-CG2 3.32Å; I366-V370 PolarHBondContact O-N 3.21Å; Y367-V370 PolarHBondContact O-N 3.4Å; V370-S373 WeakPolarHBondContact CA-OG 3.29Å; V370-S373 WeakPolarHBondContact O-CB 3.25Å; V370-S373 PolarHBondContact O-N 2.94Å; V370-S373 PolarHBondContact O-OG 3.43Å; V370-R374 PolarHBondContact O-N 3Å; V370-V390 HydrophobicContact CB-CG2 4.4Å; V370-V390 HydrophobicContact CG2-CG1 3.84Å; V370-V390 HydrophobicContact CG2-CG2 3.81Å; V370-A441 HydrophobicContact CB-CB 3.64Å; V370-A441 HydrophobicContact CG1-CB 3.41Å; V370-A441 VanDerWaalsContact CG1-CB 3.41Å; V370-A441 HydrophobicContact CG2-CB 3.82Å
371	E	74.8	Confident	72.2	Confident	71 Å²	71	66.5 Å²	66.5	33%	0.332	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-49.2	174.7	-174.7	145	-109.4	0	0	111.6	Y367 T368 S373 R374	Y367-E371 WeakPolarHBondContact CE1-OE2 3.34Å; Y367-E371 WeakPolarHBondContact O-CB 3.29Å; Y367-E371 PolarHBondContact O-N 3.06Å; T368-E371 PolarHBondContact O-N 2.73Å; E371-S373 PolarHBondContact O-N 3.38Å; E371-R374 WeakPolarHBondContact O-CB 3.3Å; E371-R374 WeakPolarHBondContact O-CG 3.39Å; E371-R374 PolarHBondContact O-N 3.01Å; E371-R374 IonicContact OE1-NH1 2.74Å; E371-R374 PolarHBondContact OE1-NH1 3.45Å
372	R	75.2	Confident	70.7	Confident	146 Å²	146	64.2 Å²	64.2	55%	0.551	32%	0.318	S	S	*	.	H	α-helix	trans	-58.9	-34.1	173.2	174.4	174.7	-82.8	161.8	-5.3	112.5	T368 R374 D375 I376	T368-R372 WeakPolarHBondContact O-CB 3.22Å; T368-R372 PolarHBondContact O-N 2.8Å; R372-R374 PolarHBondContact O-N 3.02Å; R372-D375 PolarHBondContact O-N 2.83Å; R372-I376 HydrophobicContact CG-CD1 3.61Å; R372-I376 HydrophobicContact CG-CG1 4.27Å; R372-I376 WeakPolarHBondContact O-CD1 3.45Å; R372-I376 VanDerWaalsContact O-CG1 3.32Å; R372-I376 WeakPolarHBondContact O-CG1 3.41Å; R372-I376 PolarHBondContact O-N 3.26Å
373	S	66.5	Low	69.5	Low	21 Å²	21	68.4 Å²	68.4	15%	0.147	34%	0.344	C	S	.	.	H	α-helix	trans	-67.6	-11.7	175.1	82.5	0	0	0	0	114.1	V369 V370 E371 K445	V369-S373 WeakPolarHBondContact O-CB 3.4Å; V369-S373 PolarHBondContact O-N 2.92Å; V370-S373 WeakPolarHBondContact CA-OG 3.29Å; V370-S373 WeakPolarHBondContact O-CB 3.25Å; V370-S373 PolarHBondContact O-N 2.94Å; V370-S373 PolarHBondContact O-OG 3.43Å; E371-S373 PolarHBondContact O-N 3.38Å; S373-K445 PolarHBondContact O-NZ 3.41Å
374	R	63.4	Low	68.1	Low	33 Å²	33	68 Å²	68	13%	0.125	35%	0.345	C	S	.	.	H	α-helix	trans	-76.5	-44.9	170.3	-55	-172.1	-167	123.8	3.3	110.4	V370 E371 R372 T444 K445	V370-R374 PolarHBondContact O-N 3Å; E371-R374 WeakPolarHBondContact O-CB 3.3Å; E371-R374 WeakPolarHBondContact O-CG 3.39Å; E371-R374 PolarHBondContact O-N 3.01Å; E371-R374 IonicContact OE1-NH1 2.74Å; E371-R374 PolarHBondContact OE1-NH1 3.45Å; R372-R374 PolarHBondContact O-N 3.02Å; R374-T444 PolarHBondContact NH2-OG1 2.95Å; R374-K445 HydrophobicContact CG-CB 4.24Å; R374-K445 HydrophobicContact CG-CD 4.38Å; R374-K445 HydrophobicContact CG-CG 4.16Å
375	D	61.5	Low	67	Low	109 Å²	109	66 Å²	66	58%	0.583	34%	0.344	S	S	*	.	H	α-helix	trans	-69.2	-37.2	-176.2	-51.7	-27.6	0	0	0	112	R372 E377	R372-D375 PolarHBondContact O-N 2.83Å; D375-E377 VanDerWaalsContact C-N 3.28Å; D375-E377 PolarHBondContact O-N 3.32Å
376	I	57.6	Low	65.9	Low	22 Å²	22	68.4 Å²	68.4	11%	0.113	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-67.2	-27.2	-176.7	-66.9	162.1	0	0	0	112.5	R372 H378 D379 A382 Q386 K387	R372-I376 HydrophobicContact CG-CD1 3.61Å; R372-I376 HydrophobicContact CG-CG1 4.27Å; R372-I376 WeakPolarHBondContact O-CD1 3.45Å; R372-I376 VanDerWaalsContact O-CG1 3.32Å; R372-I376 WeakPolarHBondContact O-CG1 3.41Å; R372-I376 PolarHBondContact O-N 3.26Å; I376-H378 PolarHBondContact O-N 2.97Å; I376-D379 PolarHBondContact O-N 2.92Å; I376-A382 HydrophobicContact CG2-CB 3.39Å; I376-Q386 HydrophobicContact CD1-CB 4.05Å; I376-Q386 HydrophobicContact CG2-CB 4.37Å; I376-K387 HydrophobicContact CG2-CG 4.44Å
377	E	53.9	Low	64.9	Low	75 Å²	75	71.5 Å²	71.5	35%	0.35	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-68.1	-22.4	-174.1	-164	158.6	-166	0	0	112.9	D375 K445 T669	D375-E377 VanDerWaalsContact C-N 3.28Å; D375-E377 PolarHBondContact O-N 3.32Å; E377-K445 WeakPolarHBondContact OE2-CE 3.38Å; E377-K445 IonicContact OE2-NZ 2.79Å; E377-K445 PolarHBondContact OE2-NZ 3.35Å; E377-T669 VanDerWaalsContact OE1-CG2 3.31Å; E377-T669 WeakPolarHBondContact OE1-CG2 3.25Å
378	H	52.5	Low	64.3	Low	97 Å²	97	67.8 Å²	67.8	45%	0.449	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-84	-11.2	173.9	-81	-78.8	0	0	0	114	I376 F491	I376-H378 PolarHBondContact O-N 2.97Å; H378-F491 AromaticContact CE1-CE1 3.51Å; H378-F491 AromaticContact CE1-CZ 3.63Å; H378-F491 AromaticContact ND1-CE1 3.64Å; H378-F491 AromaticContact ND1-CZ 3.94Å
379	D	54.1	Low	64.1	Low	83 Å²	83	67.6 Å²	67.6	44%	0.444	35%	0.347	S	S	.	.			trans	-99.2	111.3	-174.9	-157.9	23.2	0	0	0	112	I376 T381 A382	I376-D379 PolarHBondContact O-N 2.92Å; D379-T381 PolarHBondContact O-N 3.43Å; D379-T381 PolarHBondContact OD1-OG1 3.06Å; D379-T381 VanDerWaalsContact OD1-OG1 3.05Å; D379-T381 PolarHBondContact OD2-OG1 2.94Å; D379-T381 VanDerWaalsContact OD2-OG1 3.08Å; D379-A382 WeakPolarHBondContact O-CB 3.34Å; D379-A382 PolarHBondContact O-N 3.12Å
380	L	49.7	Very low	63.8	Low	174 Å²	174	67.9 Å²	67.9	91%	0.911	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.3	-179.4	-159.3	73.8	0	0	0	111.8
381	T	51.3	Low	63.8	Low	116 Å²	116	67.8 Å²	67.8	71%	0.712	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	2.3	180	40.6	0	0	0	0	115.1	D379 T383	D379-T381 PolarHBondContact O-N 3.43Å; D379-T381 PolarHBondContact OD1-OG1 3.06Å; D379-T381 VanDerWaalsContact OD1-OG1 3.05Å; D379-T381 PolarHBondContact OD2-OG1 2.94Å; D379-T381 VanDerWaalsContact OD2-OG1 3.08Å; T381-T383 PolarHBondContact O-N 3.14Å
382	A	59.2	Low	64	Low	7 Å²	7	67 Å²	67	6%	0.058	35%	0.346	C	S	.	.			trans	-61.9	128.5	-178.9	0	0	0	0	0	112.9	I376 D379	I376-A382 HydrophobicContact CG2-CB 3.39Å; D379-A382 WeakPolarHBondContact O-CB 3.34Å; D379-A382 PolarHBondContact O-N 3.12Å
383	T	65.7	Low	64.5	Low	88 Å²	88	61.6 Å²	61.6	54%	0.54	33%	0.329	S	S	.	.			trans	-64.6	142.5	-180	-56.7	0	0	0	0	110	T381 L385 Q386 K387	T381-T383 PolarHBondContact O-N 3.14Å; T383-L385 HydrophobicContact CG2-CB 4.32Å; T383-L385 PolarHBondContact O-N 3.48Å; T383-Q386 VanDerWaalsContact N-OE1 3.16Å; T383-Q386 WeakPolarHBondContact O-CB 3.15Å; T383-Q386 PolarHBondContact O-N 3.29Å; T383-K387 PolarHBondContact O-N 3.42Å
384	A	59.2	Low	65.2	Low	35 Å²	35	61.1 Å²	61.1	29%	0.289	33%	0.325	S	S	.	.	H	α-helix	trans	-48.5	-35.5	179.2	0	0	0	0	0	113.3	Q189 K387 I388	Q189-A384 HydrophobicContact CG-CB 4.19Å; A384-K387 PolarHBondContact O-N 3.44Å; A384-I388 VanDerWaalsContact O-CD1 3.3Å; A384-I388 WeakPolarHBondContact O-CD1 3.4Å; A384-I388 VanDerWaalsContact O-CG1 3.31Å; A384-I388 WeakPolarHBondContact O-CG1 3.47Å
385	L	65.2	Low	66	Low	121 Å²	121	59.6 Å²	59.6	63%	0.634	32%	0.319	S	S	*	.	H	α-helix	trans	-66.7	-35.6	178.4	-169.6	137.9	0	0	0	113.5	T383 K387 I388 E389	T383-L385 HydrophobicContact CG2-CB 4.32Å; T383-L385 PolarHBondContact O-N 3.48Å; L385-K387 VanDerWaalsContact C-N 3.33Å; L385-I388 PolarHBondContact O-N 3.05Å; L385-E389 PolarHBondContact O-N 3.39Å
386	Q	67.5	Low	67.1	Low	81 Å²	81	59.6 Å²	59.6	38%	0.379	31%	0.314	S	S	.	.	H	α-helix	trans	-67.7	-34.9	177.7	-71.3	174.8	-30.5	0	0	111.5	I376 T383 I388 E389	I376-Q386 HydrophobicContact CD1-CB 4.05Å; I376-Q386 HydrophobicContact CG2-CB 4.37Å; T383-Q386 VanDerWaalsContact N-OE1 3.16Å; T383-Q386 WeakPolarHBondContact O-CB 3.15Å; T383-Q386 PolarHBondContact O-N 3.29Å; Q386-I388 PolarHBondContact O-N 3.11Å; Q386-E389 VanDerWaalsContact O-CB 3.31Å; Q386-E389 WeakPolarHBondContact O-CB 3.29Å; Q386-E389 PolarHBondContact O-N 3.35Å
387	K	62.7	Low	68.5	Low	67 Å²	67	58.9 Å²	58.9	29%	0.291	31%	0.31	S	S	.	.	H	α-helix	trans	-68.5	-21	176.1	-64.3	-179.5	-178.7	173.9	0	113.1	I376 T383 A384 L385	I376-K387 HydrophobicContact CG2-CG 4.44Å; T383-K387 PolarHBondContact O-N 3.42Å; A384-K387 PolarHBondContact O-N 3.44Å; L385-K387 VanDerWaalsContact C-N 3.33Å
388	I	70.4	Confident	69.9	Low	17 Å²	17	55.4 Å²	55.4	9%	0.087	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	4.9	-177.3	-51.6	161.4	0	0	0	111	A384 L385 Q386 V390 P391 I392 M680	A384-I388 VanDerWaalsContact O-CD1 3.3Å; A384-I388 WeakPolarHBondContact O-CD1 3.4Å; A384-I388 VanDerWaalsContact O-CG1 3.31Å; A384-I388 WeakPolarHBondContact O-CG1 3.47Å; L385-I388 PolarHBondContact O-N 3.05Å; Q386-I388 PolarHBondContact O-N 3.11Å; I388-V390 PolarHBondContact O-N 3.19Å; I388-P391 WeakPolarHBondContact O-CD 3.18Å; I388-I392 HydrophobicContact CB-CD1 3.91Å; I388-I392 HydrophobicContact CG2-CD1 3.58Å; I388-I392 HydrophobicContact CG2-CG1 3.84Å; I388-I392 WeakPolarHBondContact O-CB 3.16Å; I388-I392 WeakPolarHBondContact O-CD1 3.34Å; I388-I392 WeakPolarHBondContact O-CG1 3.48Å; I388-I392 PolarHBondContact O-N 2.89Å; I388-I392 VanDerWaalsContact O-N 3.1Å; I388-M680 HydrophobicContact CB-CE 4.4Å; I388-M680 HydrophobicContact CD1-CE 4.14Å; I388-M680 HydrophobicContact CG1-CE 4.08Å; I388-M680 HydrophobicContact CG2-CE 3.33Å; I388-M680 HydrophobicContact CG2-CG 3.7Å; I388-M680 HydrophobicContact CG2-SD 3.47Å; I388-M680 WeakPolarHBondContact CG2-SD 3.34Å
389	E	80.4	Confident	71.1	Confident	40 Å²	40	51.6 Å²	51.6	19%	0.187	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-46.6	-173.5	-164.4	-175	168.5	0	0	112.3	V369 L385 Q386 I392 V393	V369-E389 HydrophobicContact CG1-CB 3.99Å; V369-E389 HydrophobicContact CG1-CG 3.57Å; V369-E389 HydrophobicContact CG2-CG 4.49Å; L385-E389 PolarHBondContact O-N 3.39Å; Q386-E389 VanDerWaalsContact O-CB 3.31Å; Q386-E389 WeakPolarHBondContact O-CB 3.29Å; Q386-E389 PolarHBondContact O-N 3.35Å; E389-I392 PolarHBondContact O-N 3.44Å; E389-V393 HydrophobicContact CG-CG2 4.26Å; E389-V393 WeakPolarHBondContact O-CB 3.48Å; E389-V393 VanDerWaalsContact O-CG2 3.27Å; E389-V393 WeakPolarHBondContact O-CG2 3.29Å; E389-V393 PolarHBondContact O-N 2.61Å
390	V	75.4	Confident	72.6	Confident	18 Å²	18	49.8 Å²	49.8	11%	0.109	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-56.7	-178.8	172.4	0	0	0	0	111.5	V369 V370 I388 I392 V393 V394 L438	V369-V390 HydrophobicContact CG1-CB 4.24Å; V369-V390 HydrophobicContact CG1-CG2 3.67Å; V370-V390 HydrophobicContact CB-CG2 4.4Å; V370-V390 HydrophobicContact CG2-CG1 3.84Å; V370-V390 HydrophobicContact CG2-CG2 3.81Å; I388-V390 PolarHBondContact O-N 3.19Å; V390-I392 VanDerWaalsContact C-N 3.34Å; V390-I392 PolarHBondContact O-N 3.37Å; V390-V393 PolarHBondContact O-N 3.36Å; V390-V394 HydrophobicContact CG1-CG2 4.49Å; V390-V394 VanDerWaalsContact O-CG2 3.3Å; V390-V394 WeakPolarHBondContact O-CG2 3.35Å; V390-V394 PolarHBondContact O-N 3.29Å; V390-L438 HydrophobicContact CG1-CD1 4.22Å
391	P	72.9	Confident	74.4	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.013	23%	0.23	C	C	.	.	H	α-helix	trans	-56	-42.5	175	-29.3	34.3	0	0	0	115.1	I388 S395 K676 L677 M680	I388-P391 WeakPolarHBondContact O-CD 3.18Å; P391-S395 VanDerWaalsContact O-CB 3.3Å; P391-S395 WeakPolarHBondContact O-CB 3.39Å; P391-S395 PolarHBondContact O-N 3.28Å; P391-S395 PolarHBondContact O-OG 3.25Å; P391-K676 HydrophobicContact CG-CB 4.46Å; P391-L677 HydrophobicContact CB-CD1 3.97Å; P391-L677 HydrophobicContact CG-CB 4.48Å; P391-L677 HydrophobicContact CG-CD1 4.35Å; P391-M680 HydrophobicContact CB-CB 3.55Å; P391-M680 HydrophobicContact CB-CG 3.54Å; P391-M680 HydrophobicContact CG-CG 4.24Å
392	I	80.8	Confident	76	Confident	56 Å²	56	37 Å²	37	29%	0.287	20%	0.197	S	C	.	.	H	α-helix	trans	-63.6	-48.4	-178.4	-74.4	162.2	0	0	0	110.2	I388 E389 V390 S395 F396	I388-I392 HydrophobicContact CB-CD1 3.91Å; I388-I392 HydrophobicContact CG2-CD1 3.58Å; I388-I392 HydrophobicContact CG2-CG1 3.84Å; I388-I392 WeakPolarHBondContact O-CB 3.16Å; I388-I392 WeakPolarHBondContact O-CD1 3.34Å; I388-I392 WeakPolarHBondContact O-CG1 3.48Å; I388-I392 PolarHBondContact O-N 2.89Å; I388-I392 VanDerWaalsContact O-N 3.1Å; E389-I392 PolarHBondContact O-N 3.44Å; V390-I392 VanDerWaalsContact C-N 3.34Å; V390-I392 PolarHBondContact O-N 3.37Å; I392-S395 PolarHBondContact O-N 3.4Å; I392-F396 WeakPolarHBondContact O-CB 3.07Å; I392-F396 PolarHBondContact O-N 2.99Å
393	V	85	Confident	77	Confident	32 Å²	32	39.6 Å²	39.6	19%	0.194	21%	0.209	C	C	.	.	H	α-helix	trans	-64.5	-45.3	-178.1	171.7	0	0	0	0	110.7	A365 V369 E389 V390 F396 I397	A365-V393 HydrophobicContact CB-CG1 4.46Å; V369-V393 HydrophobicContact CG1-CB 4.49Å; V369-V393 HydrophobicContact CG1-CG2 4.29Å; V369-V393 HydrophobicContact CG2-CB 4.49Å; V369-V393 HydrophobicContact CG2-CG1 4.31Å; V369-V393 HydrophobicContact CG2-CG2 4.08Å; E389-V393 HydrophobicContact CG-CG2 4.26Å; E389-V393 WeakPolarHBondContact O-CB 3.48Å; E389-V393 VanDerWaalsContact O-CG2 3.27Å; E389-V393 WeakPolarHBondContact O-CG2 3.29Å; E389-V393 PolarHBondContact O-N 2.61Å; V390-V393 PolarHBondContact O-N 3.36Å; V393-F396 PolarHBondContact O-N 3.23Å; V393-I397 HydrophobicContact CG1-CD1 3.63Å; V393-I397 HydrophobicContact CG1-CG1 4.34Å; V393-I397 WeakPolarHBondContact O-CB 3.36Å; V393-I397 WeakPolarHBondContact O-CD1 3.32Å; V393-I397 WeakPolarHBondContact O-CG1 3.46Å; V393-I397 PolarHBondContact O-N 2.87Å
394	V	81.9	Confident	77.9	Confident	11 Å²	11	39 Å²	39	7%	0.067	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-49.8	178.1	173.6	0	0	0	0	110.8	I366 V390 F396 I397 T398 L677	I366-V394 HydrophobicContact CD1-CG2 4.35Å; I366-V394 HydrophobicContact CG1-CG2 4.1Å; I366-V394 HydrophobicContact CG2-CG2 4.46Å; V390-V394 HydrophobicContact CG1-CG2 4.49Å; V390-V394 VanDerWaalsContact O-CG2 3.3Å; V390-V394 WeakPolarHBondContact O-CG2 3.35Å; V390-V394 PolarHBondContact O-N 3.29Å; V394-F396 PolarHBondContact O-N 3.5Å; V394-I397 PolarHBondContact O-N 3.46Å; V394-T398 WeakPolarHBondContact O-CG2 3.16Å; V394-T398 PolarHBondContact O-N 3.22Å; V394-T398 PolarHBondContact O-OG1 3.07Å; V394-L677 HydrophobicContact CB-CD1 4.23Å; V394-L677 HydrophobicContact CG1-CD1 4.26Å
395	S	79.1	Confident	79.3	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-41.9	179	-69.3	0	0	0	0	112	P391 I392 T398 L399 D681	P391-S395 VanDerWaalsContact O-CB 3.3Å; P391-S395 WeakPolarHBondContact O-CB 3.39Å; P391-S395 PolarHBondContact O-N 3.28Å; P391-S395 PolarHBondContact O-OG 3.25Å; I392-S395 PolarHBondContact O-N 3.4Å; S395-T398 PolarHBondContact O-N 3.27Å; S395-T398 PolarHBondContact O-OG1 3.44Å; S395-L399 WeakPolarHBondContact O-CD1 3.02Å; S395-L399 VanDerWaalsContact O-CG 3.28Å; S395-L399 WeakPolarHBondContact O-CG 3.41Å; S395-L399 PolarHBondContact O-N 3.46Å; S395-L399 VanDerWaalsContact O-N 3.11Å; S395-D681 VanDerWaalsContact OG-CA 3.23Å; S395-D681 WeakPolarHBondContact OG-CA 3.24Å; S395-D681 WeakPolarHBondContact OG-CB 3.12Å; S395-D681 PolarHBondContact OG-OD1 3.35Å
396	F	84.3	Confident	79.9	Confident	108 Å²	108	33.5 Å²	33.5	47%	0.474	17%	0.167	S	C	.	.	H	α-helix	trans	-59.7	-48.9	176.2	-179.1	-96.8	0	0	0	112.1	I392 V393 V394 T398 L399 V400 M684	I392-F396 WeakPolarHBondContact O-CB 3.07Å; I392-F396 PolarHBondContact O-N 2.99Å; V393-F396 PolarHBondContact O-N 3.23Å; V394-F396 PolarHBondContact O-N 3.5Å; F396-T398 VanDerWaalsContact C-N 3.32Å; F396-T398 PolarHBondContact O-N 2.95Å; F396-L399 PolarHBondContact O-N 2.99Å; F396-L399 VanDerWaalsContact O-N 3.12Å; F396-V400 HydrophobicContact CD1-CG2 4.27Å; F396-V400 HydrophobicContact CD2-CG2 3.92Å; F396-V400 HydrophobicContact CE1-CB 4.36Å; F396-V400 HydrophobicContact CE1-CG2 3.98Å; F396-V400 HydrophobicContact CE2-CG2 3.62Å; F396-V400 HydrophobicContact CG-CG2 4.24Å; F396-V400 HydrophobicContact CZ-CB 4.43Å; F396-V400 HydrophobicContact CZ-CG2 3.66Å; F396-V400 WeakPolarHBondContact O-CB 3.36Å; F396-V400 WeakPolarHBondContact O-CG2 3.21Å; F396-V400 PolarHBondContact O-N 3.32Å; F396-M684 HydrophobicContact CB-CE 4.29Å; F396-M684 HydrophobicContact CD2-CE 4.38Å
397	I	87.6	Confident	80.5	Confident	7 Å²	7	33.4 Å²	33.4	4%	0.036	17%	0.168	C	C	.	.	H	α-helix	trans	-57.5	-47.5	176.8	-70.8	166.5	0	0	0	110.2	A365 I366 V393 V394 L399 F401 L430 N434	A365-I397 HydrophobicContact CB-CD1 4.26Å; I366-I397 HydrophobicContact CD1-CD1 4.38Å; I366-I397 HydrophobicContact CG1-CD1 4.01Å; V393-I397 HydrophobicContact CG1-CD1 3.63Å; V393-I397 HydrophobicContact CG1-CG1 4.34Å; V393-I397 WeakPolarHBondContact O-CB 3.36Å; V393-I397 WeakPolarHBondContact O-CD1 3.32Å; V393-I397 WeakPolarHBondContact O-CG1 3.46Å; V393-I397 PolarHBondContact O-N 2.87Å; V394-I397 PolarHBondContact O-N 3.46Å; I397-L399 PolarHBondContact O-N 3.02Å; I397-F401 HydrophobicContact CB-CD1 4.46Å; I397-F401 HydrophobicContact CB-CE1 4.38Å; I397-F401 HydrophobicContact CG1-CE1 4.13Å; I397-F401 HydrophobicContact CG1-CZ 4.26Å; I397-F401 HydrophobicContact CG2-CD1 4.05Å; I397-F401 HydrophobicContact CG2-CD2 3.86Å; I397-F401 HydrophobicContact CG2-CE1 4.09Å; I397-F401 HydrophobicContact CG2-CE2 3.91Å; I397-F401 HydrophobicContact CG2-CG 3.94Å; I397-F401 HydrophobicContact CG2-CZ 4.02Å; I397-F401 VanDerWaalsContact O-CB 3.27Å; I397-F401 WeakPolarHBondContact O-CB 3.46Å; I397-F401 WeakPolarHBondContact O-CG 3.3Å; I397-F401 PolarHBondContact O-N 3.1Å; I397-F401 VanDerWaalsContact O-N 3.09Å; I397-L430 HydrophobicContact CG2-CD1 4.43Å; I397-N434 WeakPolarHBondContact CG2-ND2 3.47Å
398	T	83.1	Confident	81.6	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-63	-26.4	-179	62.2	0	0	0	0	112.9	V394 S395 F396 P402 Y431 H729	V394-T398 WeakPolarHBondContact O-CG2 3.16Å; V394-T398 PolarHBondContact O-N 3.22Å; V394-T398 PolarHBondContact O-OG1 3.07Å; S395-T398 PolarHBondContact O-N 3.27Å; S395-T398 PolarHBondContact O-OG1 3.44Å; F396-T398 VanDerWaalsContact C-N 3.32Å; F396-T398 PolarHBondContact O-N 2.95Å; T398-P402 WeakPolarHBondContact O-CD 3.36Å; T398-P402 WeakPolarHBondContact O-CG 3.44Å; T398-Y431 HydrophobicContact CG2-CD1 4.26Å; T398-Y431 HydrophobicContact CG2-CE1 4.14Å; T398-Y431 PolarHBondContact O-OH 3.02Å; T398-H729 PolarHBondContact O-CE1 3.04Å
399	L	78.7	Confident	81.9	Confident	16 Å²	16	30.9 Å²	30.9	8%	0.084	16%	0.16	C	C	.	.	H	α-helix	trans	-90.3	-39	-179	-68.1	165	0	0	0	113.5	S395 F396 I397 N403 M684 N685	S395-L399 WeakPolarHBondContact O-CD1 3.02Å; S395-L399 VanDerWaalsContact O-CG 3.28Å; S395-L399 WeakPolarHBondContact O-CG 3.41Å; S395-L399 PolarHBondContact O-N 3.46Å; S395-L399 VanDerWaalsContact O-N 3.11Å; F396-L399 PolarHBondContact O-N 2.99Å; F396-L399 VanDerWaalsContact O-N 3.12Å; I397-L399 PolarHBondContact O-N 3.02Å; L399-N403 PolarHBondContact O-ND2 3.12Å; L399-N403 VanDerWaalsContact O-ND2 3.15Å; L399-M684 HydrophobicContact CD1-CB 3.85Å; L399-M684 WeakPolarHBondContact CD1-O 3.49Å; L399-N685 VanDerWaalsContact CD2-OD1 3.25Å; L399-N685 WeakPolarHBondContact CD2-OD1 3.2Å
400	V	84.2	Confident	81.8	Confident	45 Å²	45	34.3 Å²	34.3	27%	0.273	17%	0.174	S	C	.	.	H	α-helix	trans	-84	-39.7	-173.6	174.9	0	0	0	0	111.7	F396 N403 L404	F396-V400 HydrophobicContact CD1-CG2 4.27Å; F396-V400 HydrophobicContact CD2-CG2 3.92Å; F396-V400 HydrophobicContact CE1-CB 4.36Å; F396-V400 HydrophobicContact CE1-CG2 3.98Å; F396-V400 HydrophobicContact CE2-CG2 3.62Å; F396-V400 HydrophobicContact CG-CG2 4.24Å; F396-V400 HydrophobicContact CZ-CB 4.43Å; F396-V400 HydrophobicContact CZ-CG2 3.66Å; F396-V400 WeakPolarHBondContact O-CB 3.36Å; F396-V400 WeakPolarHBondContact O-CG2 3.21Å; F396-V400 PolarHBondContact O-N 3.32Å; V400-N403 WeakPolarHBondContact O-CB 3.42Å; V400-N403 PolarHBondContact O-N 3.04Å; V400-L404 HydrophobicContact CG1-CD1 3.81Å; V400-L404 HydrophobicContact CG1-CG 4.14Å; V400-L404 PolarHBondContact O-N 3.34Å; V400-L404 VanDerWaalsContact O-N 3.08Å
401	F	87.8	Confident	82	Confident	22 Å²	22	36.7 Å²	36.7	10%	0.096	19%	0.186	C	C	.	.	H	α-helix	trans	-66.1	-39.3	-173.2	-77.7	32.9	0	0	0	113.7	M358 S362 I397 N403 L404 F405 L430	M358-F401 HydrophobicContact CB-CE2 4.37Å; M358-F401 HydrophobicContact CE-CB 4.39Å; M358-F401 HydrophobicContact CE-CD1 4.25Å; M358-F401 HydrophobicContact CE-CD2 4.09Å; M358-F401 HydrophobicContact CE-CE2 4.41Å; M358-F401 HydrophobicContact CE-CG 3.99Å; M358-F401 WeakPolarHBondContact O-CE2 3.49Å; S362-F401 VanDerWaalsContact CB-CE2 3.46Å; I397-F401 HydrophobicContact CB-CD1 4.46Å; I397-F401 HydrophobicContact CB-CE1 4.38Å; I397-F401 HydrophobicContact CG1-CE1 4.13Å; I397-F401 HydrophobicContact CG1-CZ 4.26Å; I397-F401 HydrophobicContact CG2-CD1 4.05Å; I397-F401 HydrophobicContact CG2-CD2 3.86Å; I397-F401 HydrophobicContact CG2-CE1 4.09Å; I397-F401 HydrophobicContact CG2-CE2 3.91Å; I397-F401 HydrophobicContact CG2-CG 3.94Å; I397-F401 HydrophobicContact CG2-CZ 4.02Å; I397-F401 VanDerWaalsContact O-CB 3.27Å; I397-F401 WeakPolarHBondContact O-CB 3.46Å; I397-F401 WeakPolarHBondContact O-CG 3.3Å; I397-F401 PolarHBondContact O-N 3.1Å; I397-F401 VanDerWaalsContact O-N 3.09Å; F401-N403 VanDerWaalsContact C-N 3.27Å; F401-N403 PolarHBondContact O-N 3.47Å; F401-L404 PolarHBondContact O-N 3.27Å; F401-F405 VanDerWaalsContact O-CG 3.29Å; F401-F405 WeakPolarHBondContact O-CG 3.47Å; F401-F405 PolarHBondContact O-N 3.49Å; F401-L430 HydrophobicContact CB-CD2 3.47Å; F401-L430 VanDerWaalsContact CB-CD2 3.47Å; F401-L430 HydrophobicContact CD2-CD1 3.83Å; F401-L430 HydrophobicContact CD2-CD2 3.87Å; F401-L430 HydrophobicContact CE2-CD1 4.38Å; F401-L430 HydrophobicContact CG-CD2 4.09Å
402	P	84.9	Confident	82.3	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-57.9	-39.6	173.9	-25.1	34.5	0	0	0	113.1	T398 F405 E406 I427 Y431	T398-P402 WeakPolarHBondContact O-CD 3.36Å; T398-P402 WeakPolarHBondContact O-CG 3.44Å; P402-F405 PolarHBondContact O-N 2.69Å; P402-E406 PolarHBondContact O-N 2.98Å; P402-E406 VanDerWaalsContact O-N 3.12Å; P402-I427 HydrophobicContact CB-CD1 3.95Å; P402-I427 HydrophobicContact CB-CG1 4.11Å; P402-I427 HydrophobicContact CB-CG2 4.3Å; P402-I427 HydrophobicContact CG-CG2 3.93Å; P402-Y431 HydrophobicContact CG-CE1 4.34Å; P402-Y431 WeakPolarHBondContact CG-OH 3.32Å
403	N	79.8	Confident	82	Confident	61 Å²	61	43.1 Å²	43.1	33%	0.326	21%	0.206	S	C	.	.	H	α-helix	trans	-66.5	-41.5	177	-67.7	-34.4	0	0	0	111.3	L399 V400 F401 E406 M407	L399-N403 PolarHBondContact O-ND2 3.12Å; L399-N403 VanDerWaalsContact O-ND2 3.15Å; V400-N403 WeakPolarHBondContact O-CB 3.42Å; V400-N403 PolarHBondContact O-N 3.04Å; F401-N403 VanDerWaalsContact C-N 3.27Å; F401-N403 PolarHBondContact O-N 3.47Å; N403-E406 WeakPolarHBondContact O-CB 3.23Å; N403-E406 PolarHBondContact O-N 3.23Å; N403-M407 PolarHBondContact O-N 3.32Å
404	L	85.6	Confident	81.4	Confident	74 Å²	74	44.5 Å²	44.5	39%	0.387	21%	0.21	S	C	.	.	H	α-helix	trans	-65.5	-39.7	174.5	-69.3	176.6	0	0	0	112.2	M358 V400 F401 E406 M407 V408	M358-L404 HydrophobicContact CE-CB 3.55Å; M358-L404 HydrophobicContact CE-CD1 3.42Å; M358-L404 VanDerWaalsContact CE-CD1 3.42Å; M358-L404 HydrophobicContact CE-CG 4.14Å; M358-L404 HydrophobicContact SD-CB 4.3Å; V400-L404 HydrophobicContact CG1-CD1 3.81Å; V400-L404 HydrophobicContact CG1-CG 4.14Å; V400-L404 PolarHBondContact O-N 3.34Å; V400-L404 VanDerWaalsContact O-N 3.08Å; F401-L404 PolarHBondContact O-N 3.27Å; L404-E406 PolarHBondContact O-N 2.85Å; L404-M407 PolarHBondContact O-N 2.97Å; L404-M407 VanDerWaalsContact O-N 3.1Å; L404-V408 WeakPolarHBondContact O-CG2 3.4Å; L404-V408 PolarHBondContact O-N 2.74Å
405	F	87.2	Confident	81	Confident	1 Å²	1	49.5 Å²	49.5	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-30.6	175.2	-70.2	-19.2	0	0	0	112.8	I355 M358 M359 F401 P402 S409 R426 I427 L430	I355-F405 HydrophobicContact CB-CE1 4.49Å; I355-F405 HydrophobicContact CG1-CD1 4.13Å; I355-F405 HydrophobicContact CG1-CE1 4.3Å; I355-F405 HydrophobicContact CG2-CE1 4.07Å; I355-F405 HydrophobicContact CG2-CZ 4.43Å; M358-F405 HydrophobicContact CB-CE1 4.07Å; M358-F405 HydrophobicContact CE-CD1 4.25Å; M358-F405 HydrophobicContact CE-CE1 3.99Å; M358-F405 HydrophobicContact SD-CD1 4.12Å; M358-F405 HydrophobicContact SD-CE1 3.92Å; M359-F405 HydrophobicContact CG-CZ 4.19Å; F401-F405 VanDerWaalsContact O-CG 3.29Å; F401-F405 WeakPolarHBondContact O-CG 3.47Å; F401-F405 PolarHBondContact O-N 3.49Å; P402-F405 PolarHBondContact O-N 2.69Å; F405-S409 WeakPolarHBondContact O-CB 3.47Å; F405-S409 PolarHBondContact O-N 2.81Å; F405-R426 HydrophobicContact CD2-CB 4.23Å; F405-R426 HydrophobicContact CE2-CB 4.34Å; F405-I427 HydrophobicContact CD2-CG1 3.95Å; F405-L430 HydrophobicContact CE2-CB 4.17Å; F405-L430 HydrophobicContact CE2-CD2 3.89Å; F405-L430 HydrophobicContact CZ-CD2 4.34Å
406	E	79	Confident	80.3	Confident	40 Å²	40	52 Å²	52	19%	0.187	25%	0.248	C	C	.	.	H	α-helix	trans	-68.3	-43.3	171.3	-177.3	-178.7	-143.3	0	0	112	P402 N403 L404 V408 S409 K410 K722	P402-E406 PolarHBondContact O-N 2.98Å; P402-E406 VanDerWaalsContact O-N 3.12Å; N403-E406 WeakPolarHBondContact O-CB 3.23Å; N403-E406 PolarHBondContact O-N 3.23Å; L404-E406 PolarHBondContact O-N 2.85Å; E406-V408 VanDerWaalsContact C-N 3.25Å; E406-V408 PolarHBondContact O-N 2.88Å; E406-S409 PolarHBondContact O-N 3.34Å; E406-S409 VanDerWaalsContact O-N 3.08Å; E406-S409 PolarHBondContact O-OG 3.44Å; E406-K410 PolarHBondContact O-N 2.68Å; E406-K722 WeakPolarHBondContact OE1-CE 3.48Å; E406-K722 IonicContact OE1-NZ 3.24Å; E406-K722 PolarHBondContact OE1-NZ 2.91Å; E406-K722 VanDerWaalsContact OE2-CE 3.24Å; E406-K722 WeakPolarHBondContact OE2-CE 3.44Å; E406-K722 IonicContact OE2-NZ 3.38Å; E406-K722 PolarHBondContact OE2-NZ 3.26Å
407	M	80	Confident	79.3	Confident	80 Å²	80	55.3 Å²	55.3	39%	0.394	26%	0.257	S	S	.	.	H	α-helix	trans	-60.8	-40.8	176.7	-62.9	-57.9	152.2	0	0	110.9	N403 L404 K410 F715	N403-M407 PolarHBondContact O-N 3.32Å; L404-M407 PolarHBondContact O-N 2.97Å; L404-M407 VanDerWaalsContact O-N 3.1Å; M407-K410 PolarHBondContact O-N 2.89Å; M407-F715 HydrophobicContact CE-CD2 4.22Å; M407-F715 HydrophobicContact CE-CE2 3.61Å; M407-F715 HydrophobicContact SD-CD2 4.46Å; M407-F715 HydrophobicContact SD-CE2 4.11Å
408	V	85.4	Confident	78.5	Confident	18 Å²	18	58.3 Å²	58.3	11%	0.109	28%	0.276	C	S	.	.	H	α-helix	trans	-67.7	-36.4	174	179.8	0	0	0	0	111.6	A351 I354 I355 L404 E406 K410 L411	A351-V408 HydrophobicContact CB-CG1 3.65Å; I354-V408 HydrophobicContact CG2-CG2 3.91Å; I355-V408 HydrophobicContact CD1-CG1 3.72Å; I355-V408 HydrophobicContact CG1-CB 4.49Å; I355-V408 HydrophobicContact CG1-CG1 3.88Å; L404-V408 WeakPolarHBondContact O-CG2 3.4Å; L404-V408 PolarHBondContact O-N 2.74Å; E406-V408 VanDerWaalsContact C-N 3.25Å; E406-V408 PolarHBondContact O-N 2.88Å; V408-K410 VanDerWaalsContact C-N 3.33Å; V408-K410 PolarHBondContact O-N 3.31Å; V408-L411 WeakPolarHBondContact O-CB 3.49Å; V408-L411 PolarHBondContact O-N 3.47Å; V408-L411 VanDerWaalsContact O-N 3.07Å
409	S	77.7	Confident	78.1	Confident	13 Å²	13	58.9 Å²	58.9	9%	0.091	28%	0.281	C	S	.	.	H	α-helix	trans	-67.4	-32.2	179.4	83.1	0	0	0	0	112.8	F405 E406 L411 E412	F405-S409 WeakPolarHBondContact O-CB 3.47Å; F405-S409 PolarHBondContact O-N 2.81Å; E406-S409 PolarHBondContact O-N 3.34Å; E406-S409 VanDerWaalsContact O-N 3.08Å; E406-S409 PolarHBondContact O-OG 3.44Å; S409-L411 PolarHBondContact O-N 3.33Å; S409-E412 PolarHBondContact O-N 3.2Å; S409-E412 VanDerWaalsContact O-N 3.15Å
410	K	77.5	Confident	77.7	Confident	112 Å²	112	60.6 Å²	60.6	49%	0.487	29%	0.29	S	S	.	.	H	α-helix	trans	-60	-31	171.5	-70.1	-177.3	-179.4	-173.9	0	111.8	E406 M407 V408 E717	E406-K410 PolarHBondContact O-N 2.68Å; M407-K410 PolarHBondContact O-N 2.89Å; V408-K410 VanDerWaalsContact C-N 3.33Å; V408-K410 PolarHBondContact O-N 3.31Å; K410-E717 IonicContact NZ-OE2 2.67Å
411	L	79.4	Confident	77.3	Confident	68 Å²	68	67.7 Å²	67.7	36%	0.356	31%	0.312	S	S	.	.	H	α-helix	trans	-69.9	-31.5	176.5	-165.5	67.2	0	0	0	113.1	L347 A351 V408 S409 R413	L347-L411 HydrophobicContact CD2-CD1 3.77Å; L347-L411 HydrophobicContact CD2-CD2 4.28Å; L347-L411 HydrophobicContact CD2-CG 3.95Å; A351-L411 HydrophobicContact CB-CD2 4.5Å; V408-L411 WeakPolarHBondContact O-CB 3.49Å; V408-L411 PolarHBondContact O-N 3.47Å; V408-L411 VanDerWaalsContact O-N 3.07Å; S409-L411 PolarHBondContact O-N 3.33Å; L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 3.04Å
412	E	78.6	Confident	76.9	Confident	3 Å²	3	69.3 Å²	69.3	1%	0.014	32%	0.322	C	S	.	.	H	α-helix	trans	-76.4	-15	-172.3	-62.6	-177	143	0	0	114.5	R348 A351 S409 F414 R426	R348-E412 HydrophobicContact CG-CB 4.46Å; R348-E412 PolarHBondContact NE-O 3.3Å; A351-E412 HydrophobicContact CB-CG 3.46Å; A351-E412 VanDerWaalsContact CB-CG 3.46Å; A351-E412 WeakPolarHBondContact CB-OE1 3.45Å; S409-E412 PolarHBondContact O-N 3.2Å; S409-E412 VanDerWaalsContact O-N 3.15Å; E412-F414 HydrophobicContact CB-CD2 3.48Å; E412-F414 VanDerWaalsContact CB-CD2 3.48Å; E412-F414 HydrophobicContact CB-CE2 3.71Å; E412-F414 HydrophobicContact CG-CD2 4.38Å; E412-F414 HydrophobicContact CG-CE2 4.27Å; E412-F414 PolarHBondContact O-N 3.05Å; E412-F414 VanDerWaalsContact O-N 3.15Å; E412-F414 WeakPolarHBondContact OE2-CD2 3.44Å; E412-F414 WeakPolarHBondContact OE2-CE2 3.5Å; E412-R426 VanDerWaalsContact CD-NH1 3.32Å; E412-R426 IonicContact OE1-CZ 2.84Å; E412-R426 IonicContact OE1-NH1 3.87Å; E412-R426 PolarHBondContact OE1-NH1 2.9Å; E412-R426 IonicContact OE1-NH2 2.79Å; E412-R426 PolarHBondContact OE1-NH2 2.97Å; E412-R426 IonicContact OE2-CZ 3.12Å; E412-R426 IonicContact OE2-NH1 2.96Å; E412-R426 PolarHBondContact OE2-NH1 2.91Å; E412-R426 IonicContact OE2-NH2 3.88Å; E412-R426 PolarHBondContact OE2-NH2 3.33Å
413	R	75.7	Confident	76.7	Confident	190 Å²	190	69.9 Å²	69.9	72%	0.717	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	43.1	-178.8	-58	-172.3	-173.3	-138	4.1	113	L411	L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 3.04Å
414	F	72.9	Confident	76.7	Confident	61 Å²	61	68.3 Å²	68.3	27%	0.268	32%	0.315	S	S	.	.			trans	-73.5	159.1	172.3	-81.1	-67.2	0	0	0	111.5	R348 E412 T418 A419 L422	R348-F414 HydrophobicContact CG-CZ 4.49Å; E412-F414 HydrophobicContact CB-CD2 3.48Å; E412-F414 VanDerWaalsContact CB-CD2 3.48Å; E412-F414 HydrophobicContact CB-CE2 3.71Å; E412-F414 HydrophobicContact CG-CD2 4.38Å; E412-F414 HydrophobicContact CG-CE2 4.27Å; E412-F414 PolarHBondContact O-N 3.05Å; E412-F414 VanDerWaalsContact O-N 3.15Å; E412-F414 WeakPolarHBondContact OE2-CD2 3.44Å; E412-F414 WeakPolarHBondContact OE2-CE2 3.5Å; F414-T418 HydrophobicContact CD1-CG2 4.32Å; F414-A419 HydrophobicContact CB-CB 3.92Å; F414-L422 HydrophobicContact CD2-CD2 4.07Å; F414-L422 HydrophobicContact CE2-CD2 3.74Å; F414-L422 HydrophobicContact CZ-CD2 4.47Å
415	H	72.5	Confident	76.6	Confident	116 Å²	116	67 Å²	67	54%	0.537	32%	0.316	S	S	.	.			trans	-58.8	136.4	167.7	-176.2	-69.8	0	0	0	108.9	R417 T418 A419	H415-R417 VanDerWaalsContact C-N 3.27Å; H415-R417 PolarHBondContact ND1-N 2.81Å; H415-R417 PolarHBondContact O-N 3.24Å; H415-T418 WeakPolarHBondContact O-CA 3.19Å; H415-T418 PolarHBondContact O-N 3.24Å; H415-A419 PolarHBondContact O-N 2.97Å
416	P	64.6	Low	76.6	Confident	54 Å²	54	68 Å²	68	35%	0.351	32%	0.319	S	S	.	.	H	α-helix	trans	-52.5	-41	-168.5	15.7	-31.8	0	0	0	113.8	T418 A419 L420 E775	P416-T418 PolarHBondContact O-N 3.19Å; P416-A419 PolarHBondContact O-N 2.99Å; P416-L420 PolarHBondContact O-N 3.02Å; P416-E775 WeakPolarHBondContact CB-OE2 3.34Å
417	R	63.1	Low	77	Confident	176 Å²	176	66 Å²	66	66%	0.664	31%	0.31	S	S	*	.	H	α-helix	trans	-60.8	-37.3	174.6	-64.4	-177.8	-176	167.8	4.5	115	H415 R421	H415-R417 VanDerWaalsContact C-N 3.27Å; H415-R417 PolarHBondContact ND1-N 2.81Å; H415-R417 PolarHBondContact O-N 3.24Å; R417-R421 WeakPolarHBondContact O-CG 3.44Å
418	T	71.7	Confident	77.1	Confident	71 Å²	71	64.2 Å²	64.2	44%	0.436	30%	0.302	S	S	.	.	H	α-helix	trans	-79.2	-41.5	179.2	-55.2	0	0	0	0	109.9	F414 H415 P416 L420 R421 L422	F414-T418 HydrophobicContact CD1-CG2 4.32Å; H415-T418 WeakPolarHBondContact O-CA 3.19Å; H415-T418 PolarHBondContact O-N 3.24Å; P416-T418 PolarHBondContact O-N 3.19Å; T418-L420 VanDerWaalsContact C-N 3.35Å; T418-L420 PolarHBondContact O-N 3.3Å; T418-R421 PolarHBondContact O-N 3.03Å; T418-L422 WeakPolarHBondContact O-CB 3.21Å; T418-L422 PolarHBondContact O-N 3.41Å
419	A	74.4	Confident	77.2	Confident	15 Å²	15	66.4 Å²	66.4	12%	0.124	32%	0.315	C	S	.	.	H	α-helix	trans	-54	-50.3	174.8	0	0	0	0	0	111.2	F414 H415 P416 R421 L422 Q423	F414-A419 HydrophobicContact CB-CB 3.92Å; H415-A419 PolarHBondContact O-N 2.97Å; P416-A419 PolarHBondContact O-N 2.99Å; A419-R421 PolarHBondContact O-N 2.86Å; A419-L422 PolarHBondContact O-N 3.01Å; A419-Q423 VanDerWaalsContact O-CB 3.31Å; A419-Q423 WeakPolarHBondContact O-CB 3.34Å; A419-Q423 PolarHBondContact O-N 3.17Å
420	L	69.6	Low	77.7	Confident	51 Å²	51	65.8 Å²	65.8	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-44.7	179	-178.6	69.1	0	0	0	112.8	P416 T418 L422 Q423 L424 F777	P416-L420 PolarHBondContact O-N 3.02Å; T418-L420 VanDerWaalsContact C-N 3.35Å; T418-L420 PolarHBondContact O-N 3.3Å; L420-L422 VanDerWaalsContact C-N 3.33Å; L420-L422 PolarHBondContact O-N 2.87Å; L420-Q423 PolarHBondContact O-N 3.34Å; L420-L424 HydrophobicContact CD1-CD1 4.18Å; L420-L424 HydrophobicContact CD1-CG 4.25Å; L420-L424 HydrophobicContact CD2-CD1 4.41Å; L420-L424 HydrophobicContact CG-CD1 3.95Å; L420-L424 HydrophobicContact CG-CG 4.39Å; L420-L424 WeakPolarHBondContact O-CB 3.33Å; L420-L424 VanDerWaalsContact O-CG 3.28Å; L420-L424 WeakPolarHBondContact O-CG 3.43Å; L420-L424 PolarHBondContact O-N 3.38Å; L420-F777 HydrophobicContact CD2-CD1 4.43Å; L420-F777 HydrophobicContact CD2-CE1 3.49Å; L420-F777 VanDerWaalsContact CD2-CE1 3.49Å; L420-F777 HydrophobicContact CD2-CE2 3.8Å; L420-F777 HydrophobicContact CD2-CZ 3.14Å; L420-F777 HydrophobicContact CG-CZ 4.35Å
421	R	75.9	Confident	78	Confident	194 Å²	194	60.6 Å²	60.6	73%	0.732	29%	0.288	S	S	*	.	H	α-helix	trans	-63.5	-41.5	-179.9	-73.2	178.5	-175.7	-172.2	1.1	111.8	R417 T418 A419 A425	R417-R421 WeakPolarHBondContact O-CG 3.44Å; T418-R421 PolarHBondContact O-N 3.03Å; A419-R421 PolarHBondContact O-N 2.86Å; R421-A425 WeakPolarHBondContact O-CB 3.46Å; R421-A425 PolarHBondContact O-N 2.9Å
422	L	80.2	Confident	78.2	Confident	57 Å²	57	59.2 Å²	59.2	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-67.6	-43.8	179.1	-163.9	80.6	0	0	0	110.8	F414 T418 A419 L420 A425 R426	F414-L422 HydrophobicContact CD2-CD2 4.07Å; F414-L422 HydrophobicContact CE2-CD2 3.74Å; F414-L422 HydrophobicContact CZ-CD2 4.47Å; T418-L422 WeakPolarHBondContact O-CB 3.21Å; T418-L422 PolarHBondContact O-N 3.41Å; A419-L422 PolarHBondContact O-N 3.01Å; L420-L422 VanDerWaalsContact C-N 3.33Å; L420-L422 PolarHBondContact O-N 2.87Å; L422-A425 PolarHBondContact O-N 3.07Å; L422-R426 VanDerWaalsContact O-CG 3.28Å; L422-R426 WeakPolarHBondContact O-CG 3.35Å; L422-R426 PolarHBondContact O-N 3.31Å
423	Q	81.2	Confident	78.5	Confident	13 Å²	13	61.7 Å²	61.7	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-49.2	174.1	177.4	174.4	-12.3	0	0	111.4	A419 L420 A425 R426 I427 E725	A419-Q423 VanDerWaalsContact O-CB 3.31Å; A419-Q423 WeakPolarHBondContact O-CB 3.34Å; A419-Q423 PolarHBondContact O-N 3.17Å; L420-Q423 PolarHBondContact O-N 3.34Å; Q423-A425 VanDerWaalsContact C-N 3.3Å; Q423-A425 PolarHBondContact O-N 3.24Å; Q423-R426 PolarHBondContact O-N 2.76Å; Q423-R426 VanDerWaalsContact O-N 3.15Å; Q423-I427 HydrophobicContact CG-CD1 3.91Å; Q423-I427 VanDerWaalsContact O-CG1 3.3Å; Q423-I427 WeakPolarHBondContact O-CG1 3.11Å; Q423-I427 PolarHBondContact O-N 3.05Å; Q423-E725 PolarHBondContact NE2-OE1 3.4Å
424	L	79.2	Confident	78.9	Confident	27 Å²	27	52.9 Å²	52.9	14%	0.141	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-39	176.3	-71.2	172.3	0	0	0	112.4	L420 L428 A724	L420-L424 HydrophobicContact CD1-CD1 4.18Å; L420-L424 HydrophobicContact CD1-CG 4.25Å; L420-L424 HydrophobicContact CD2-CD1 4.41Å; L420-L424 HydrophobicContact CG-CD1 3.95Å; L420-L424 HydrophobicContact CG-CG 4.39Å; L420-L424 WeakPolarHBondContact O-CB 3.33Å; L420-L424 VanDerWaalsContact O-CG 3.28Å; L420-L424 WeakPolarHBondContact O-CG 3.43Å; L420-L424 PolarHBondContact O-N 3.38Å; L424-L428 WeakPolarHBondContact O-CB 3.41Å; L424-L428 PolarHBondContact O-N 3.02Å; L424-A724 HydrophobicContact CD1-CB 3.84Å; L424-A724 HydrophobicContact CD2-CB 3.42Å; L424-A724 VanDerWaalsContact CD2-CB 3.42Å; L424-A724 HydrophobicContact CG-CB 4.23Å
425	A	82.9	Confident	79.1	Confident	47 Å²	47	50.3 Å²	50.3	39%	0.388	25%	0.248	S	C	.	.	H	α-helix	trans	-64.3	-40.5	174.9	0	0	0	0	0	112	R421 L422 Q423 L428 V429	R421-A425 WeakPolarHBondContact O-CB 3.46Å; R421-A425 PolarHBondContact O-N 2.9Å; L422-A425 PolarHBondContact O-N 3.07Å; Q423-A425 VanDerWaalsContact C-N 3.3Å; Q423-A425 PolarHBondContact O-N 3.24Å; A425-L428 WeakPolarHBondContact O-CB 3.45Å; A425-L428 PolarHBondContact O-N 3Å; A425-V429 VanDerWaalsContact O-CG2 3.26Å; A425-V429 WeakPolarHBondContact O-CG2 3.18Å; A425-V429 PolarHBondContact O-N 3.13Å
426	R	88.2	Confident	79.5	Confident	21 Å²	21	50.7 Å²	50.7	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-46.6	177.3	-71.5	163.2	178.7	171.3	-7.6	112.2	N352 I355 F405 E412 L422 Q423 L428 V429 L430	N352-R426 PolarHBondContact OD1-NH2 3.49Å; I355-R426 VanDerWaalsContact CD1-NH1 3.32Å; I355-R426 HydrophobicContact CG2-CG 4.34Å; F405-R426 HydrophobicContact CD2-CB 4.23Å; F405-R426 HydrophobicContact CE2-CB 4.34Å; E412-R426 VanDerWaalsContact CD-NH1 3.32Å; E412-R426 IonicContact OE1-CZ 2.84Å; E412-R426 IonicContact OE1-NH1 3.87Å; E412-R426 PolarHBondContact OE1-NH1 2.9Å; E412-R426 IonicContact OE1-NH2 2.79Å; E412-R426 PolarHBondContact OE1-NH2 2.97Å; E412-R426 IonicContact OE2-CZ 3.12Å; E412-R426 IonicContact OE2-NH1 2.96Å; E412-R426 PolarHBondContact OE2-NH1 2.91Å; E412-R426 IonicContact OE2-NH2 3.88Å; E412-R426 PolarHBondContact OE2-NH2 3.33Å; L422-R426 VanDerWaalsContact O-CG 3.28Å; L422-R426 WeakPolarHBondContact O-CG 3.35Å; L422-R426 PolarHBondContact O-N 3.31Å; Q423-R426 PolarHBondContact O-N 2.76Å; Q423-R426 VanDerWaalsContact O-N 3.15Å; R426-L428 VanDerWaalsContact C-N 3.3Å; R426-L428 PolarHBondContact O-N 3.23Å; R426-V429 PolarHBondContact O-N 3.46Å; R426-L430 PolarHBondContact O-N 3.08Å
427	I	85.5	Confident	80.4	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.3	-40.3	178	-56	162	0	0	0	110.2	P402 F405 Q423 V429 L430 Y431 E725 L728	P402-I427 HydrophobicContact CB-CD1 3.95Å; P402-I427 HydrophobicContact CB-CG1 4.11Å; P402-I427 HydrophobicContact CB-CG2 4.3Å; P402-I427 HydrophobicContact CG-CG2 3.93Å; F405-I427 HydrophobicContact CD2-CG1 3.95Å; Q423-I427 HydrophobicContact CG-CD1 3.91Å; Q423-I427 VanDerWaalsContact O-CG1 3.3Å; Q423-I427 WeakPolarHBondContact O-CG1 3.11Å; Q423-I427 PolarHBondContact O-N 3.05Å; I427-V429 PolarHBondContact O-N 3.39Å; I427-L430 WeakPolarHBondContact O-CB 3.49Å; I427-L430 PolarHBondContact O-N 2.87Å; I427-Y431 HydrophobicContact CG2-CD1 4.22Å; I427-Y431 HydrophobicContact CG2-CD2 4.48Å; I427-Y431 HydrophobicContact CG2-CE1 3.64Å; I427-Y431 HydrophobicContact CG2-CE2 3.98Å; I427-Y431 VanDerWaalsContact CG2-CZ 3.48Å; I427-Y431 WeakPolarHBondContact O-CD1 3.2Å; I427-Y431 PolarHBondContact O-N 3.28Å; I427-E725 HydrophobicContact CD1-CG 3.86Å; I427-L728 HydrophobicContact CB-CD2 3.76Å; I427-L728 HydrophobicContact CG2-CD2 3.35Å
428	L	83.9	Confident	81	Confident	42 Å²	42	41.7 Å²	41.7	22%	0.22	21%	0.208	C	C	.	.	H	α-helix	trans	-56.9	-49.2	174	178.4	86.7	0	0	0	111.9	L424 A425 R426 L430 Y431 F432 L728 L808	L424-L428 WeakPolarHBondContact O-CB 3.41Å; L424-L428 PolarHBondContact O-N 3.02Å; A425-L428 WeakPolarHBondContact O-CB 3.45Å; A425-L428 PolarHBondContact O-N 3Å; R426-L428 VanDerWaalsContact C-N 3.3Å; R426-L428 PolarHBondContact O-N 3.23Å; L428-L430 VanDerWaalsContact C-N 3.35Å; L428-Y431 PolarHBondContact O-N 3.35Å; L428-F432 HydrophobicContact CD1-CD2 4.29Å; L428-F432 HydrophobicContact CD1-CE2 3.49Å; L428-F432 VanDerWaalsContact CD1-CE2 3.49Å; L428-F432 HydrophobicContact CD1-CZ 3.88Å; L428-F432 HydrophobicContact CD2-CD2 4.4Å; L428-F432 HydrophobicContact CD2-CE2 3.83Å; L428-F432 HydrophobicContact CG-CD2 3.84Å; L428-F432 HydrophobicContact CG-CE2 3.42Å; L428-F432 VanDerWaalsContact CG-CE2 3.42Å; L428-F432 HydrophobicContact CG-CZ 4.3Å; L428-F432 VanDerWaalsContact O-CD2 3.29Å; L428-F432 WeakPolarHBondContact O-CD2 3.43Å; L428-F432 PolarHBondContact O-N 3.26Å; L428-L728 HydrophobicContact CD1-CD1 3.95Å; L428-L808 HydrophobicContact CD1-CD1 3.08Å; L428-L808 HydrophobicContact CD1-CD2 4.31Å; L428-L808 HydrophobicContact CD1-CG 4.29Å
429	V	87.3	Confident	81	Confident	63 Å²	63	39.3 Å²	39.3	38%	0.382	19%	0.193	S	C	.	.	H	α-helix	trans	-65.4	-40.5	-180	179.2	0	0	0	0	110.7	M359 A425 R426 I427 Y431 F432 L433	M359-V429 HydrophobicContact CE-CB 3.93Å; M359-V429 HydrophobicContact CE-CG1 3.31Å; A425-V429 VanDerWaalsContact O-CG2 3.26Å; A425-V429 WeakPolarHBondContact O-CG2 3.18Å; A425-V429 PolarHBondContact O-N 3.13Å; R426-V429 PolarHBondContact O-N 3.46Å; I427-V429 PolarHBondContact O-N 3.39Å; V429-Y431 VanDerWaalsContact C-N 3.32Å; V429-Y431 PolarHBondContact O-N 3.48Å; V429-F432 PolarHBondContact O-N 3.23Å; V429-L433 HydrophobicContact CG1-CD1 3.89Å; V429-L433 HydrophobicContact CG1-CG 4.2Å; V429-L433 WeakPolarHBondContact O-CB 3.44Å; V429-L433 WeakPolarHBondContact O-CG 3.48Å; V429-L433 PolarHBondContact O-N 3.32Å
430	L	88.1	Confident	81.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-55.2	-47.6	173	176.4	69.7	0	0	0	111.2	S362 I397 F401 F405 R426 I427 L428 F432 L433 N434	S362-L430 VanDerWaalsContact OG-CD1 3.28Å; S362-L430 WeakPolarHBondContact OG-CD1 3.16Å; I397-L430 HydrophobicContact CG2-CD1 4.43Å; F401-L430 HydrophobicContact CB-CD2 3.47Å; F401-L430 VanDerWaalsContact CB-CD2 3.47Å; F401-L430 HydrophobicContact CD2-CD1 3.83Å; F401-L430 HydrophobicContact CD2-CD2 3.87Å; F401-L430 HydrophobicContact CE2-CD1 4.38Å; F401-L430 HydrophobicContact CG-CD2 4.09Å; F405-L430 HydrophobicContact CE2-CB 4.17Å; F405-L430 HydrophobicContact CE2-CD2 3.89Å; F405-L430 HydrophobicContact CZ-CD2 4.34Å; R426-L430 PolarHBondContact O-N 3.08Å; I427-L430 WeakPolarHBondContact O-CB 3.49Å; I427-L430 PolarHBondContact O-N 2.87Å; L428-L430 VanDerWaalsContact C-N 3.35Å; L430-F432 PolarHBondContact O-N 2.83Å; L430-L433 PolarHBondContact O-N 3.36Å; L430-N434 WeakPolarHBondContact O-CB 3.47Å; L430-N434 PolarHBondContact O-N 3.36Å; L430-N434 PolarHBondContact O-OD1 2.8Å
431	Y	84.3	Confident	81.2	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-37.9	-178.2	-69.2	3.7	0	0	0	112	T398 P402 I427 L428 V429 F435 L728 H729 N732	T398-Y431 HydrophobicContact CG2-CD1 4.26Å; T398-Y431 HydrophobicContact CG2-CE1 4.14Å; T398-Y431 PolarHBondContact O-OH 3.02Å; P402-Y431 HydrophobicContact CG-CE1 4.34Å; P402-Y431 WeakPolarHBondContact CG-OH 3.32Å; I427-Y431 HydrophobicContact CG2-CD1 4.22Å; I427-Y431 HydrophobicContact CG2-CD2 4.48Å; I427-Y431 HydrophobicContact CG2-CE1 3.64Å; I427-Y431 HydrophobicContact CG2-CE2 3.98Å; I427-Y431 VanDerWaalsContact CG2-CZ 3.48Å; I427-Y431 WeakPolarHBondContact O-CD1 3.2Å; I427-Y431 PolarHBondContact O-N 3.28Å; L428-Y431 PolarHBondContact O-N 3.35Å; V429-Y431 VanDerWaalsContact C-N 3.32Å; V429-Y431 PolarHBondContact O-N 3.48Å; Y431-F435 WeakPolarHBondContact O-CB 3.48Å; Y431-F435 PolarHBondContact O-N 2.86Å; Y431-L728 HydrophobicContact CD2-CD1 4.08Å; Y431-L728 HydrophobicContact CD2-CD2 3.78Å; Y431-L728 HydrophobicContact CD2-CG 3.46Å; Y431-L728 VanDerWaalsContact CD2-CG 3.46Å; Y431-L728 HydrophobicContact CE2-CB 4.12Å; Y431-L728 HydrophobicContact CE2-CD2 3.7Å; Y431-L728 HydrophobicContact CE2-CG 3.44Å; Y431-L728 VanDerWaalsContact CE2-CG 3.44Å; Y431-H729 AromaticContact CZ-CE1 4Å; Y431-H729 PolarHBondContact OH-CE1 2.79Å; Y431-H729 PolarHBondContact OH-ND1 3.04Å; Y431-H729 PolarHBondContact OH-NE2 3.15Å; Y431-H729 VanDerWaalsContact OH-NE2 3.09Å; Y431-N732 HydrophobicContact CD2-CB 3.95Å; Y431-N732 HydrophobicContact CE2-CB 4.46Å
432	F	82.8	Confident	80.7	Confident	39 Å²	39	32.9 Å²	32.9	17%	0.171	17%	0.169	C	C	.	.	H	α-helix	trans	-66.4	-40.3	173.8	-71.7	-47	0	0	0	113.1	L428 V429 L430 F435 Y436 L808 L811 I812 I815	L428-F432 HydrophobicContact CD1-CD2 4.29Å; L428-F432 HydrophobicContact CD1-CE2 3.49Å; L428-F432 VanDerWaalsContact CD1-CE2 3.49Å; L428-F432 HydrophobicContact CD1-CZ 3.88Å; L428-F432 HydrophobicContact CD2-CD2 4.4Å; L428-F432 HydrophobicContact CD2-CE2 3.83Å; L428-F432 HydrophobicContact CG-CD2 3.84Å; L428-F432 HydrophobicContact CG-CE2 3.42Å; L428-F432 VanDerWaalsContact CG-CE2 3.42Å; L428-F432 HydrophobicContact CG-CZ 4.3Å; L428-F432 VanDerWaalsContact O-CD2 3.29Å; L428-F432 WeakPolarHBondContact O-CD2 3.43Å; L428-F432 PolarHBondContact O-N 3.26Å; V429-F432 PolarHBondContact O-N 3.23Å; L430-F432 PolarHBondContact O-N 2.83Å; F432-F435 PolarHBondContact O-N 3.38Å; F432-Y436 WeakPolarHBondContact O-CB 3.49Å; F432-Y436 PolarHBondContact O-N 2.8Å; F432-L808 HydrophobicContact CZ-CD1 4.34Å; F432-L811 HydrophobicContact CE1-CD2 3.76Å; F432-L811 HydrophobicContact CE2-CD1 4.37Å; F432-L811 HydrophobicContact CE2-CD2 3.96Å; F432-L811 HydrophobicContact CZ-CD1 4.23Å; F432-L811 HydrophobicContact CZ-CD2 3.3Å; F432-L811 HydrophobicContact CZ-CG 4.29Å; F432-I812 HydrophobicContact CE1-CB 4.26Å; F432-I812 HydrophobicContact CE1-CD1 4.04Å; F432-I812 HydrophobicContact CE1-CG1 4.17Å; F432-I815 HydrophobicContact CD1-CD1 3.54Å; F432-I815 HydrophobicContact CE1-CD1 3.5Å; F432-I815 VanDerWaalsContact CE1-CD1 3.5Å; F432-I815 HydrophobicContact CG-CD1 4.23Å; F432-I815 HydrophobicContact CZ-CD1 4.1Å
433	L	84.7	Confident	80.3	Confident	55 Å²	55	31.6 Å²	31.6	29%	0.288	16%	0.161	S	C	.	.	H	α-helix	trans	-65.2	-45.5	175.7	-73.7	172.7	0	0	0	111.4	M359 V429 L430 F435 Y436 T437	M359-L433 HydrophobicContact CE-CD1 3.48Å; M359-L433 VanDerWaalsContact CE-CD1 3.48Å; V429-L433 HydrophobicContact CG1-CD1 3.89Å; V429-L433 HydrophobicContact CG1-CG 4.2Å; V429-L433 WeakPolarHBondContact O-CB 3.44Å; V429-L433 WeakPolarHBondContact O-CG 3.48Å; V429-L433 PolarHBondContact O-N 3.32Å; L430-L433 PolarHBondContact O-N 3.36Å; L433-F435 VanDerWaalsContact C-N 3.32Å; L433-F435 PolarHBondContact O-N 3.23Å; L433-Y436 PolarHBondContact O-N 2.74Å; L433-T437 WeakPolarHBondContact O-CB 3.28Å; L433-T437 WeakPolarHBondContact O-CG2 3.3Å; L433-T437 PolarHBondContact O-N 2.91Å; L433-T437 PolarHBondContact O-OG1 3.35Å
434	N	84.1	Confident	79.7	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-41.6	176.8	-70.1	-0.1	0	0	0	111.4	I366 I397 L430 T437 L438	I366-N434 HydrophobicContact CD1-CB 3.78Å; I366-N434 WeakPolarHBondContact CD1-OD1 3.19Å; I397-N434 WeakPolarHBondContact CG2-ND2 3.47Å; L430-N434 WeakPolarHBondContact O-CB 3.47Å; L430-N434 PolarHBondContact O-N 3.36Å; L430-N434 PolarHBondContact O-OD1 2.8Å; N434-T437 VanDerWaalsContact CA-OG1 3.31Å; N434-T437 WeakPolarHBondContact CA-OG1 3.31Å; N434-T437 PolarHBondContact O-OG1 3.34Å; N434-L438 VanDerWaalsContact O-CB 3.29Å; N434-L438 WeakPolarHBondContact O-CB 3.31Å; N434-L438 PolarHBondContact O-N 3.43Å
435	F	77.8	Confident	79.2	Confident	7 Å²	7	32.2 Å²	32.2	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-63.6	-46.8	176.1	-172.8	-106.5	0	0	0	111.7	Y431 F432 L433 I439 M736 L739 I815 C816	Y431-F435 WeakPolarHBondContact O-CB 3.48Å; Y431-F435 PolarHBondContact O-N 2.86Å; F432-F435 PolarHBondContact O-N 3.38Å; L433-F435 VanDerWaalsContact C-N 3.32Å; L433-F435 PolarHBondContact O-N 3.23Å; F435-I439 HydrophobicContact CD1-CD1 3.49Å; F435-I439 VanDerWaalsContact CD1-CD1 3.49Å; F435-I439 HydrophobicContact CE1-CD1 3.24Å; F435-I439 HydrophobicContact CE1-CG1 4.41Å; F435-I439 HydrophobicContact CE2-CD1 4.35Å; F435-I439 HydrophobicContact CG-CD1 4.16Å; F435-I439 HydrophobicContact CZ-CD1 3.71Å; F435-I439 WeakPolarHBondContact O-CD1 3.36Å; F435-I439 WeakPolarHBondContact O-CG1 3.23Å; F435-I439 PolarHBondContact O-N 2.83Å; F435-M736 HydrophobicContact CE2-CG 4.35Å; F435-L739 HydrophobicContact CE1-CD1 4.24Å; F435-L739 HydrophobicContact CE2-CB 4.48Å; F435-L739 HydrophobicContact CE2-CD1 3.98Å; F435-L739 HydrophobicContact CZ-CB 4.16Å; F435-L739 HydrophobicContact CZ-CD1 3.45Å; F435-L739 VanDerWaalsContact CZ-CD1 3.45Å; F435-L739 HydrophobicContact CZ-CG 4.44Å; F435-I815 HydrophobicContact CD1-CG2 3.89Å; F435-I815 HydrophobicContact CE1-CG2 3.89Å; F435-C816 HydrophobicContact CZ-CB 4.27Å; F435-C816 WeakPolarHBondContact CZ-SG 3.25Å
436	Y	80.2	Confident	78.2	Confident	125 Å²	125	31.3 Å²	31.3	49%	0.49	15%	0.153	S	C	.	.	H	α-helix	trans	-64.5	-42.7	179	-177.9	-97.3	0	0	0	112.8	F432 L433 I439 F440	F432-Y436 WeakPolarHBondContact O-CB 3.49Å; F432-Y436 PolarHBondContact O-N 2.8Å; L433-Y436 PolarHBondContact O-N 2.74Å; Y436-I439 PolarHBondContact O-N 3.28Å; Y436-F440 WeakPolarHBondContact O-CB 3.27Å; Y436-F440 PolarHBondContact O-N 2.8Å
437	T	83.3	Confident	77.1	Confident	19 Å²	19	33 Å²	33	12%	0.117	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-44.4	178.3	49.5	0	0	0	0	111.5	T363 L433 N434 I439 F440 A441	T363-T437 HydrophobicContact CG2-CG2 3.52Å; L433-T437 WeakPolarHBondContact O-CB 3.28Å; L433-T437 WeakPolarHBondContact O-CG2 3.3Å; L433-T437 PolarHBondContact O-N 2.91Å; L433-T437 PolarHBondContact O-OG1 3.35Å; N434-T437 VanDerWaalsContact CA-OG1 3.31Å; N434-T437 WeakPolarHBondContact CA-OG1 3.31Å; N434-T437 PolarHBondContact O-OG1 3.34Å; T437-I439 VanDerWaalsContact C-N 3.33Å; T437-I439 PolarHBondContact O-N 3.47Å; T437-F440 PolarHBondContact O-N 2.94Å; T437-A441 WeakPolarHBondContact O-CB 3.4Å; T437-A441 PolarHBondContact O-N 3.48Å
438	L	75.1	Confident	76.1	Confident	22 Å²	22	36.4 Å²	36.4	12%	0.115	18%	0.175	C	C	.	.	H	α-helix	trans	-56.3	-48.1	173.1	178	71.7	0	0	0	111.2	V390 N434 A441 V442 L677	V390-L438 HydrophobicContact CG1-CD1 4.22Å; N434-L438 VanDerWaalsContact O-CB 3.29Å; N434-L438 WeakPolarHBondContact O-CB 3.31Å; N434-L438 PolarHBondContact O-N 3.43Å; L438-A441 PolarHBondContact O-N 2.94Å; L438-V442 HydrophobicContact CD1-CG2 4.27Å; L438-V442 HydrophobicContact CG-CG2 4.48Å; L438-V442 WeakPolarHBondContact O-CB 3.4Å; L438-V442 WeakPolarHBondContact O-CG2 3.36Å; L438-V442 PolarHBondContact O-N 3.03Å; L438-L677 HydrophobicContact CD1-CD2 4.5Å; L438-L677 HydrophobicContact CD2-CD2 3.43Å; L438-L677 VanDerWaalsContact CD2-CD2 3.43Å
439	I	73.2	Confident	74.8	Confident	20 Å²	20	36 Å²	36	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-57.2	-55.2	178.3	-71.5	163.3	0	0	0	110.6	F435 Y436 T437 A441 V442 F443 L739 P819	F435-I439 HydrophobicContact CD1-CD1 3.49Å; F435-I439 VanDerWaalsContact CD1-CD1 3.49Å; F435-I439 HydrophobicContact CE1-CD1 3.24Å; F435-I439 HydrophobicContact CE1-CG1 4.41Å; F435-I439 HydrophobicContact CE2-CD1 4.35Å; F435-I439 HydrophobicContact CG-CD1 4.16Å; F435-I439 HydrophobicContact CZ-CD1 3.71Å; F435-I439 WeakPolarHBondContact O-CD1 3.36Å; F435-I439 WeakPolarHBondContact O-CG1 3.23Å; F435-I439 PolarHBondContact O-N 2.83Å; Y436-I439 PolarHBondContact O-N 3.28Å; T437-I439 VanDerWaalsContact C-N 3.33Å; T437-I439 PolarHBondContact O-N 3.47Å; I439-A441 VanDerWaalsContact C-N 3.31Å; I439-A441 PolarHBondContact O-N 2.76Å; I439-V442 PolarHBondContact O-N 3.31Å; I439-F443 HydrophobicContact CG2-CD2 3.49Å; I439-F443 VanDerWaalsContact CG2-CD2 3.49Å; I439-F443 HydrophobicContact CG2-CE2 3.43Å; I439-F443 VanDerWaalsContact CG2-CE2 3.43Å; I439-F443 WeakPolarHBondContact O-CD2 3.31Å; I439-F443 PolarHBondContact O-N 3.34Å; I439-L739 HydrophobicContact CD1-CD1 3.65Å; I439-L739 HydrophobicContact CG1-CD1 3.56Å; I439-P819 HydrophobicContact CD1-CB 4.45Å; I439-P819 HydrophobicContact CD1-CG 3.63Å; I439-P819 HydrophobicContact CG1-CG 4.41Å; I439-P819 HydrophobicContact CG2-CB 4.02Å; I439-P819 HydrophobicContact CG2-CG 4.01Å
440	F	75.7	Confident	73.5	Confident	85 Å²	85	36.3 Å²	36.3	37%	0.373	17%	0.172	S	C	.	.	H	α-helix	trans	-60.2	-41.8	-177.7	-179.4	-97.4	0	0	0	112.2	Y436 T437 F443 T444	Y436-F440 WeakPolarHBondContact O-CB 3.27Å; Y436-F440 PolarHBondContact O-N 2.8Å; T437-F440 PolarHBondContact O-N 2.94Å; F440-F443 PolarHBondContact O-N 3.44Å; F440-T444 HydrophobicContact CD1-CG2 4.31Å; F440-T444 HydrophobicContact CE1-CG2 3.84Å; F440-T444 HydrophobicContact CE2-CG2 4.38Å; F440-T444 HydrophobicContact CZ-CG2 3.88Å; F440-T444 WeakPolarHBondContact O-CG2 3.18Å; F440-T444 PolarHBondContact O-N 2.93Å; F440-T444 PolarHBondContact O-OG1 3.1Å
441	A	71.8	Confident	72.4	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-37	-179.9	0	0	0	0	0	112	V370 T437 L438 I439 T444 K445	V370-A441 HydrophobicContact CB-CB 3.64Å; V370-A441 HydrophobicContact CG1-CB 3.41Å; V370-A441 VanDerWaalsContact CG1-CB 3.41Å; V370-A441 HydrophobicContact CG2-CB 3.82Å; T437-A441 WeakPolarHBondContact O-CB 3.4Å; T437-A441 PolarHBondContact O-N 3.48Å; L438-A441 PolarHBondContact O-N 2.94Å; I439-A441 VanDerWaalsContact C-N 3.31Å; I439-A441 PolarHBondContact O-N 2.76Å; A441-T444 VanDerWaalsContact CA-OG1 3.32Å; A441-T444 WeakPolarHBondContact CA-OG1 3.36Å; A441-T444 PolarHBondContact O-OG1 3.3Å; A441-K445 PolarHBondContact O-N 3.1Å
442	V	66	Low	71.3	Confident	39 Å²	39	44 Å²	44	24%	0.236	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-45.1	171.5	172	0	0	0	0	110.8	L438 I439 T444 K445 M446 H670	L438-V442 HydrophobicContact CD1-CG2 4.27Å; L438-V442 HydrophobicContact CG-CG2 4.48Å; L438-V442 WeakPolarHBondContact O-CB 3.4Å; L438-V442 WeakPolarHBondContact O-CG2 3.36Å; L438-V442 PolarHBondContact O-N 3.03Å; I439-V442 PolarHBondContact O-N 3.31Å; V442-T444 VanDerWaalsContact C-N 3.34Å; V442-T444 PolarHBondContact O-N 3.01Å; V442-K445 WeakPolarHBondContact O-CB 3.47Å; V442-K445 PolarHBondContact O-N 3.33Å; V442-M446 WeakPolarHBondContact O-CG 3.05Å; V442-M446 PolarHBondContact O-N 2.88Å; V442-H670 WeakPolarHBondContact CG1-ND1 3.28Å
443	F	70.4	Confident	69.9	Low	31 Å²	31	47.4 Å²	47.4	14%	0.136	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-41.5	176.3	-89.5	-73.7	0	0	0	113.4	I439 F440 M446 E447 P819 Y822 V823	I439-F443 HydrophobicContact CG2-CD2 3.49Å; I439-F443 VanDerWaalsContact CG2-CD2 3.49Å; I439-F443 HydrophobicContact CG2-CE2 3.43Å; I439-F443 VanDerWaalsContact CG2-CE2 3.43Å; I439-F443 WeakPolarHBondContact O-CD2 3.31Å; I439-F443 PolarHBondContact O-N 3.34Å; F440-F443 PolarHBondContact O-N 3.44Å; F443-M446 HydrophobicContact CD1-CE 3.12Å; F443-M446 HydrophobicContact CE1-CE 3.32Å; F443-M446 HydrophobicContact CG-CE 3.86Å; F443-M446 HydrophobicContact CZ-CE 4.17Å; F443-M446 WeakPolarHBondContact O-CA 3.5Å; F443-M446 VanDerWaalsContact O-CB 3.23Å; F443-M446 WeakPolarHBondContact O-CB 2.88Å; F443-M446 PolarHBondContact O-N 3.32Å; F443-M446 VanDerWaalsContact O-N 3.14Å; F443-E447 PolarHBondContact O-N 3.08Å; F443-E447 VanDerWaalsContact O-N 3.08Å; F443-P819 HydrophobicContact CE2-CB 4.18Å; F443-Y822 AromaticContact CE1-CD1 3.95Å; F443-Y822 HydrophobicContact CE1-CD1 3.95Å; F443-Y822 HydrophobicContact CE1-CE1 4.18Å; F443-Y822 AromaticContact CZ-CD1 3.99Å; F443-Y822 HydrophobicContact CZ-CD1 3.99Å; F443-V823 HydrophobicContact CE1-CG2 3.53Å; F443-V823 HydrophobicContact CZ-CG2 3.38Å
444	T	70	Confident	68.7	Low	36 Å²	36	48.5 Å²	48.5	22%	0.221	23%	0.23	C	C	.	.	H	α-helix	trans	-68.8	-38.3	177.2	45.7	0	0	0	0	111.7	R374 F440 A441 V442 M446 E447 Y448	R374-T444 PolarHBondContact NH2-OG1 2.95Å; F440-T444 HydrophobicContact CD1-CG2 4.31Å; F440-T444 HydrophobicContact CE1-CG2 3.84Å; F440-T444 HydrophobicContact CE2-CG2 4.38Å; F440-T444 HydrophobicContact CZ-CG2 3.88Å; F440-T444 WeakPolarHBondContact O-CG2 3.18Å; F440-T444 PolarHBondContact O-N 2.93Å; F440-T444 PolarHBondContact O-OG1 3.1Å; A441-T444 VanDerWaalsContact CA-OG1 3.32Å; A441-T444 WeakPolarHBondContact CA-OG1 3.36Å; A441-T444 PolarHBondContact O-OG1 3.3Å; V442-T444 VanDerWaalsContact C-N 3.34Å; V442-T444 PolarHBondContact O-N 3.01Å; T444-M446 PolarHBondContact O-N 3.06Å; T444-E447 PolarHBondContact O-N 3.04Å; T444-Y448 PolarHBondContact O-N 3.41Å; T444-Y448 VanDerWaalsContact O-N 3.1Å
445	K	67.9	Low	67.6	Low	16 Å²	16	50.4 Å²	50.4	7%	0.07	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-36.5	168.2	179.7	170.1	178.1	165.3	0	111.4	S373 R374 E377 A441 V442 Y448 L449	S373-K445 PolarHBondContact O-NZ 3.41Å; R374-K445 HydrophobicContact CG-CB 4.24Å; R374-K445 HydrophobicContact CG-CD 4.38Å; R374-K445 HydrophobicContact CG-CG 4.16Å; E377-K445 WeakPolarHBondContact OE2-CE 3.38Å; E377-K445 IonicContact OE2-NZ 2.79Å; E377-K445 PolarHBondContact OE2-NZ 3.35Å; A441-K445 PolarHBondContact O-N 3.1Å; V442-K445 WeakPolarHBondContact O-CB 3.47Å; V442-K445 PolarHBondContact O-N 3.33Å; K445-Y448 PolarHBondContact O-N 3.14Å; K445-L449 HydrophobicContact CG-CD1 4.05Å; K445-L449 WeakPolarHBondContact O-CG 3.45Å; K445-L449 PolarHBondContact O-N 3.45Å
446	M	62.1	Low	66.4	Low	29 Å²	29	52.5 Å²	52.5	14%	0.143	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-51	176.5	-56.6	-145.1	-87.1	0	0	113.3	V442 F443 T444 Y448 L449 I450 F666 H670	V442-M446 WeakPolarHBondContact O-CG 3.05Å; V442-M446 PolarHBondContact O-N 2.88Å; F443-M446 HydrophobicContact CD1-CE 3.12Å; F443-M446 HydrophobicContact CE1-CE 3.32Å; F443-M446 HydrophobicContact CG-CE 3.86Å; F443-M446 HydrophobicContact CZ-CE 4.17Å; F443-M446 WeakPolarHBondContact O-CA 3.5Å; F443-M446 VanDerWaalsContact O-CB 3.23Å; F443-M446 WeakPolarHBondContact O-CB 2.88Å; F443-M446 PolarHBondContact O-N 3.32Å; F443-M446 VanDerWaalsContact O-N 3.14Å; T444-M446 PolarHBondContact O-N 3.06Å; M446-Y448 PolarHBondContact O-N 2.92Å; M446-L449 PolarHBondContact O-N 3.42Å; M446-I450 VanDerWaalsContact O-CG1 3.32Å; M446-I450 WeakPolarHBondContact O-CG1 3.47Å; M446-I450 PolarHBondContact O-N 3.35Å; M446-F666 HydrophobicContact CB-CE1 4Å; M446-F666 HydrophobicContact CB-CE2 4.29Å; M446-F666 HydrophobicContact CB-CZ 3.33Å; M446-F666 HydrophobicContact CG-CE1 4.1Å; M446-F666 HydrophobicContact CG-CZ 3.51Å; M446-F666 HydrophobicContact SD-CE1 3.78Å; M446-F666 HydrophobicContact SD-CZ 3.8Å; M446-H670 VanDerWaalsContact CG-CE1 3.41Å; M446-H670 WeakPolarHBondContact CG-CE1 3.04Å
447	E	65.6	Low	65.2	Low	57 Å²	57	52.2 Å²	52.2	27%	0.266	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-30.8	-178.8	-67.2	-171.9	170.1	0	0	111.8	F443 T444 K451 R528 K827	F443-E447 PolarHBondContact O-N 3.08Å; F443-E447 VanDerWaalsContact O-N 3.08Å; T444-E447 PolarHBondContact O-N 3.04Å; E447-K451 VanDerWaalsContact O-CG 3.24Å; E447-K451 WeakPolarHBondContact O-CG 3.3Å; E447-K451 PolarHBondContact O-N 3.23Å; E447-R528 IonicContact OE2-NH1 2.83Å; E447-K827 IonicContact OE1-NZ 3.97Å; E447-K827 PolarHBondContact OE1-NZ 3.36Å
448	Y	64.3	Low	64	Low	71 Å²	71	57.9 Å²	57.9	28%	0.278	28%	0.282	S	S	.	.	H	α-helix	trans	-66.4	-53.9	173.2	-178.7	-99.8	0	0	0	112	T444 K445 M446 I450 K451 V452	T444-Y448 PolarHBondContact O-N 3.41Å; T444-Y448 VanDerWaalsContact O-N 3.1Å; K445-Y448 PolarHBondContact O-N 3.14Å; M446-Y448 PolarHBondContact O-N 2.92Å; Y448-I450 VanDerWaalsContact C-N 3.33Å; Y448-I450 PolarHBondContact O-N 3.13Å; Y448-K451 WeakPolarHBondContact O-CB 3.42Å; Y448-K451 PolarHBondContact O-N 3.32Å; Y448-K451 VanDerWaalsContact O-N 3.1Å; Y448-V452 HydrophobicContact CD1-CG2 4.12Å; Y448-V452 HydrophobicContact CE1-CG2 3.69Å; Y448-V452 HydrophobicContact CE2-CG2 4.19Å; Y448-V452 WeakPolarHBondContact O-CG2 3.27Å; Y448-V452 PolarHBondContact O-N 3.09Å
449	L	57.1	Low	62.7	Low	32 Å²	32	59.5 Å²	59.5	17%	0.168	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-36.2	-177.2	-73.5	172.9	0	0	0	113	K445 M446 V452 Q453 F666	K445-L449 HydrophobicContact CG-CD1 4.05Å; K445-L449 WeakPolarHBondContact O-CG 3.45Å; K445-L449 PolarHBondContact O-N 3.45Å; M446-L449 PolarHBondContact O-N 3.42Å; L449-V452 PolarHBondContact O-N 3.39Å; L449-Q453 WeakPolarHBondContact O-CB 3.39Å; L449-Q453 PolarHBondContact O-N 3.3Å; L449-F666 HydrophobicContact CB-CD2 3.77Å; L449-F666 HydrophobicContact CB-CE2 3.51Å; L449-F666 HydrophobicContact CD1-CD2 4.02Å; L449-F666 HydrophobicContact CD1-CE2 3.64Å; L449-F666 HydrophobicContact CG-CE2 4.19Å
450	I	59.8	Low	61.5	Low	71 Å²	71	62.4 Å²	62.4	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-63.2	-44.5	173.9	-66.5	166	0	0	0	110.5	M446 Y448 V452 Q453 D454 F666	M446-I450 VanDerWaalsContact O-CG1 3.32Å; M446-I450 WeakPolarHBondContact O-CG1 3.47Å; M446-I450 PolarHBondContact O-N 3.35Å; Y448-I450 VanDerWaalsContact C-N 3.33Å; Y448-I450 PolarHBondContact O-N 3.13Å; I450-V452 PolarHBondContact O-N 2.99Å; I450-Q453 PolarHBondContact O-N 3.28Å; I450-D454 PolarHBondContact O-N 3.3Å; I450-F666 HydrophobicContact CD1-CE1 4.24Å; I450-F666 HydrophobicContact CG1-CD1 4.46Å; I450-F666 HydrophobicContact CG1-CE1 4.37Å; I450-F666 HydrophobicContact CG1-CZ 4.47Å
451	K	65	Low	60.2	Low	138 Å²	138	65.3 Å²	65.3	60%	0.6	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-40.3	177.5	-75.8	174.9	178.9	-174.2	0	112.5	E447 Y448 S455	E447-K451 VanDerWaalsContact O-CG 3.24Å; E447-K451 WeakPolarHBondContact O-CG 3.3Å; E447-K451 PolarHBondContact O-N 3.23Å; Y448-K451 WeakPolarHBondContact O-CB 3.42Å; Y448-K451 PolarHBondContact O-N 3.32Å; Y448-K451 VanDerWaalsContact O-N 3.1Å; K451-S455 WeakPolarHBondContact O-CB 3.45Å; K451-S455 PolarHBondContact O-N 3.23Å; K451-S455 PolarHBondContact O-OG 3.29Å
452	V	60.1	Low	58.9	Low	28 Å²	28	69.6 Å²	69.6	17%	0.17	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-45.9	176.6	173.3	0	0	0	0	109.8	Y448 L449 I450 S455 L456 F491	Y448-V452 HydrophobicContact CD1-CG2 4.12Å; Y448-V452 HydrophobicContact CE1-CG2 3.69Å; Y448-V452 HydrophobicContact CE2-CG2 4.19Å; Y448-V452 WeakPolarHBondContact O-CG2 3.27Å; Y448-V452 PolarHBondContact O-N 3.09Å; L449-V452 PolarHBondContact O-N 3.39Å; I450-V452 PolarHBondContact O-N 2.99Å; V452-S455 PolarHBondContact O-N 3.35Å; V452-L456 HydrophobicContact CG1-CD1 4.14Å; V452-L456 WeakPolarHBondContact O-CB 3.43Å; V452-L456 PolarHBondContact O-N 2.91Å; V452-F491 HydrophobicContact CG1-CZ 4.42Å
453	Q	53.1	Low	57.8	Low	109 Å²	109	70.4 Å²	70.4	51%	0.509	34%	0.341	S	S	.	.	H	α-helix	trans	-60.1	-47.5	177.4	-175	69.7	0.7	0	0	112.3	L449 I450 S455 L456 Q457	L449-Q453 WeakPolarHBondContact O-CB 3.39Å; L449-Q453 PolarHBondContact O-N 3.3Å; I450-Q453 PolarHBondContact O-N 3.28Å; Q453-S455 VanDerWaalsContact C-N 3.25Å; Q453-S455 PolarHBondContact O-N 2.96Å; Q453-L456 PolarHBondContact O-N 3.06Å; Q453-Q457 PolarHBondContact O-N 3.47Å
454	D	59.7	Low	56.4	Low	78 Å²	78	72.8 Å²	72.8	42%	0.417	36%	0.359	S	S	.	.	H	α-helix	trans	-61	-37.1	176.6	-77.2	-3.1	0	0	0	111.5	I450 K458	I450-D454 PolarHBondContact O-N 3.3Å; D454-K458 VanDerWaalsContact O-CG 3.25Å; D454-K458 WeakPolarHBondContact O-CG 3.25Å; D454-K458 PolarHBondContact O-N 2.95Å; D454-K458 VanDerWaalsContact O-N 3.08Å
455	S	61.7	Low	55.1	Low	44 Å²	44	74.9 Å²	74.9	31%	0.308	37%	0.371	S	S	.	.	H	α-helix	trans	-72.4	-38.3	178.4	-54.6	0	0	0	0	111.7	K451 V452 Q453 K458 L459	K451-S455 WeakPolarHBondContact O-CB 3.45Å; K451-S455 PolarHBondContact O-N 3.23Å; K451-S455 PolarHBondContact O-OG 3.29Å; V452-S455 PolarHBondContact O-N 3.35Å; Q453-S455 VanDerWaalsContact C-N 3.25Å; Q453-S455 PolarHBondContact O-N 2.96Å; S455-K458 PolarHBondContact O-N 3.35Å; S455-L459 WeakPolarHBondContact O-CB 3.34Å; S455-L459 PolarHBondContact O-N 3.37Å
456	L	52.7	Low	53.9	Low	52 Å²	52	77.4 Å²	77.4	27%	0.272	39%	0.388	S	S	.	.	H	α-helix	trans	-65.9	-41.5	175.2	-121.7	143.2	0	0	0	111.3	V452 Q453 K458 L459 Q460 F491	V452-L456 HydrophobicContact CG1-CD1 4.14Å; V452-L456 WeakPolarHBondContact O-CB 3.43Å; V452-L456 PolarHBondContact O-N 2.91Å; Q453-L456 PolarHBondContact O-N 3.06Å; L456-K458 VanDerWaalsContact C-N 3.33Å; L456-L459 PolarHBondContact O-N 3.38Å; L456-Q460 VanDerWaalsContact O-CB 3.25Å; L456-Q460 WeakPolarHBondContact O-CB 2.92Å; L456-Q460 PolarHBondContact O-N 2.91Å; L456-F491 HydrophobicContact CD1-CE2 3.71Å; L456-F491 HydrophobicContact CD1-CZ 3.71Å; L456-F491 HydrophobicContact CG-CE2 4.32Å
457	Q	54.3	Low	52.7	Low	119 Å²	119	80.2 Å²	80.2	56%	0.556	40%	0.404	S	S	*	.	H	α-helix	trans	-63	-40.4	173.5	-76.7	-173.5	-76.9	0	0	111.8	Q453 F461	Q453-Q457 PolarHBondContact O-N 3.47Å; Q457-F461 WeakPolarHBondContact O-CB 3.16Å; Q457-F461 PolarHBondContact O-N 3.3Å
458	K	57.8	Low	51.2	Low	138 Å²	138	81.8 Å²	81.8	60%	0.6	43%	0.426	S	S	*	.	H	α-helix	trans	-65.1	-47.5	174.5	-74.1	170.6	-174.5	175.8	0	112.3	D454 S455 L456 Q460 F461 D462	D454-K458 VanDerWaalsContact O-CG 3.25Å; D454-K458 WeakPolarHBondContact O-CG 3.25Å; D454-K458 PolarHBondContact O-N 2.95Å; D454-K458 VanDerWaalsContact O-N 3.08Å; S455-K458 PolarHBondContact O-N 3.35Å; L456-K458 VanDerWaalsContact C-N 3.33Å; K458-Q460 VanDerWaalsContact C-N 3.31Å; K458-Q460 PolarHBondContact O-N 3.06Å; K458-F461 CarbonylContact O-C 3.59Å; K458-F461 WeakPolarHBondContact O-CA 3.43Å; K458-F461 WeakPolarHBondContact O-CB 3.47Å; K458-F461 PolarHBondContact O-N 3Å; K458-F461 VanDerWaalsContact O-N 3.13Å; K458-D462 PolarHBondContact O-N 2.81Å
459	L	49	Very low	50.1	Low	55 Å²	55	82.1 Å²	82.1	29%	0.288	44%	0.439	S	S	.	.	H	α-helix	trans	-65.2	-35.1	178.4	-82.9	157.5	0	0	0	112.5	S455 L456 F461 D462 L463 I494	S455-L459 WeakPolarHBondContact O-CB 3.34Å; S455-L459 PolarHBondContact O-N 3.37Å; L456-L459 PolarHBondContact O-N 3.38Å; L459-F461 VanDerWaalsContact C-N 3.32Å; L459-D462 PolarHBondContact O-N 3.15Å; L459-L463 WeakPolarHBondContact O-CB 3.24Å; L459-L463 WeakPolarHBondContact O-CD1 3.41Å; L459-L463 PolarHBondContact O-N 2.9Å; L459-I494 HydrophobicContact CD1-CD1 3.21Å; L459-I494 HydrophobicContact CD1-CG1 4.09Å
460	Q	48	Very low	49	Very low	82 Å²	82	87.1 Å²	87.1	38%	0.383	47%	0.466	S	S	.	.	H	α-helix	trans	-68.6	-35.8	174.5	-169.4	158.1	-51.9	0	0	111.1	L456 K458 T464	L456-Q460 VanDerWaalsContact O-CB 3.25Å; L456-Q460 WeakPolarHBondContact O-CB 2.92Å; L456-Q460 PolarHBondContact O-N 2.91Å; K458-Q460 VanDerWaalsContact C-N 3.31Å; K458-Q460 PolarHBondContact O-N 3.06Å; Q460-T464 WeakPolarHBondContact O-CB 3.23Å; Q460-T464 VanDerWaalsContact O-CG2 3.24Å; Q460-T464 WeakPolarHBondContact O-CG2 3.5Å; Q460-T464 PolarHBondContact O-N 3.26Å; Q460-T464 PolarHBondContact O-OG1 3Å
461	F	48.9	Very low	47.6	Very low	145 Å²	145	90 Å²	90	64%	0.636	48%	0.481	S	S	*	.	H	α-helix	trans	-65.1	-42.8	171.1	-168.3	-95.1	0	0	0	111.1	Q457 K458 L459 T464 V465	Q457-F461 WeakPolarHBondContact O-CB 3.16Å; Q457-F461 PolarHBondContact O-N 3.3Å; K458-F461 CarbonylContact O-C 3.59Å; K458-F461 WeakPolarHBondContact O-CA 3.43Å; K458-F461 WeakPolarHBondContact O-CB 3.47Å; K458-F461 PolarHBondContact O-N 3Å; K458-F461 VanDerWaalsContact O-N 3.13Å; L459-F461 VanDerWaalsContact C-N 3.32Å; F461-T464 WeakPolarHBondContact CA-OG1 3.3Å; F461-T464 PolarHBondContact O-N 3.12Å; F461-T464 PolarHBondContact O-OG1 3.38Å; F461-V465 HydrophobicContact CD1-CG2 4.32Å; F461-V465 HydrophobicContact CE1-CG2 4.15Å; F461-V465 WeakPolarHBondContact O-CB 3.43Å; F461-V465 WeakPolarHBondContact O-CG2 3.31Å; F461-V465 PolarHBondContact O-N 2.87Å
462	D	44.4	Very low	46.1	Very low	91 Å²	91	88.1 Å²	88.1	49%	0.487	48%	0.483	S	S	.	.	H	α-helix	trans	-69.3	-44.1	179.2	-68.6	-23.4	0	0	0	112.1	K458 L459 T464 V465 T466	K458-D462 PolarHBondContact O-N 2.81Å; L459-D462 PolarHBondContact O-N 3.15Å; D462-T464 VanDerWaalsContact C-N 3.32Å; D462-T464 PolarHBondContact O-N 3.2Å; D462-V465 PolarHBondContact O-N 2.95Å; D462-T466 WeakPolarHBondContact O-CG2 3.13Å; D462-T466 PolarHBondContact O-N 3.31Å; D462-T466 PolarHBondContact O-OG1 3.37Å; D462-T466 VanDerWaalsContact O-OG1 3.1Å
463	L	42.2	Very low	44.7	Very low	57 Å²	57	92.4 Å²	92.4	30%	0.298	51%	0.511	S	S	.	.	H	α-helix	trans	-65.5	-32.5	176.9	-101.3	111.5	0	0	0	113.1	L459 T466 N467	L459-L463 WeakPolarHBondContact O-CB 3.24Å; L459-L463 WeakPolarHBondContact O-CD1 3.41Å; L459-L463 PolarHBondContact O-N 2.9Å; L463-T466 WeakPolarHBondContact CA-OG1 3.35Å; L463-T466 PolarHBondContact O-OG1 3.11Å; L463-N467 VanDerWaalsContact O-CB 3.27Å; L463-N467 WeakPolarHBondContact O-CB 3.13Å; L463-N467 PolarHBondContact O-N 3.12Å; L463-N467 PolarHBondContact O-ND2 3.05Å
464	T	41.7	Very low	43.6	Very low	81 Å²	81	96.2 Å²	96.2	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-73.7	-34	174.9	49.5	0	0	0	0	111.5	Q460 F461 D462 A468	Q460-T464 WeakPolarHBondContact O-CB 3.23Å; Q460-T464 VanDerWaalsContact O-CG2 3.24Å; Q460-T464 WeakPolarHBondContact O-CG2 3.5Å; Q460-T464 PolarHBondContact O-N 3.26Å; Q460-T464 PolarHBondContact O-OG1 3Å; F461-T464 WeakPolarHBondContact CA-OG1 3.3Å; F461-T464 PolarHBondContact O-N 3.12Å; F461-T464 PolarHBondContact O-OG1 3.38Å; D462-T464 VanDerWaalsContact C-N 3.32Å; D462-T464 PolarHBondContact O-N 3.2Å; T464-A468 VanDerWaalsContact O-CB 3.32Å; T464-A468 WeakPolarHBondContact O-CB 3.31Å; T464-A468 PolarHBondContact O-N 2.85Å
465	V	42	Very low	42.1	Very low	79 Å²	79	104 Å²	104	48%	0.479	55%	0.553	S	S	.	*	H	α-helix	trans	-71.5	-38.5	172.9	173.4	0	0	0	0	112.1	F461 D462 S469	F461-V465 HydrophobicContact CD1-CG2 4.32Å; F461-V465 HydrophobicContact CE1-CG2 4.15Å; F461-V465 WeakPolarHBondContact O-CB 3.43Å; F461-V465 WeakPolarHBondContact O-CG2 3.31Å; F461-V465 PolarHBondContact O-N 2.87Å; D462-V465 PolarHBondContact O-N 2.95Å; V465-S469 PolarHBondContact O-N 3.49Å; V465-S469 PolarHBondContact O-OG 3.24Å
466	T	41.6	Very low	40.7	Very low	70 Å²	70	108.9 Å²	108.9	43%	0.429	58%	0.581	S	S	.	*	H	α-helix	trans	-78	-37.1	179.6	55.2	0	0	0	0	113.3	D462 L463 A468 S469 D470	D462-T466 WeakPolarHBondContact O-CG2 3.13Å; D462-T466 PolarHBondContact O-N 3.31Å; D462-T466 PolarHBondContact O-OG1 3.37Å; D462-T466 VanDerWaalsContact O-OG1 3.1Å; L463-T466 WeakPolarHBondContact CA-OG1 3.35Å; L463-T466 PolarHBondContact O-OG1 3.11Å; T466-A468 PolarHBondContact O-N 2.85Å; T466-S469 WeakPolarHBondContact CA-OG 3.44Å; T466-S469 PolarHBondContact O-N 3.46Å; T466-S469 VanDerWaalsContact O-N 3.09Å; T466-S469 PolarHBondContact O-OG 3.35Å; T466-D470 PolarHBondContact O-N 2.8Å
467	N	37.8	Very low	39.6	Very low	88 Å²	88	114.2 Å²	114.2	47%	0.471	61%	0.609	S	S	.	*	H	α-helix	trans	-68.2	-25	172.3	-76.7	-18.7	0	0	0	112	L463 S469 L471	L463-N467 VanDerWaalsContact O-CB 3.27Å; L463-N467 WeakPolarHBondContact O-CB 3.13Å; L463-N467 PolarHBondContact O-N 3.12Å; L463-N467 PolarHBondContact O-ND2 3.05Å; N467-S469 VanDerWaalsContact C-N 3.27Å; N467-S469 PolarHBondContact O-N 2.66Å; N467-L471 HydrophobicContact CB-CD1 4.3Å; N467-L471 WeakPolarHBondContact O-CD1 3.49Å
468	A	34.8	Very low	38.6	Very low	89 Å²	89	111.4 Å²	111.4	74%	0.736	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-14.5	172.1	0	0	0	0	0	113.6	T464 T466	T464-A468 VanDerWaalsContact O-CB 3.32Å; T464-A468 WeakPolarHBondContact O-CB 3.31Å; T464-A468 PolarHBondContact O-N 2.85Å; T466-A468 PolarHBondContact O-N 2.85Å
469	S	40.9	Very low	37.5	Very low	79 Å²	79	110.3 Å²	110.3	55%	0.552	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-20.4	-175.2	35.5	0	0	0	0	115.4	V465 T466 N467	V465-S469 PolarHBondContact O-N 3.49Å; V465-S469 PolarHBondContact O-OG 3.24Å; T466-S469 WeakPolarHBondContact CA-OG 3.44Å; T466-S469 PolarHBondContact O-N 3.46Å; T466-S469 VanDerWaalsContact O-N 3.09Å; T466-S469 PolarHBondContact O-OG 3.35Å; N467-S469 VanDerWaalsContact C-N 3.27Å; N467-S469 PolarHBondContact O-N 2.66Å
470	D	34.7	Very low	37.1	Very low	136 Å²	136	113.8 Å²	113.8	73%	0.727	63%	0.632	S	S	*	*	S	Bend	trans	-129	21.8	-171.6	-78	-36.6	0	0	0	116.9	T466 P472	T466-D470 PolarHBondContact O-N 2.8Å; D470-P472 WeakPolarHBondContact O-CD 3.49Å
471	L	30	Very low	36.7	Very low	131 Å²	131	113.6 Å²	113.6	69%	0.686	64%	0.636	S	S	*	*			trans	-90.8	110.7	177.4	-92.7	161.4	0	0	0	113.1	N467	N467-L471 HydrophobicContact CB-CD1 4.3Å; N467-L471 WeakPolarHBondContact O-CD1 3.49Å
472	P	32.4	Very low	36.4	Very low	99 Å²	99	108.9 Å²	108.9	64%	0.643	62%	0.624	S	S	*	*			trans	-65.3	141.7	160.8	27.4	-32.2	0	0	0	109.5	D470	D470-P472 WeakPolarHBondContact O-CD 3.49Å
473	P	31.5	Very low	36.1	Very low	118 Å²	118	109.3 Å²	109.3	77%	0.766	63%	0.626	S	S	*	*	S	Bend	trans	-69.5	140.2	-179.5	31.4	-32.1	0	0	0	108.4
474	Q	28.9	Very low	36.1	Very low	190 Å²	190	114 Å²	114	89%	0.888	64%	0.644	S	S	*	*			trans	87.9	74.2	175.8	-50.9	179.4	-14.3	0	0	117
475	R	29.8	Very low	36.4	Very low	242 Å²	242	117.8 Å²	117.8	91%	0.913	65%	0.649	S	S	*	*			trans	-135.9	121.7	133.2	-88.9	-171.8	-172.3	149.9	4.3	109.6	L477	R475-L477 PolarHBondContact O-N 3.21Å
476	T	30.7	Very low	36.6	Very low	146 Å²	146	118.7 Å²	118.7	90%	0.896	65%	0.651	S	S	*	*			trans	-55.7	104	174.3	45.7	0	0	0	0	110	G478	T476-G478 PolarHBondContact O-N 3.46Å
477	L	30.8	Very low	36.9	Very low	163 Å²	163	118.5 Å²	118.5	85%	0.853	65%	0.649	S	S	*	*			trans	-75	69.9	179.5	-168.4	75.4	0	0	0	110	R475	R475-L477 PolarHBondContact O-N 3.21Å
478	G	33.6	Very low	37.4	Very low	61 Å²	61	122.7 Å²	122.7	63%	0.629	66%	0.659	S	S	*	*			trans	-95.5	-10.4	173.6	0	0	0	0	0	114.2	T476 N480	T476-G478 PolarHBondContact O-N 3.46Å; G478-N480 PolarHBondContact O-N 2.99Å
479	D	33.5	Very low	38.1	Very low	115 Å²	115	123.6 Å²	123.6	62%	0.615	65%	0.648	S	S	*	*			trans	-101	86.3	-176	-84.8	-15.2	0	0	0	111.6	T481 A482	D479-T481 PolarHBondContact O-N 3.25Å; D479-A482 PolarHBondContact O-N 3.47Å
480	N	40.4	Very low	38.3	Very low	127 Å²	127	120.9 Å²	120.9	68%	0.679	63%	0.63	S	S	*	*	H	α-helix	trans	-50.4	-25.6	167.9	-71.8	-36.7	0	0	0	112.3	G478 A482 F484	G478-N480 PolarHBondContact O-N 2.99Å; N480-A482 PolarHBondContact O-N 3.23Å; N480-F484 VanDerWaalsContact O-CD2 3.26Å; N480-F484 WeakPolarHBondContact O-CD2 3.41Å; N480-F484 PolarHBondContact O-N 2.98Å
481	T	40.2	Very low	38.7	Very low	79 Å²	79	116.9 Å²	116.9	49%	0.485	61%	0.606	S	S	.	*	H	α-helix	trans	-63.2	-29.6	175.4	26.9	0	0	0	0	114.7	D479 R485	D479-T481 PolarHBondContact O-N 3.25Å; T481-R485 WeakPolarHBondContact O-CG 3.3Å; T481-R485 PolarHBondContact O-N 3.49Å; T481-R485 VanDerWaalsContact O-N 3.15Å
482	A	42.1	Very low	39.7	Very low	45 Å²	45	117 Å²	117	37%	0.372	60%	0.603	S	S	.	*	H	α-helix	trans	-76.2	-41.3	-179.2	0	0	0	0	0	112.2	D479 N480 R485 L486	D479-A482 PolarHBondContact O-N 3.47Å; N480-A482 PolarHBondContact O-N 3.23Å; A482-R485 PolarHBondContact O-N 3Å; A482-L486 PolarHBondContact O-N 2.67Å
483	L	39	Very low	40.2	Very low	101 Å²	101	119.2 Å²	119.2	53%	0.529	61%	0.605	S	S	.	*	H	α-helix	trans	-63.8	-43	174.3	-173.7	71.4	0	0	0	111.1	R485 L486 V487	L483-R485 VanDerWaalsContact C-N 3.26Å; L483-R485 PolarHBondContact O-N 3.38Å; L483-L486 PolarHBondContact O-N 3.37Å; L483-V487 WeakPolarHBondContact O-CG2 3.1Å; L483-V487 PolarHBondContact O-N 3.48Å
484	F	42	Very low	40.9	Very low	155 Å²	155	116.9 Å²	116.9	68%	0.68	59%	0.585	S	S	*	*	H	α-helix	trans	-62.3	-31.7	174.6	-90.9	-71.3	0	0	0	113.1	N480 R488	N480-F484 VanDerWaalsContact O-CD2 3.26Å; N480-F484 WeakPolarHBondContact O-CD2 3.41Å; N480-F484 PolarHBondContact O-N 2.98Å; F484-R488 WeakPolarHBondContact O-CB 3.39Å; F484-R488 PolarHBondContact O-N 3.24Å; F484-R488 VanDerWaalsContact O-N 3.12Å
485	R	46.9	Very low	41.6	Very low	160 Å²	160	112.1 Å²	112.1	60%	0.604	57%	0.566	S	S	*	*	H	α-helix	trans	-70.7	-47.4	173.6	-79.4	179.3	-174.2	145	1.6	111.9	T481 A482 L483 V487 R488 E489	T481-R485 WeakPolarHBondContact O-CG 3.3Å; T481-R485 PolarHBondContact O-N 3.49Å; T481-R485 VanDerWaalsContact O-N 3.15Å; A482-R485 PolarHBondContact O-N 3Å; L483-R485 VanDerWaalsContact C-N 3.26Å; L483-R485 PolarHBondContact O-N 3.38Å; R485-V487 PolarHBondContact O-N 3.32Å; R485-R488 CarbonylContact O-C 3.52Å; R485-R488 WeakPolarHBondContact O-CB 3.35Å; R485-R488 PolarHBondContact O-N 2.84Å; R485-R488 VanDerWaalsContact O-N 3.14Å; R485-E489 WeakPolarHBondContact O-CB 3.28Å; R485-E489 WeakPolarHBondContact O-CG 3.27Å; R485-E489 PolarHBondContact O-N 3.27Å
486	L	47.1	Very low	42.1	Very low	98 Å²	98	102.9 Å²	102.9	51%	0.513	55%	0.546	S	S	.	.	H	α-helix	trans	-61.7	-41.7	178.2	-80.1	167.1	0	0	0	112.4	A482 L483 R488 E489 A490	A482-L486 PolarHBondContact O-N 2.67Å; L483-L486 PolarHBondContact O-N 3.37Å; L486-R488 VanDerWaalsContact C-N 3.33Å; L486-R488 PolarHBondContact O-N 3.44Å; L486-E489 PolarHBondContact O-N 2.82Å; L486-A490 WeakPolarHBondContact O-CB 3.49Å; L486-A490 PolarHBondContact O-N 2.79Å
487	V	46.7	Very low	42.6	Very low	66 Å²	66	103.8 Å²	103.8	40%	0.4	54%	0.54	S	S	.	.	H	α-helix	trans	-65.8	-37.4	175.3	174.2	0	0	0	0	111.2	L483 R485 F491	L483-V487 WeakPolarHBondContact O-CG2 3.1Å; L483-V487 PolarHBondContact O-N 3.48Å; R485-V487 PolarHBondContact O-N 3.32Å; V487-F491 HydrophobicContact CG1-CD2 4.46Å; V487-F491 WeakPolarHBondContact O-CB 3.38Å; V487-F491 PolarHBondContact O-N 3.43Å
488	R	48.9	Very low	42.8	Very low	177 Å²	177	103.1 Å²	103.1	67%	0.668	54%	0.536	S	S	*	.	H	α-helix	trans	-68.1	-39.7	175.1	176.8	177.7	-95.5	158.7	-8.2	112.2	F484 R485 L486 F491 Q492	F484-R488 WeakPolarHBondContact O-CB 3.39Å; F484-R488 PolarHBondContact O-N 3.24Å; F484-R488 VanDerWaalsContact O-N 3.12Å; R485-R488 CarbonylContact O-C 3.52Å; R485-R488 WeakPolarHBondContact O-CB 3.35Å; R485-R488 PolarHBondContact O-N 2.84Å; R485-R488 VanDerWaalsContact O-N 3.14Å; L486-R488 VanDerWaalsContact C-N 3.33Å; L486-R488 PolarHBondContact O-N 3.44Å; R488-F491 WeakPolarHBondContact O-CB 3.43Å; R488-F491 PolarHBondContact O-N 3.22Å; R488-Q492 WeakPolarHBondContact O-CG 3.42Å; R488-Q492 PolarHBondContact O-N 3Å
489	E	49.6	Very low	42.9	Very low	107 Å²	107	101.7 Å²	101.7	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-41.7	176.3	-75.3	170.8	-172.2	0	0	111.2	R485 L486 F491 Q492 Q493	R485-E489 WeakPolarHBondContact O-CB 3.28Å; R485-E489 WeakPolarHBondContact O-CG 3.27Å; R485-E489 PolarHBondContact O-N 3.27Å; L486-E489 PolarHBondContact O-N 2.82Å; E489-F491 PolarHBondContact O-N 2.99Å; E489-Q492 PolarHBondContact O-N 3.24Å; E489-Q493 PolarHBondContact O-N 3.42Å
490	A	45.1	Very low	43.1	Very low	22 Å²	22	99 Å²	99	18%	0.182	52%	0.516	C	S	.	.	H	α-helix	trans	-62.2	-41.3	172.6	0	0	0	0	0	111.8	L486 Q492 Q493 I494	L486-A490 WeakPolarHBondContact O-CB 3.49Å; L486-A490 PolarHBondContact O-N 2.79Å; A490-Q492 VanDerWaalsContact C-N 3.34Å; A490-Q492 PolarHBondContact O-N 3Å; A490-Q493 PolarHBondContact O-N 2.9Å; A490-I494 WeakPolarHBondContact O-CD1 3.46Å; A490-I494 VanDerWaalsContact O-CG1 3.31Å; A490-I494 WeakPolarHBondContact O-CG1 3.03Å; A490-I494 PolarHBondContact O-N 2.9Å
491	F	43.7	Very low	42.9	Very low	53 Å²	53	100.2 Å²	100.2	23%	0.232	52%	0.522	C	S	.	.	H	α-helix	trans	-59.9	-42.9	173.6	-114.4	-89.7	0	0	0	112.2	H378 V452 L456 V487 R488 E489 Q493 I494 D495	H378-F491 AromaticContact CE1-CE1 3.51Å; H378-F491 AromaticContact CE1-CZ 3.63Å; H378-F491 AromaticContact ND1-CE1 3.64Å; H378-F491 AromaticContact ND1-CZ 3.94Å; V452-F491 HydrophobicContact CG1-CZ 4.42Å; L456-F491 HydrophobicContact CD1-CE2 3.71Å; L456-F491 HydrophobicContact CD1-CZ 3.71Å; L456-F491 HydrophobicContact CG-CE2 4.32Å; V487-F491 HydrophobicContact CG1-CD2 4.46Å; V487-F491 WeakPolarHBondContact O-CB 3.38Å; V487-F491 PolarHBondContact O-N 3.43Å; R488-F491 WeakPolarHBondContact O-CB 3.43Å; R488-F491 PolarHBondContact O-N 3.22Å; E489-F491 PolarHBondContact O-N 2.99Å; F491-Q493 VanDerWaalsContact C-N 3.32Å; F491-Q493 PolarHBondContact O-N 3.36Å; F491-I494 PolarHBondContact O-N 2.96Å; F491-D495 PolarHBondContact O-N 3.27Å
492	Q	50.5	Low	42.7	Very low	134 Å²	134	99.7 Å²	99.7	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-67	-31.5	177.4	-77.9	-178.4	-38.6	0	0	113.1	R488 E489 A490 G496	R488-Q492 WeakPolarHBondContact O-CG 3.42Å; R488-Q492 PolarHBondContact O-N 3Å; E489-Q492 PolarHBondContact O-N 3.24Å; A490-Q492 VanDerWaalsContact C-N 3.34Å; A490-Q492 PolarHBondContact O-N 3Å; Q492-G496 PolarHBondContact O-N 3.01Å
493	Q	43.7	Very low	42.4	Very low	145 Å²	145	104.1 Å²	104.1	68%	0.678	54%	0.543	S	S	*	.	H	α-helix	trans	-68	-37.8	175	-101.4	173.5	-30.2	0	0	112.7	E489 A490 F491 G496 E497	E489-Q493 PolarHBondContact O-N 3.42Å; A490-Q493 PolarHBondContact O-N 2.9Å; F491-Q493 VanDerWaalsContact C-N 3.32Å; F491-Q493 PolarHBondContact O-N 3.36Å; Q493-G496 PolarHBondContact O-N 2.8Å; Q493-E497 PolarHBondContact O-N 3.24Å
494	I	46.2	Very low	42.2	Very low	69 Å²	69	106.7 Å²	106.7	35%	0.354	56%	0.557	S	S	.	*	H	α-helix	trans	-69.2	-38.6	178.8	-60	158.1	0	0	0	111.1	L459 A490 F491 G496	L459-I494 HydrophobicContact CD1-CD1 3.21Å; L459-I494 HydrophobicContact CD1-CG1 4.09Å; A490-I494 WeakPolarHBondContact O-CD1 3.46Å; A490-I494 VanDerWaalsContact O-CG1 3.31Å; A490-I494 WeakPolarHBondContact O-CG1 3.03Å; A490-I494 PolarHBondContact O-N 2.9Å; F491-I494 PolarHBondContact O-N 2.96Å; I494-G496 VanDerWaalsContact C-N 3.33Å
495	D	42.5	Very low	41.9	Very low	90 Å²	90	102.5 Å²	102.5	48%	0.481	55%	0.551	S	S	.	*	H	α-helix	trans	-71.8	-28.5	175.3	-73.9	-28.2	0	0	0	112.2	F491 G499	F491-D495 PolarHBondContact O-N 3.27Å; D495-G499 PolarHBondContact O-N 3.19Å
496	G	40.4	Very low	41.3	Very low	47 Å²	47	100.1 Å²	100.1	49%	0.485	56%	0.559	S	S	.	*	H	α-helix	trans	-71.3	-37.1	179.3	0	0	0	0	0	114.4	Q492 Q493 I494	Q492-G496 PolarHBondContact O-N 3.01Å; Q493-G496 PolarHBondContact O-N 2.8Å; I494-G496 VanDerWaalsContact C-N 3.33Å
497	E	40.9	Very low	40.6	Very low	165 Å²	165	99.6 Å²	99.6	77%	0.771	57%	0.568	S	S	*	*	H	α-helix	trans	-76.1	-24.6	178.4	-80.5	-168.2	145.3	0	0	113.3	Q493	Q493-E497 PolarHBondContact O-N 3.24Å
498	L	36.8	Very low	40	Very low	149 Å²	149	102.2 Å²	102.2	78%	0.78	59%	0.585	S	S	*	*	H	α-helix	trans	-88.8	-17.1	177.8	-133.1	75.6	0	0	0	113.5
499	G	35.3	Very low	39.3	Very low	32 Å²	32	98.3 Å²	98.3	33%	0.33	59%	0.59	S	S	.	*	H	α-helix	trans	-89.1	-16.1	177.9	0	0	0	0	0	115.2	D495 D501 A502	D495-G499 PolarHBondContact O-N 3.19Å; G499-D501 VanDerWaalsContact C-N 3.31Å; G499-D501 PolarHBondContact O-N 3.02Å; G499-A502 PolarHBondContact O-N 3.37Å
500	A	37	Very low	38.4	Very low	59 Å²	59	99.6 Å²	99.6	49%	0.488	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-25.2	-176.7	0	0	0	0	0	113.7
501	D	35.8	Very low	37.9	Very low	151 Å²	151	102.3 Å²	102.3	81%	0.807	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-6.6	178.4	-72	-17.5	0	0	0	113.9	G499	G499-D501 VanDerWaalsContact C-N 3.31Å; G499-D501 PolarHBondContact O-N 3.02Å
502	A	37.5	Very low	37.4	Very low	69 Å²	69	105.3 Å²	105.3	57%	0.57	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-15.5	177.8	0	0	0	0	0	113.7	G499 N504 A505	G499-A502 PolarHBondContact O-N 3.37Å; A502-N504 VanDerWaalsContact C-N 3.31Å; A502-N504 PolarHBondContact O-N 3.34Å; A502-A505 PolarHBondContact O-N 3.33Å
503	L	34.4	Very low	36.6	Very low	137 Å²	137	105.1 Å²	105.1	72%	0.717	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-7.1	-174.6	-91	147.9	0	0	0	114.9
504	N	34.7	Very low	36.2	Very low	156 Å²	156	103.9 Å²	103.9	83%	0.834	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	6.5	170.4	-73.2	-24	0	0	0	113.9	A502	A502-N504 VanDerWaalsContact C-N 3.31Å; A502-N504 PolarHBondContact O-N 3.34Å
505	A	35.2	Very low	35.8	Very low	66 Å²	66	105.1 Å²	105.1	55%	0.545	67%	0.67	S	S	.	*			trans	-97.4	14	-178	0	0	0	0	0	114.8	A502 A507	A502-A505 PolarHBondContact O-N 3.33Å; A505-A507 PolarHBondContact O-N 3.36Å; A505-A507 VanDerWaalsContact O-N 3.08Å
506	S	35.1	Very low	35.4	Very low	111 Å²	111	106.6 Å²	106.6	78%	0.776	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	5.8	178.2	56.9	0	0	0	0	114.9
507	A	32.5	Very low	35.3	Very low	86 Å²	86	112.8 Å²	112.8	71%	0.711	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	5	-177.5	0	0	0	0	0	116	A505	A505-A507 PolarHBondContact O-N 3.36Å; A505-A507 VanDerWaalsContact O-N 3.08Å
508	V	34.9	Very low	35.3	Very low	122 Å²	122	111.3 Å²	111.3	74%	0.739	68%	0.684	S	S	*	*			trans	-105.1	12.2	-172.6	-170.6	0	0	0	0	114	T510	V508-T510 PolarHBondContact O-N 3.49Å
509	A	33.6	Very low	35.4	Very low	95 Å²	95	110.9 Å²	110.9	79%	0.785	68%	0.682	S	S	*	*	S	Bend	trans	-71.2	3.3	-177.1	0	0	0	0	0	116
510	T	31.4	Very low	35.5	Very low	134 Å²	134	113.9 Å²	113.9	82%	0.822	69%	0.689	S	S	*	*	S	Bend	trans	-148.3	64.5	-176.4	49.8	0	0	0	0	113.9	V508	V508-T510 PolarHBondContact O-N 3.49Å
511	A	33.2	Very low	35.7	Very low	79 Å²	79	113.9 Å²	113.9	65%	0.653	68%	0.684	S	S	*	*			trans	-153.4	106.3	166.8	0	0	0	0	0	114.3
512	T	33.3	Very low	35.8	Very low	116 Å²	116	113.6 Å²	113.6	71%	0.712	68%	0.676	S	S	*	*			trans	26.9	134.6	148.2	59.5	0	0	0	0	121	I514	T512-I514 PolarHBondContact O-N 2.98Å
513	P	35.2	Very low	36.2	Very low	130 Å²	130	115.8 Å²	115.8	84%	0.844	67%	0.674	S	S	*	*			trans	-68.8	107.7	179.7	29.9	-33	0	0	0	111.6
514	I	35.3	Very low	36.4	Very low	119 Å²	119	113.5 Å²	113.5	61%	0.61	66%	0.659	S	S	*	*			trans	-74	133.6	172.3	-59.3	169.1	0	0	0	108.6	T512 H518	T512-I514 PolarHBondContact O-N 2.98Å; I514-H518 HydrophobicContact CG2-CB 4.07Å
515	P	35.9	Very low	36.7	Very low	95 Å²	95	113.3 Å²	113.3	62%	0.617	65%	0.651	S	S	*	*			trans	-61.8	141.9	-175.8	21.7	-32.3	0	0	0	113.8	F517 H518	P515-F517 PolarHBondContact O-N 2.66Å; P515-H518 PolarHBondContact O-N 3.33Å; P515-H518 VanDerWaalsContact O-N 3.1Å
516	L	36.1	Very low	37	Very low	121 Å²	121	113.6 Å²	113.6	63%	0.634	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.2	-14.2	-174.7	-148.4	95.1	0	0	0	117.2	H518	L516-H518 VanDerWaalsContact C-N 3.34Å
517	F	37.5	Very low	37.4	Very low	176 Å²	176	112 Å²	112	77%	0.772	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-11.5	177.6	-83.5	-83.4	0	0	0	114.1	P515 I520	P515-F517 PolarHBondContact O-N 2.66Å; F517-I520 HydrophobicContact CD1-CD1 4.24Å
518	H	41.3	Very low	38	Very low	135 Å²	135	115.7 Å²	115.7	63%	0.625	62%	0.624	S	S	*	*	S	Bend	trans	-97.7	-3.5	174.4	-97.9	-85.4	0	0	0	114.6	I514 P515 L516 I520	I514-H518 HydrophobicContact CG2-CB 4.07Å; P515-H518 PolarHBondContact O-N 3.33Å; P515-H518 VanDerWaalsContact O-N 3.1Å; L516-H518 VanDerWaalsContact C-N 3.34Å; H518-I520 VanDerWaalsContact C-N 3.34Å
519	L	38.8	Very low	38.2	Very low	140 Å²	140	115.3 Å²	115.3	73%	0.733	61%	0.613	S	S	*	*	S	Bend	trans	-91.3	6.1	171.3	-88.5	144	0	0	0	113.2	P521	L519-P521 WeakPolarHBondContact O-CD 3.31Å
520	I	36.7	Very low	38.8	Very low	94 Å²	94	116.1 Å²	116.1	48%	0.482	60%	0.603	S	S	.	*	S	Bend	trans	-77	119	161.1	-59.3	168.7	0	0	0	105.3	F517 H518 K522	F517-I520 HydrophobicContact CD1-CD1 4.24Å; H518-I520 VanDerWaalsContact C-N 3.34Å; I520-K522 PolarHBondContact O-N 2.88Å
521	P	41.7	Very low	39.5	Very low	59 Å²	59	112.4 Å²	112.4	38%	0.383	58%	0.582	S	S	.	*			trans	-58.9	112.2	168.8	-10.1	23.3	0	0	0	105.5	L519 E523 F524	L519-P521 WeakPolarHBondContact O-CD 3.31Å; P521-E523 HydrophobicContact CB-CB 3.76Å; P521-E523 HydrophobicContact CB-CG 4.17Å; P521-E523 PolarHBondContact O-N 2.85Å; P521-F524 HydrophobicContact CB-CB 4.26Å; P521-F524 HydrophobicContact CG-CB 4.36Å; P521-F524 WeakPolarHBondContact O-CB 3.39Å; P521-F524 PolarHBondContact O-N 3.44Å
522	K	38.2	Very low	40	Very low	146 Å²	146	116.4 Å²	116.4	64%	0.635	58%	0.581	S	S	*	*	H	α-helix	trans	-51.3	-26.2	162.6	-71.2	-177.3	176.8	179.3	0	108.9	I520 F524 T526	I520-K522 PolarHBondContact O-N 2.88Å; K522-F524 VanDerWaalsContact C-N 3.31Å; K522-F524 PolarHBondContact O-N 3.35Å; K522-T526 PolarHBondContact O-N 3.09Å; K522-T526 VanDerWaalsContact O-N 3.08Å; K522-T526 PolarHBondContact O-OG1 3.44Å
523	E	44.7	Very low	40.7	Very low	114 Å²	114	113.5 Å²	113.5	53%	0.533	57%	0.569	S	S	.	*	I	π-helix	trans	-52.4	-33.1	168.3	-46.7	-65.5	137.4	0	0	116.1	P521 N527 R528	P521-E523 HydrophobicContact CB-CB 3.76Å; P521-E523 HydrophobicContact CB-CG 4.17Å; P521-E523 PolarHBondContact O-N 2.85Å; E523-N527 HydrophobicContact CB-CB 4.41Å; E523-N527 CarbonylContact O-C 3.55Å; E523-N527 PolarHBondContact O-N 3.33Å; E523-N527 VanDerWaalsContact O-N 3.15Å; E523-N527 PolarHBondContact OE1-ND2 2.89Å; E523-N527 WeakPolarHBondContact OE2-CB 3.4Å; E523-N527 PolarHBondContact OE2-ND2 3.35Å; E523-R528 PolarHBondContact O-N 3.31Å
524	F	39.3	Very low	41.2	Very low	89 Å²	89	113.7 Å²	113.7	39%	0.39	56%	0.557	S	S	.	*	I	π-helix	trans	-75.2	-40.6	-169.4	-164.1	-96.2	0	0	0	113.2	P521 K522	P521-F524 HydrophobicContact CB-CB 4.26Å; P521-F524 HydrophobicContact CG-CB 4.36Å; P521-F524 WeakPolarHBondContact O-CB 3.39Å; P521-F524 PolarHBondContact O-N 3.44Å; K522-F524 VanDerWaalsContact C-N 3.31Å; K522-F524 PolarHBondContact O-N 3.35Å
525	F	40.5	Very low	41.8	Very low	153 Å²	153	110.4 Å²	110.4	67%	0.671	54%	0.544	S	S	*	.	I	π-helix	trans	-97.1	-29.8	175.8	-90.2	-80.2	0	0	0	113.2
526	T	42.8	Very low	42.6	Very low	72 Å²	72	109.5 Å²	109.5	44%	0.442	53%	0.533	S	S	.	.	I	π-helix	trans	-107.2	-27.4	-171.7	57.9	0	0	0	0	115.7	K522 L530 P531	K522-T526 PolarHBondContact O-N 3.09Å; K522-T526 VanDerWaalsContact O-N 3.08Å; K522-T526 PolarHBondContact O-OG1 3.44Å; T526-L530 WeakPolarHBondContact O-CB 3.22Å; T526-P531 WeakPolarHBondContact O-CD 3.33Å
527	N	41.7	Very low	43.1	Very low	76 Å²	76	112.2 Å²	112.2	41%	0.406	54%	0.535	S	S	.	.	I	π-helix	trans	-115	-3.5	-172.8	-52	-23.4	0	0	0	115.8	E523 P531	E523-N527 HydrophobicContact CB-CB 4.41Å; E523-N527 CarbonylContact O-C 3.55Å; E523-N527 PolarHBondContact O-N 3.33Å; E523-N527 VanDerWaalsContact O-N 3.15Å; E523-N527 PolarHBondContact OE1-ND2 2.89Å; E523-N527 WeakPolarHBondContact OE2-CB 3.4Å; E523-N527 PolarHBondContact OE2-ND2 3.35Å; N527-P531 WeakPolarHBondContact O-CD 3.3Å; N527-P531 WeakPolarHBondContact O-CG 3.41Å
528	R	47	Very low	43.8	Very low	164 Å²	164	109 Å²	109	62%	0.619	52%	0.522	S	S	*	.	I	π-helix	trans	-119.8	-43.6	168.6	-144.2	177	-92.3	-154.6	-1.8	112.7	E447 E523 Y532	E447-R528 IonicContact OE2-NH1 2.83Å; E523-R528 PolarHBondContact O-N 3.31Å; R528-Y532 WeakPolarHBondContact O-CB 3.28Å; R528-Y532 PolarHBondContact O-N 3.37Å
529	F	38.8	Very low	44.1	Very low	115 Å²	115	111.4 Å²	111.4	50%	0.504	53%	0.526	S	S	.	.	H	α-helix	trans	-68.9	-45.4	173.7	-104	-82.7	0	0	0	112.9	A533 Y822	F529-A533 WeakPolarHBondContact O-CB 3.43Å; F529-A533 PolarHBondContact O-N 3.21Å; F529-Y822 HydrophobicContact CE2-CE2 4.32Å; F529-Y822 HydrophobicContact CZ-CE2 4.43Å
530	L	44.9	Very low	44.9	Very low	111 Å²	111	113 Å²	113	58%	0.581	52%	0.522	S	S	*	.	H	α-helix	trans	-72.2	-43.5	-176.2	-119.2	78.1	0	0	0	113.8	T526 K534	T526-L530 WeakPolarHBondContact O-CB 3.22Å; L530-K534 WeakPolarHBondContact O-CB 3.23Å; L530-K534 PolarHBondContact O-N 2.92Å
531	P	46.9	Very low	45.8	Very low	57 Å²	57	111.9 Å²	111.9	37%	0.37	52%	0.517	S	S	.	.	H	α-helix	trans	-80.3	-23.2	177.1	26.8	-30.7	0	0	0	114.1	T526 N527 K534 S535	T526-P531 WeakPolarHBondContact O-CD 3.33Å; N527-P531 WeakPolarHBondContact O-CD 3.3Å; N527-P531 WeakPolarHBondContact O-CG 3.41Å; P531-K534 CarbonylContact O-C 3.58Å; P531-K534 PolarHBondContact O-N 3.28Å; P531-S535 VanDerWaalsContact O-CB 3.26Å; P531-S535 WeakPolarHBondContact O-CB 3.37Å; P531-S535 PolarHBondContact O-N 3.46Å; P531-S535 PolarHBondContact O-OG 2.86Å
532	Y	42.4	Very low	46.4	Very low	162 Å²	162	114.3 Å²	114.3	64%	0.635	53%	0.525	S	S	*	.	H	α-helix	trans	-75.1	-38.1	169.1	-150.2	-96.4	0	0	0	111	R528 K534 S535 I536	R528-Y532 WeakPolarHBondContact O-CB 3.28Å; R528-Y532 PolarHBondContact O-N 3.37Å; Y532-K534 VanDerWaalsContact C-N 3.34Å; Y532-S535 PolarHBondContact O-OG 3.13Å; Y532-S535 VanDerWaalsContact O-OG 3.13Å; Y532-I536 HydrophobicContact CD1-CD1 3.57Å; Y532-I536 HydrophobicContact CD1-CG1 4.33Å; Y532-I536 HydrophobicContact CE1-CD1 3.72Å; Y532-I536 HydrophobicContact CE1-CG1 4.48Å; Y532-I536 WeakPolarHBondContact O-CB 3.43Å; Y532-I536 VanDerWaalsContact O-CG1 3.23Å; Y532-I536 WeakPolarHBondContact O-CG1 3.48Å; Y532-I536 PolarHBondContact O-N 2.84Å
533	A	49.5	Very low	47.1	Very low	56 Å²	56	112.5 Å²	112.5	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-61.2	-44.2	164.8	0	0	0	0	0	110.4	F529 I536 W537	F529-A533 WeakPolarHBondContact O-CB 3.43Å; F529-A533 PolarHBondContact O-N 3.21Å; A533-I536 PolarHBondContact O-N 3.35Å; A533-W537 WeakPolarHBondContact O-CA 3.49Å; A533-W537 WeakPolarHBondContact O-CB 3.47Å; A533-W537 PolarHBondContact O-N 2.86Å
534	K	45.6	Very low	47.3	Very low	134 Å²	134	110.2 Å²	110.2	58%	0.583	52%	0.52	S	S	*	.	H	α-helix	trans	-67.2	-35.3	179.7	-162	179.9	-177.7	-175.6	0	112.9	L530 P531 Y532 W537 Q538	L530-K534 WeakPolarHBondContact O-CB 3.23Å; L530-K534 PolarHBondContact O-N 2.92Å; P531-K534 CarbonylContact O-C 3.58Å; P531-K534 PolarHBondContact O-N 3.28Å; Y532-K534 VanDerWaalsContact C-N 3.34Å; K534-W537 PolarHBondContact O-N 3.48Å; K534-Q538 VanDerWaalsContact O-CB 3.23Å; K534-Q538 WeakPolarHBondContact O-CB 3.47Å; K534-Q538 WeakPolarHBondContact O-CG 3.48Å; K534-Q538 PolarHBondContact O-N 2.72Å
535	S	48.1	Very low	47.7	Very low	49 Å²	49	114.4 Å²	114.4	34%	0.343	54%	0.538	S	S	.	.	H	α-helix	trans	-75	-39.5	177.5	69.2	0	0	0	0	111.4	P531 Y532 W537 R539	P531-S535 VanDerWaalsContact O-CB 3.26Å; P531-S535 WeakPolarHBondContact O-CB 3.37Å; P531-S535 PolarHBondContact O-N 3.46Å; P531-S535 PolarHBondContact O-OG 2.86Å; Y532-S535 PolarHBondContact O-OG 3.13Å; Y532-S535 VanDerWaalsContact O-OG 3.13Å; S535-W537 VanDerWaalsContact C-N 3.33Å; S535-R539 WeakPolarHBondContact O-CB 3.46Å; S535-R539 WeakPolarHBondContact O-CG 3.26Å; S535-R539 PolarHBondContact O-N 3.49Å
536	I	51.1	Low	48	Very low	76 Å²	76	112.3 Å²	112.3	39%	0.39	54%	0.538	S	S	.	.	H	α-helix	trans	-64.7	-40.3	169.3	-68.6	170.4	0	0	0	110.2	Y532 A533 R540	Y532-I536 HydrophobicContact CD1-CD1 3.57Å; Y532-I536 HydrophobicContact CD1-CG1 4.33Å; Y532-I536 HydrophobicContact CE1-CD1 3.72Å; Y532-I536 HydrophobicContact CE1-CG1 4.48Å; Y532-I536 WeakPolarHBondContact O-CB 3.43Å; Y532-I536 VanDerWaalsContact O-CG1 3.23Å; Y532-I536 WeakPolarHBondContact O-CG1 3.48Å; Y532-I536 PolarHBondContact O-N 2.84Å; A533-I536 PolarHBondContact O-N 3.35Å; I536-R540 HydrophobicContact CG2-CG 4.49Å; I536-R540 VanDerWaalsContact O-CB 3.28Å; I536-R540 WeakPolarHBondContact O-CB 3.45Å; I536-R540 VanDerWaalsContact O-CG 3.32Å; I536-R540 WeakPolarHBondContact O-CG 3.47Å; I536-R540 PolarHBondContact O-N 2.99Å
537	W	47.6	Very low	47.8	Very low	179 Å²	179	117.1 Å²	117.1	68%	0.678	55%	0.553	S	S	*	*	H	α-helix	trans	-71	-37.9	179.7	-152.5	79.7	0	0	0	111.4	A533 K534 S535 L541	A533-W537 WeakPolarHBondContact O-CA 3.49Å; A533-W537 WeakPolarHBondContact O-CB 3.47Å; A533-W537 PolarHBondContact O-N 2.86Å; K534-W537 PolarHBondContact O-N 3.48Å; S535-W537 VanDerWaalsContact C-N 3.33Å; W537-L541 HydrophobicContact CD2-CD1 3.72Å; W537-L541 HydrophobicContact CE3-CD1 3.18Å; W537-L541 HydrophobicContact CH2-CD1 3.59Å; W537-L541 HydrophobicContact CZ2-CD1 4.1Å; W537-L541 HydrophobicContact CZ3-CD1 3.11Å; W537-L541 VanDerWaalsContact O-CB 3.24Å; W537-L541 WeakPolarHBondContact O-CB 3.49Å; W537-L541 PolarHBondContact O-N 3.21Å
538	Q	52.4	Low	47.5	Very low	108 Å²	108	118.5 Å²	118.5	51%	0.505	57%	0.569	S	S	.	*	H	α-helix	trans	-69	-43.8	172.2	-85.2	-178.6	-71.9	0	0	111.7	K534 R540 L541 I542	K534-Q538 VanDerWaalsContact O-CB 3.23Å; K534-Q538 WeakPolarHBondContact O-CB 3.47Å; K534-Q538 WeakPolarHBondContact O-CG 3.48Å; K534-Q538 PolarHBondContact O-N 2.72Å; Q538-R540 PolarHBondContact O-N 2.73Å; Q538-L541 PolarHBondContact O-N 3.39Å; Q538-I542 WeakPolarHBondContact O-CB 2.97Å; Q538-I542 WeakPolarHBondContact O-CD1 3.37Å; Q538-I542 WeakPolarHBondContact O-CG1 3.5Å; Q538-I542 PolarHBondContact O-N 2.74Å
539	R	48.1	Very low	47.1	Very low	185 Å²	185	116.1 Å²	116.1	70%	0.698	57%	0.574	S	S	*	*	H	α-helix	trans	-60.7	-44.5	173.4	-79.9	-173.2	-172.8	-174.5	3.2	111.1	S535 I542 E543	S535-R539 WeakPolarHBondContact O-CB 3.46Å; S535-R539 WeakPolarHBondContact O-CG 3.26Å; S535-R539 PolarHBondContact O-N 3.49Å; R539-I542 PolarHBondContact O-N 2.98Å; R539-E543 WeakPolarHBondContact O-CB 3.47Å; R539-E543 VanDerWaalsContact O-CG 3.3Å; R539-E543 WeakPolarHBondContact O-CG 3.37Å; R539-E543 PolarHBondContact O-N 3.42Å
540	R	55	Low	46.8	Very low	173 Å²	173	116.8 Å²	116.8	65%	0.653	59%	0.593	S	S	*	*	H	α-helix	trans	-71.3	-29	177	-72.1	-167.9	-179.1	-165.2	3.4	113.8	I536 Q538 A544	I536-R540 HydrophobicContact CG2-CG 4.49Å; I536-R540 VanDerWaalsContact O-CB 3.28Å; I536-R540 WeakPolarHBondContact O-CB 3.45Å; I536-R540 VanDerWaalsContact O-CG 3.32Å; I536-R540 WeakPolarHBondContact O-CG 3.47Å; I536-R540 PolarHBondContact O-N 2.99Å; Q538-R540 PolarHBondContact O-N 2.73Å; R540-A544 WeakPolarHBondContact O-CB 3.38Å; R540-A544 PolarHBondContact O-N 3.08Å
541	L	56.5	Low	46.2	Very low	72 Å²	72	120.2 Å²	120.2	38%	0.377	60%	0.603	S	S	.	*	H	α-helix	trans	-72.3	-36	171.7	-101.6	153.1	0	0	0	112.5	W537 Q538 A544 K545	W537-L541 HydrophobicContact CD2-CD1 3.72Å; W537-L541 HydrophobicContact CE3-CD1 3.18Å; W537-L541 HydrophobicContact CH2-CD1 3.59Å; W537-L541 HydrophobicContact CZ2-CD1 4.1Å; W537-L541 HydrophobicContact CZ3-CD1 3.11Å; W537-L541 VanDerWaalsContact O-CB 3.24Å; W537-L541 WeakPolarHBondContact O-CB 3.49Å; W537-L541 PolarHBondContact O-N 3.21Å; Q538-L541 PolarHBondContact O-N 3.39Å; L541-A544 PolarHBondContact O-N 3.2Å; L541-K545 WeakPolarHBondContact O-CB 3.2Å; L541-K545 PolarHBondContact O-N 3.49Å
542	I	54.5	Low	45.4	Very low	109 Å²	109	127 Å²	127	56%	0.559	63%	0.627	S	S	*	*	H	α-helix	trans	-69.5	-44.1	174	-67.7	164.8	0	0	0	109.2	Q538 R539 A544 K545 T546	Q538-I542 WeakPolarHBondContact O-CB 2.97Å; Q538-I542 WeakPolarHBondContact O-CD1 3.37Å; Q538-I542 WeakPolarHBondContact O-CG1 3.5Å; Q538-I542 PolarHBondContact O-N 2.74Å; R539-I542 PolarHBondContact O-N 2.98Å; I542-A544 VanDerWaalsContact C-N 3.31Å; I542-A544 PolarHBondContact O-N 2.94Å; I542-K545 PolarHBondContact O-N 3.32Å; I542-T546 WeakPolarHBondContact O-CG2 3.21Å; I542-T546 PolarHBondContact O-N 3.39Å; I542-T546 PolarHBondContact O-OG1 3.14Å
543	E	50.9	Low	44.7	Very low	108 Å²	108	124.5 Å²	124.5	51%	0.505	63%	0.631	S	S	.	*	H	α-helix	trans	-65.4	-30.1	172.8	-73.5	172.2	-178.5	0	0	113.4	R539 T546 K547	R539-E543 WeakPolarHBondContact O-CB 3.47Å; R539-E543 VanDerWaalsContact O-CG 3.3Å; R539-E543 WeakPolarHBondContact O-CG 3.37Å; R539-E543 PolarHBondContact O-N 3.42Å; E543-T546 WeakPolarHBondContact CA-OG1 3.18Å; E543-T546 PolarHBondContact O-OG1 2.98Å; E543-K547 WeakPolarHBondContact O-CB 3.34Å; E543-K547 PolarHBondContact O-N 3.47Å
544	A	50.7	Low	43.7	Very low	66 Å²	66	129.3 Å²	129.3	55%	0.545	65%	0.647	S	S	.	*	H	α-helix	trans	-78.4	-28.8	174	0	0	0	0	0	112.6	R540 L541 I542	R540-A544 WeakPolarHBondContact O-CB 3.38Å; R540-A544 PolarHBondContact O-N 3.08Å; L541-A544 PolarHBondContact O-N 3.2Å; I542-A544 VanDerWaalsContact C-N 3.31Å; I542-A544 PolarHBondContact O-N 2.94Å
545	K	47.1	Very low	43	Very low	177 Å²	177	128.2 Å²	128.2	77%	0.77	65%	0.653	S	S	*	*	H	α-helix	trans	-78.1	-27.8	172.8	-89.1	-173.4	173.5	-173.2	0	113	L541 I542	L541-K545 WeakPolarHBondContact O-CB 3.2Å; L541-K545 PolarHBondContact O-N 3.49Å; I542-K545 PolarHBondContact O-N 3.32Å
546	T	45.9	Very low	41.9	Very low	109 Å²	109	135 Å²	135	67%	0.669	68%	0.68	S	S	*	*	H	α-helix	trans	-88.2	-9.4	177.5	53.3	0	0	0	0	113.8	I542 E543	I542-T546 WeakPolarHBondContact O-CG2 3.21Å; I542-T546 PolarHBondContact O-N 3.39Å; I542-T546 PolarHBondContact O-OG1 3.14Å; E543-T546 WeakPolarHBondContact CA-OG1 3.18Å; E543-T546 PolarHBondContact O-OG1 2.98Å
547	K	39.8	Very low	40.8	Very low	173 Å²	173	143 Å²	143	75%	0.752	71%	0.705	S	S	*	*			trans	-108.8	66.5	172.7	-73.4	178.2	176.9	172.8	0	111.7	E543	E543-K547 WeakPolarHBondContact O-CB 3.34Å; E543-K547 PolarHBondContact O-N 3.47Å
548	S	35.8	Very low	39.9	Very low	106 Å²	106	143 Å²	143	74%	0.741	71%	0.712	S	S	*	*			trans	-112.5	135	157.8	-166	0	0	0	0	109.3
549	P	37.4	Very low	38.9	Very low	114 Å²	114	143 Å²	143	74%	0.74	72%	0.724	S	S	*	*			trans	-105.5	117.2	-145.8	33.7	-21.7	0	0	0	112
550	S	33.8	Very low	37.9	Very low	128 Å²	128	141.7 Å²	141.7	90%	0.895	73%	0.729	S	S	*	*			trans	-97.7	100.8	156.4	-167.9	0	0	0	0	109.4
551	K	31.1	Very low	36.8	Very low	184 Å²	184	139.9 Å²	139.9	80%	0.8	74%	0.737	S	S	*	*			trans	-51.8	141	168.7	-71.6	168.2	171.9	176	0	111.4
552	K	30.1	Very low	35.5	Very low	200 Å²	200	143 Å²	143	87%	0.87	76%	0.76	S	S	*	*				-153.4	129.6	117.9	-103.2	171.1	-172.5	-177	0	109.4
553	P	28.5	Very low	34.4	Very low	109 Å²	109	143.4 Å²	143.4	71%	0.708	77%	0.769	S	S	*	*			trans	-81.9	-176.3	176.4	37.4	-32.7	0	0	0	109.6
554	I	28.1	Very low	33.5	Very low	157 Å²	157	143.7 Å²	143.7	81%	0.805	78%	0.78	S	S	*	*			trans	132.7	140.9	163.7	-66.9	152.8	0	0	0	110
555	P	30.4	Very low	32.5	Very low	111 Å²	111	147 Å²	147	72%	0.721	80%	0.797	S	S	*	*				-128.2	-176.5	-78.1	38.1	-15.4	0	0	0	112.3	R557	P555-R557 PolarHBondContact O-N 3.34Å
556	Q	25.1	Very low	31.8	Very low	191 Å²	191	141.7 Å²	141.7	89%	0.893	79%	0.791	S	S	*	*			trans	-68.9	123.9	163.7	-72.2	176.4	-27.4	0	0	110.7
557	R	28.5	Very low	31	Very low	245 Å²	245	144 Å²	144	93%	0.925	80%	0.799	S	S	*	*			trans	-168.3	145.1	142.9	-120.2	177.9	-167.5	-163.4	2.3	113.9	P555	P555-R557 PolarHBondContact O-N 3.34Å
558	H	28.8	Very low	30.5	Very low	179 Å²	179	142.6 Å²	142.6	83%	0.829	81%	0.805	S	S	*	*			trans	-63.1	163.7	175.6	-67.3	-90.6	0	0	0	114.2
559	S	30	Very low	30	Very low	106 Å²	106	148.5 Å²	148.5	74%	0.741	81%	0.811	S	S	*	*			trans	80.2	108.5	160.5	60.5	0	0	0	0	120.3
560	I	28.7	Very low	29.8	Very low	159 Å²	159	149.1 Å²	149.1	82%	0.815	81%	0.813	S	S	*	*			trans	49.5	101.5	130.4	-50.4	169.8	0	0	0	117.3
561	T	31.8	Very low	29.7	Very low	135 Å²	135	149.7 Å²	149.7	83%	0.828	81%	0.811	S	S	*	*				-168.5	137.3	129.7	7.1	0	0	0	0	110.1
562	T	29.6	Very low	29.5	Very low	137 Å²	137	150.2 Å²	150.2	84%	0.84	82%	0.819	S	S	*	*			trans	-65.8	144.3	-166.8	46.8	0	0	0	0	116.3
563	P	31.1	Very low	29.6	Very low	117 Å²	117	146.5 Å²	146.5	76%	0.76	81%	0.805	S	S	*	*			trans	-140	-174.4	137.7	42	-26.8	0	0	0	112.5
564	P	32.3	Very low	29.6	Very low	114 Å²	114	147.3 Å²	147.3	74%	0.74	81%	0.809	S	S	*	*				-72.5	163.5	-117.9	32.7	-13.5	0	0	0	116.6
565	P	29.1	Very low	29.7	Very low	137 Å²	137	146.7 Å²	146.7	89%	0.89	80%	0.803	S	S	*	*	S	Bend	trans	-80.7	126.9	-170.5	33.3	-31.7	0	0	0	111.8
566	G	32	Very low	30	Very low	64 Å²	64	148.6 Å²	148.6	66%	0.66	80%	0.797	S	S	*	*			trans	140.9	118.1	174.5	0	0	0	0	0	111.1
567	L	28.6	Very low	30.3	Very low	159 Å²	159	143.1 Å²	143.1	83%	0.832	79%	0.792	S	S	*	*			trans	89.6	78.1	-169.4	-69.4	86.7	0	0	0	115.5
568	T	30.6	Very low	30.3	Very low	142 Å²	142	139.7 Å²	139.7	87%	0.871	79%	0.791	S	S	*	*			trans	-83.4	116.6	160.3	46.7	0	0	0	0	110.2
569	W	25.6	Very low	30.2	Very low	231 Å²	231	139.2 Å²	139.2	88%	0.875	79%	0.794	S	S	*	*			trans	-75.9	137	172.5	-54.7	73.1	0	0	0	110.5
570	T	32.4	Very low	30.1	Very low	126 Å²	126	137.1 Å²	137.1	77%	0.773	79%	0.788	S	S	*	*			trans	-150.6	113.6	158.2	46.6	0	0	0	0	114.4
571	T	31.4	Very low	30.1	Very low	140 Å²	140	134.4 Å²	134.4	86%	0.859	78%	0.779	S	S	*	*			trans	66.8	115.9	143.3	58.6	0	0	0	0	121.1
572	M	26.1	Very low	30	Very low	196 Å²	196	135.4 Å²	135.4	97%	0.966	78%	0.779	S	S	*	*			trans	-79.7	132.3	173.4	-70.3	-172.7	-170.6	0	0	112.5
573	H	32.1	Very low	30.1	Very low	122 Å²	122	135.6 Å²	135.6	57%	0.565	78%	0.775	S	S	*	*			trans	-90.3	142	159.9	-166.7	-94.3	0	0	0	109.6	E575 Y576	H573-E575 VanDerWaalsContact C-N 3.29Å; H573-E575 PolarHBondContact O-N 2.96Å; H573-Y576 AromaticContact ND1-CD2 3.71Å
574	P	29.9	Very low	30.4	Very low	125 Å²	125	136 Å²	136	81%	0.812	77%	0.771	S	S	*	*	S	Bend	trans	-73	-12.2	-169.1	-15.4	30.3	0	0	0	115.8
575	E	30.7	Very low	30.6	Very low	144 Å²	144	138.4 Å²	138.4	67%	0.673	77%	0.772	S	S	*	*	S	Bend	trans	-122.9	-11.5	-165	-70.8	179.5	162.4	0	0	115.6	H573	H573-E575 VanDerWaalsContact C-N 3.29Å; H573-E575 PolarHBondContact O-N 2.96Å
576	Y	35.9	Very low	31.2	Very low	152 Å²	152	133.8 Å²	133.8	60%	0.596	75%	0.746	S	S	*	*			trans	-139.8	113	-174.2	-55.1	-76	0	0	0	110	H573	H573-Y576 AromaticContact ND1-CD2 3.71Å
577	G	31.3	Very low	31.6	Very low	76 Å²	76	132.9 Å²	132.9	78%	0.784	72%	0.724	S	S	*	*			trans	-62.1	172.7	174	0	0	0	0	0	113.4	L579	G577-L579 PolarHBondContact O-N 3.3Å
578	L	28	Very low	32.1	Very low	173 Å²	173	131.2 Å²	131.2	91%	0.906	72%	0.715	S	S	*	*			trans	-57.7	126.9	-174.7	-107.2	92.5	0	0	0	114.3
579	L	26.4	Very low	32.8	Very low	169 Å²	169	126.2 Å²	126.2	89%	0.885	68%	0.684	S	S	*	*			trans	-124.4	89.5	148.2	-94.7	157.6	0	0	0	107.5	G577	G577-L579 PolarHBondContact O-N 3.3Å
580	G	27.5	Very low	33.3	Very low	61 Å²	61	122.4 Å²	122.4	63%	0.629	68%	0.681	S	S	*	*			trans	-99	116.9	166.1	0	0	0	0	0	108.4
581	V	30.6	Very low	33.5	Very low	102 Å²	102	119.5 Å²	119.5	62%	0.618	68%	0.676	S	S	*	*			trans	-106.9	103.9	169.7	-177.5	0	0	0	0	107.4
582	D	28	Very low	34	Very low	156 Å²	156	116 Å²	116	83%	0.834	65%	0.654	S	S	*	*			trans	-82.5	142.7	165.1	-65.8	-28.8	0	0	0	108.6
583	N	32.2	Very low	34.8	Very low	141 Å²	141	112.1 Å²	112.1	75%	0.754	64%	0.636	S	S	*	*			trans	70.1	72.1	-174.9	-79.6	-27	0	0	0	117.2	Q585	N583-Q585 PolarHBondContact O-N 3.47Å
584	L	37.7	Very low	35.8	Very low	127 Å²	127	107.4 Å²	107.4	67%	0.665	61%	0.613	S	S	*	*			trans	-71.7	114.2	159.3	-96.7	96.4	0	0	0	110.3
585	Q	36.1	Very low	36.6	Very low	163 Å²	163	109 Å²	109	76%	0.762	61%	0.608	S	S	*	*			trans	-100.4	-0.7	179.8	-69.8	-172.6	-13.9	0	0	114.6	N583	N583-Q585 PolarHBondContact O-N 3.47Å
586	A	42.1	Very low	37.7	Very low	41 Å²	41	107.5 Å²	107.5	34%	0.339	60%	0.604	S	S	.	*			trans	-162.6	154.2	175.1	0	0	0	0	0	111.8	I593 Y594	A586-I593 HydrophobicContact CB-CG2 3.59Å; A586-Y594 WeakPolarHBondContact CA-O 3.46Å
587	F	40.5	Very low	38.4	Very low	45 Å²	45	104.5 Å²	104.5	20%	0.197	60%	0.598	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.7	122	172.1	-60.3	-86.3	0	0	0	109.5	Y594 L597 L600	F587-Y594 PolarHBondContact N-O 3.44Å; F587-Y594 PolarHBondContact O-N 3.36Å; F587-L597 HydrophobicContact CE1-CD1 4.21Å; F587-L597 HydrophobicContact CE2-CB 4.37Å; F587-L597 HydrophobicContact CE2-CD1 3.71Å; F587-L597 HydrophobicContact CZ-CD1 3.42Å; F587-L597 VanDerWaalsContact CZ-CD1 3.42Å; F587-L600 HydrophobicContact CB-CD2 4.05Å; F587-L600 HydrophobicContact CD1-CD2 4.03Å; F587-L600 HydrophobicContact CD2-CD2 4.29Å; F587-L600 HydrophobicContact CG-CD2 3.86Å
588	L	38.6	Very low	39.9	Very low	124 Å²	124	105.9 Å²	105.9	65%	0.649	59%	0.591	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.5	115.4	172	-167.9	83.7	0	0	0	108.8	T592 I593	L588-T592 WeakPolarHBondContact CA-O 3.26Å; L588-I593 HydrophobicContact CD1-CG1 3.56Å
589	V	45.1	Very low	41.6	Very low	37 Å²	37	102.2 Å²	102.2	22%	0.224	57%	0.569	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.4	124.5	174	178.8	0	0	0	0	108.5	G591 T592 Y594 L600 F603	V589-G591 PolarHBondContact O-N 2.84Å; V589-G591 VanDerWaalsContact O-N 3.16Å; V589-T592 PolarHBondContact N-O 2.74Å; V589-T592 PolarHBondContact O-N 3.04Å; V589-T592 PolarHBondContact O-OG1 3.14Å; V589-Y594 HydrophobicContact CB-CD2 4.35Å; V589-Y594 HydrophobicContact CB-CE2 4.04Å; V589-L600 HydrophobicContact CB-CD1 4.32Å; V589-L600 HydrophobicContact CG2-CD1 3.62Å; V589-F603 HydrophobicContact CG1-CE1 4.37Å
590	N	37.1	Very low	43.1	Very low	151 Å²	151	94.8 Å²	94.8	81%	0.807	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	37.1	-177.9	-73.4	-10.6	0	0	0	114.8	T592	N590-T592 VanDerWaalsContact C-N 3.28Å; N590-T592 PolarHBondContact O-N 3.49Å
591	G	35.6	Very low	44.6	Very low	65 Å²	65	96.3 Å²	96.3	67%	0.67	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	2.3	178.9	0	0	0	0	0	115.2	V589	V589-G591 PolarHBondContact O-N 2.84Å; V589-G591 VanDerWaalsContact O-N 3.16Å
592	T	42.3	Very low	46.3	Very low	65 Å²	65	95.3 Å²	95.3	40%	0.399	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134.4	170.5	49.4	0	0	0	0	111	L588 V589 N590 Y594	L588-T592 WeakPolarHBondContact CA-O 3.26Å; V589-T592 PolarHBondContact N-O 2.74Å; V589-T592 PolarHBondContact O-N 3.04Å; V589-T592 PolarHBondContact O-OG1 3.14Å; N590-T592 VanDerWaalsContact C-N 3.28Å; N590-T592 PolarHBondContact O-N 3.49Å; T592-Y594 WeakPolarHBondContact OG1-CE2 3.4Å; T592-Y594 PolarHBondContact OG1-OH 3.29Å; T592-Y594 VanDerWaalsContact OG1-OH 3.1Å
593	I	42.6	Very low	47.9	Very low	115 Å²	115	90.1 Å²	90.1	59%	0.59	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	110.8	178.2	-59.2	173.5	0	0	0	108	A586 L588	A586-I593 HydrophobicContact CB-CG2 3.59Å; L588-I593 HydrophobicContact CD1-CG1 3.56Å
594	Y	53.1	Low	49	Very low	23 Å²	23	84.4 Å²	84.4	9%	0.09	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126	171.7	-62.6	-86.5	0	0	0	109.4	A586 F587 V589 T592 E599 L600 F603	A586-Y594 WeakPolarHBondContact CA-O 3.46Å; F587-Y594 PolarHBondContact N-O 3.44Å; F587-Y594 PolarHBondContact O-N 3.36Å; V589-Y594 HydrophobicContact CB-CD2 4.35Å; V589-Y594 HydrophobicContact CB-CE2 4.04Å; T592-Y594 WeakPolarHBondContact OG1-CE2 3.4Å; T592-Y594 PolarHBondContact OG1-OH 3.29Å; T592-Y594 VanDerWaalsContact OG1-OH 3.1Å; Y594-E599 HydrophobicContact CD1-CB 4.15Å; Y594-E599 HydrophobicContact CD1-CG 3.87Å; Y594-L600 HydrophobicContact CD2-CD1 3.82Å; Y594-L600 HydrophobicContact CE2-CD1 4.23Å; Y594-L600 HydrophobicContact CG-CB 4.37Å; Y594-L600 HydrophobicContact CG-CD1 4.11Å; Y594-F603 HydrophobicContact CE1-CB 3.91Å; Y594-F603 HydrophobicContact CE1-CD2 4.39Å; Y594-F603 HydrophobicContact CE1-CG 4.07Å; Y594-F603 HydrophobicContact CE2-CD1 4.43Å; Y594-F603 AromaticContact CZ-CD1 3.93Å; Y594-F603 AromaticContact CZ-CG 3.76Å; Y594-F603 WeakPolarHBondContact OH-CD1 3.23Å; Y594-F603 WeakPolarHBondContact OH-CD2 3.14Å; Y594-F603 WeakPolarHBondContact OH-CE2 3.48Å; Y594-F603 VanDerWaalsContact OH-CG 3.24Å; Y594-F603 WeakPolarHBondContact OH-CG 3.01Å; Y594-F603 WeakPolarHBondContact OH-CZ 3.28Å
595	K	46.2	Very low	50.2	Low	160 Å²	160	85.2 Å²	85.2	70%	0.696	45%	0.453	S	S	*	.	S	Bend	trans	-84.3	-25	-174.3	-73.5	-179.8	178.5	175.5	0	113.1	E599	K595-E599 PolarHBondContact N-OE2 3.36Å
596	D	54.3	Low	51.7	Low	111 Å²	111	85.1 Å²	85.1	59%	0.594	45%	0.453	S	S	*	.	S	Bend	trans	-132.7	149.8	-178.8	-82.6	-38.9	0	0	0	112.2	V598 E599 L600	D596-V598 PolarHBondContact O-N 3.45Å; D596-E599 WeakPolarHBondContact O-CB 3.38Å; D596-E599 PolarHBondContact O-N 3Å; D596-E599 VanDerWaalsContact O-N 3.13Å; D596-L600 PolarHBondContact O-N 3.1Å
597	L	51.7	Low	52.2	Low	90 Å²	90	87 Å²	87	47%	0.471	46%	0.457	S	S	.	.	H	α-helix	trans	-57.8	-32	176.5	-160.3	80.7	0	0	0	111.9	F587 E601	F587-L597 HydrophobicContact CE1-CD1 4.21Å; F587-L597 HydrophobicContact CE2-CB 4.37Å; F587-L597 HydrophobicContact CE2-CD1 3.71Å; F587-L597 HydrophobicContact CZ-CD1 3.42Å; F587-L597 VanDerWaalsContact CZ-CD1 3.42Å; L597-E601 WeakPolarHBondContact O-CB 3.33Å; L597-E601 PolarHBondContact O-N 3.33Å
598	V	63.2	Low	52.5	Low	104 Å²	104	92.4 Å²	92.4	63%	0.63	49%	0.488	S	S	*	.	H	α-helix	trans	-67	-41.5	178.6	-178.4	0	0	0	0	111.4	D596 L600 E601 T602	D596-V598 PolarHBondContact O-N 3.45Å; V598-L600 VanDerWaalsContact C-N 3.34Å; V598-E601 PolarHBondContact O-N 2.92Å; V598-T602 PolarHBondContact O-N 2.82Å; V598-T602 PolarHBondContact O-OG1 3.45Å
599	E	63.5	Low	52.6	Low	96 Å²	96	90.3 Å²	90.3	45%	0.449	48%	0.477	S	S	.	.	H	α-helix	trans	-66.1	-41.2	-179.6	-158.2	-178.7	-169.5	0	0	110.6	Y594 K595 D596 T602 F603	Y594-E599 HydrophobicContact CD1-CB 4.15Å; Y594-E599 HydrophobicContact CD1-CG 3.87Å; K595-E599 PolarHBondContact N-OE2 3.36Å; D596-E599 WeakPolarHBondContact O-CB 3.38Å; D596-E599 PolarHBondContact O-N 3Å; D596-E599 VanDerWaalsContact O-N 3.13Å; E599-T602 WeakPolarHBondContact CA-OG1 3.42Å; E599-T602 PolarHBondContact O-OG1 3.2Å; E599-F603 PolarHBondContact O-N 3.02Å; E599-F603 VanDerWaalsContact O-N 3.13Å
600	L	57	Low	52.2	Low	13 Å²	13	93.4 Å²	93.4	7%	0.068	50%	0.496	C	S	.	.	H	α-helix	trans	-63.1	-46.9	171.7	-173.9	69.7	0	0	0	111	F587 V589 Y594 D596 V598 T602 F603 L604	F587-L600 HydrophobicContact CB-CD2 4.05Å; F587-L600 HydrophobicContact CD1-CD2 4.03Å; F587-L600 HydrophobicContact CD2-CD2 4.29Å; F587-L600 HydrophobicContact CG-CD2 3.86Å; V589-L600 HydrophobicContact CB-CD1 4.32Å; V589-L600 HydrophobicContact CG2-CD1 3.62Å; Y594-L600 HydrophobicContact CD2-CD1 3.82Å; Y594-L600 HydrophobicContact CE2-CD1 4.23Å; Y594-L600 HydrophobicContact CG-CB 4.37Å; Y594-L600 HydrophobicContact CG-CD1 4.11Å; D596-L600 PolarHBondContact O-N 3.1Å; V598-L600 VanDerWaalsContact C-N 3.34Å; L600-T602 VanDerWaalsContact C-N 3.31Å; L600-T602 PolarHBondContact O-N 3.07Å; L600-F603 PolarHBondContact O-N 3.49Å; L600-F603 VanDerWaalsContact O-N 3.15Å; L600-L604 HydrophobicContact CD1-CD1 4.45Å; L600-L604 HydrophobicContact CD1-CG 4.41Å; L600-L604 HydrophobicContact CD2-CD1 4.32Å; L600-L604 HydrophobicContact CG-CD1 3.84Å; L600-L604 HydrophobicContact CG-CG 4.21Å; L600-L604 WeakPolarHBondContact O-CB 3.26Å; L600-L604 WeakPolarHBondContact O-CG 3.23Å; L600-L604 PolarHBondContact O-N 3.05Å
601	E	58.4	Low	52.1	Low	94 Å²	94	89.7 Å²	89.7	44%	0.439	47%	0.472	S	S	.	.	H	α-helix	trans	-61.7	-36.6	-179.6	-151.7	-167.2	147.3	0	0	112.7	L597 V598 K605	L597-E601 WeakPolarHBondContact O-CB 3.33Å; L597-E601 PolarHBondContact O-N 3.33Å; V598-E601 PolarHBondContact O-N 2.92Å; E601-K605 WeakPolarHBondContact O-CB 3.28Å; E601-K605 WeakPolarHBondContact O-CG 3.4Å; E601-K605 PolarHBondContact O-N 3.22Å; E601-K605 WeakPolarHBondContact OE1-CE 3.32Å; E601-K605 IonicContact OE1-NZ 2.76Å; E601-K605 PolarHBondContact OE1-NZ 3.42Å
602	T	66.7	Low	51.9	Low	80 Å²	80	93.1 Å²	93.1	49%	0.491	47%	0.471	S	S	.	.	H	α-helix	trans	-66.1	-42.7	172.8	33.5	0	0	0	0	113	V598 E599 L600 L604 K605 Q606	V598-T602 PolarHBondContact O-N 2.82Å; V598-T602 PolarHBondContact O-OG1 3.45Å; E599-T602 WeakPolarHBondContact CA-OG1 3.42Å; E599-T602 PolarHBondContact O-OG1 3.2Å; L600-T602 VanDerWaalsContact C-N 3.31Å; L600-T602 PolarHBondContact O-N 3.07Å; T602-L604 VanDerWaalsContact C-N 3.34Å; T602-K605 PolarHBondContact O-N 3.06Å; T602-Q606 PolarHBondContact O-N 3.29Å
603	F	62.6	Low	51.6	Low	47 Å²	47	93.4 Å²	93.4	21%	0.206	47%	0.469	C	S	.	.	H	α-helix	trans	-65.2	-39.8	176.5	177.6	-101	0	0	0	111.7	V589 Y594 E599 L600 Q606 N607	V589-F603 HydrophobicContact CG1-CE1 4.37Å; Y594-F603 HydrophobicContact CE1-CB 3.91Å; Y594-F603 HydrophobicContact CE1-CD2 4.39Å; Y594-F603 HydrophobicContact CE1-CG 4.07Å; Y594-F603 HydrophobicContact CE2-CD1 4.43Å; Y594-F603 AromaticContact CZ-CD1 3.93Å; Y594-F603 AromaticContact CZ-CG 3.76Å; Y594-F603 WeakPolarHBondContact OH-CD1 3.23Å; Y594-F603 WeakPolarHBondContact OH-CD2 3.14Å; Y594-F603 WeakPolarHBondContact OH-CE2 3.48Å; Y594-F603 VanDerWaalsContact OH-CG 3.24Å; Y594-F603 WeakPolarHBondContact OH-CG 3.01Å; Y594-F603 WeakPolarHBondContact OH-CZ 3.28Å; E599-F603 PolarHBondContact O-N 3.02Å; E599-F603 VanDerWaalsContact O-N 3.13Å; L600-F603 PolarHBondContact O-N 3.49Å; L600-F603 VanDerWaalsContact O-N 3.15Å; F603-Q606 PolarHBondContact O-N 3.32Å; F603-N607 VanDerWaalsContact CE1-ND2 3.32Å; F603-N607 WeakPolarHBondContact CE1-ND2 3.48Å; F603-N607 WeakPolarHBondContact CE2-ND2 3.23Å; F603-N607 WeakPolarHBondContact CZ-ND2 3.45Å; F603-N607 WeakPolarHBondContact O-CB 3.27Å; F603-N607 PolarHBondContact O-N 2.69Å; F603-N607 PolarHBondContact O-ND2 3.18Å
604	L	55.3	Low	51	Low	21 Å²	21	92.3 Å²	92.3	11%	0.11	47%	0.468	C	S	.	.	H	α-helix	trans	-64.8	-41.2	176.7	-69.6	177.1	0	0	0	112.1	L600 T602 N607 N608 L609 F611	L600-L604 HydrophobicContact CD1-CD1 4.45Å; L600-L604 HydrophobicContact CD1-CG 4.41Å; L600-L604 HydrophobicContact CD2-CD1 4.32Å; L600-L604 HydrophobicContact CG-CD1 3.84Å; L600-L604 HydrophobicContact CG-CG 4.21Å; L600-L604 WeakPolarHBondContact O-CB 3.26Å; L600-L604 WeakPolarHBondContact O-CG 3.23Å; L600-L604 PolarHBondContact O-N 3.05Å; T602-L604 VanDerWaalsContact C-N 3.34Å; L604-N607 PolarHBondContact O-N 2.82Å; L604-N608 PolarHBondContact O-N 2.99Å; L604-L609 HydrophobicContact CD2-CB 3.65Å; L604-L609 HydrophobicContact CD2-CD1 3.99Å; L604-L609 HydrophobicContact CD2-CG 4.48Å; L604-L609 PolarHBondContact O-N 3.33Å; L604-F611 HydrophobicContact CD1-CD2 3.58Å; L604-F611 HydrophobicContact CD1-CE2 4.03Å; L604-F611 HydrophobicContact CD1-CG 4.44Å; L604-F611 HydrophobicContact CD2-CD2 3.6Å; L604-F611 HydrophobicContact CD2-CE2 3.23Å; L604-F611 HydrophobicContact CD2-CZ 4.33Å; L604-F611 HydrophobicContact CG-CD2 4.18Å; L604-F611 HydrophobicContact CG-CE2 4.24Å
605	K	63	Low	50	Low	144 Å²	144	99.7 Å²	99.7	63%	0.626	50%	0.497	S	S	*	.	H	α-helix	trans	-64.9	-38.6	172.8	-79	174.4	-175.8	157.9	0	112.6	E601 T602 N607	E601-K605 WeakPolarHBondContact O-CB 3.28Å; E601-K605 WeakPolarHBondContact O-CG 3.4Å; E601-K605 PolarHBondContact O-N 3.22Å; E601-K605 WeakPolarHBondContact OE1-CE 3.32Å; E601-K605 IonicContact OE1-NZ 2.76Å; E601-K605 PolarHBondContact OE1-NZ 3.42Å; T602-K605 PolarHBondContact O-N 3.06Å; K605-N607 VanDerWaalsContact C-N 3.33Å
606	Q	66.4	Low	49.3	Very low	162 Å²	162	96 Å²	96	76%	0.757	51%	0.505	S	S	*	.	H	α-helix	trans	-66.8	-33.4	176.6	-93.4	-179.6	-24.3	0	0	113.1	T602 F603	T602-Q606 PolarHBondContact O-N 3.29Å; F603-Q606 PolarHBondContact O-N 3.32Å
607	N	52.4	Low	48.2	Very low	81 Å²	81	93.8 Å²	93.8	43%	0.433	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	13	-174.3	-69.4	-27.5	0	0	0	114.6	F603 L604 K605 L609	F603-N607 VanDerWaalsContact CE1-ND2 3.32Å; F603-N607 WeakPolarHBondContact CE1-ND2 3.48Å; F603-N607 WeakPolarHBondContact CE2-ND2 3.23Å; F603-N607 WeakPolarHBondContact CZ-ND2 3.45Å; F603-N607 WeakPolarHBondContact O-CB 3.27Å; F603-N607 PolarHBondContact O-N 2.69Å; F603-N607 PolarHBondContact O-ND2 3.18Å; L604-N607 PolarHBondContact O-N 2.82Å; K605-N607 VanDerWaalsContact C-N 3.33Å; N607-L609 HydrophobicContact CB-CD1 3.78Å; N607-L609 HydrophobicContact CB-CG 4.17Å; N607-L609 PolarHBondContact O-N 3.33Å
608	N	46.9	Very low	47.3	Very low	158 Å²	158	95 Å²	95	85%	0.845	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	33.5	-177.4	-99.1	-11.5	0	0	0	113.3	L604	L604-N608 PolarHBondContact O-N 2.99Å
609	L	42.2	Very low	45.7	Very low	80 Å²	80	99.7 Å²	99.7	42%	0.419	54%	0.535	S	S	.	.			trans	-99.9	118.1	178.4	-71.4	162.5	0	0	0	109.3	L604 N607 F611	L604-L609 HydrophobicContact CD2-CB 3.65Å; L604-L609 HydrophobicContact CD2-CD1 3.99Å; L604-L609 HydrophobicContact CD2-CG 4.48Å; L604-L609 PolarHBondContact O-N 3.33Å; N607-L609 HydrophobicContact CB-CD1 3.78Å; N607-L609 HydrophobicContact CB-CG 4.17Å; N607-L609 PolarHBondContact O-N 3.33Å; L609-F611 HydrophobicContact CB-CE2 4.23Å
610	T	35	Very low	44.4	Very low	101 Å²	101	101.3 Å²	101.3	62%	0.62	55%	0.552	S	S	*	*			trans	-105.4	125.4	175.8	53.8	0	0	0	0	110.7
611	F	36.1	Very low	43.1	Very low	73 Å²	73	108.5 Å²	108.5	32%	0.32	59%	0.591	S	S	.	*	B	Isolated β-bridge	trans	-109.2	131.4	174.1	-77.1	-93.5	0	0	0	110.2	L604 L609 L635 P637	L604-F611 HydrophobicContact CD1-CD2 3.58Å; L604-F611 HydrophobicContact CD1-CE2 4.03Å; L604-F611 HydrophobicContact CD1-CG 4.44Å; L604-F611 HydrophobicContact CD2-CD2 3.6Å; L604-F611 HydrophobicContact CD2-CE2 3.23Å; L604-F611 HydrophobicContact CD2-CZ 4.33Å; L604-F611 HydrophobicContact CG-CD2 4.18Å; L604-F611 HydrophobicContact CG-CE2 4.24Å; L609-F611 HydrophobicContact CB-CE2 4.23Å; F611-L635 HydrophobicContact CD1-CD2 3.91Å; F611-L635 HydrophobicContact CG-CD2 4.45Å; F611-P637 HydrophobicContact CE1-CB 4.44Å
612	H	31.7	Very low	42	Very low	137 Å²	137	115.1 Å²	115.1	63%	0.634	61%	0.611	S	S	*	*			trans	-90.5	117.7	175	-120.8	-79.7	0	0	0	109.7
613	I	34.8	Very low	40.4	Very low	71 Å²	71	117 Å²	117	36%	0.364	63%	0.628	S	S	.	*			trans	-95.8	111.2	174.2	-57.6	171.6	0	0	0	107.6	Y615	I613-Y615 HydrophobicContact CG2-CD2 4.31Å; I613-Y615 HydrophobicContact CG2-CE1 4.34Å; I613-Y615 HydrophobicContact CG2-CE2 3.79Å
614	T	31.6	Very low	39	Very low	92 Å²	92	125.3 Å²	125.3	56%	0.564	66%	0.658	S	S	*	*			trans	-98.3	116.1	172.3	35.2	0	0	0	0	110.6
615	Y	31.4	Very low	37.9	Very low	179 Å²	179	132.8 Å²	132.8	70%	0.702	69%	0.692	S	S	*	*			trans	-82.2	115.5	173.3	-63.8	-87.4	0	0	0	109.8	I613 G617	I613-Y615 HydrophobicContact CG2-CD2 4.31Å; I613-Y615 HydrophobicContact CG2-CE1 4.34Å; I613-Y615 HydrophobicContact CG2-CE2 3.79Å; Y615-G617 VanDerWaalsContact C-N 3.29Å; Y615-G617 PolarHBondContact O-N 2.98Å
616	G	31.7	Very low	36.7	Very low	83 Å²	83	129.2 Å²	129.2	86%	0.856	70%	0.696	S	S	*	*			trans	-72.7	76.1	173.5	0	0	0	0	0	112.2
617	G	31.4	Very low	35.4	Very low	63 Å²	63	127.3 Å²	127.3	65%	0.649	70%	0.698	S	S	*	*			trans	-94.1	115.1	175.6	0	0	0	0	0	112.4	Y615 K619	Y615-G617 VanDerWaalsContact C-N 3.29Å; Y615-G617 PolarHBondContact O-N 2.98Å; G617-K619 PolarHBondContact O-N 3.48Å
618	S	31.6	Very low	34.7	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	71%	0.714	S	S	*	*			trans	-60.1	122.2	165.8	-174.5	0	0	0	0	109.6	T620	S618-T620 PolarHBondContact O-N 3.42Å; S618-T620 VanDerWaalsContact O-N 3.08Å
619	K	29.2	Very low	34.2	Very low	204 Å²	204	127.4 Å²	127.4	89%	0.887	71%	0.711	S	S	*	*			trans	-68.7	101	179.9	-69.2	178.8	178.7	176.1	0	110.2	G617	G617-K619 PolarHBondContact O-N 3.48Å
620	T	36.2	Very low	33.6	Very low	129 Å²	129	129.9 Å²	129.9	79%	0.791	74%	0.735	S	S	*	*			trans	-133.5	126.1	155.4	53.8	0	0	0	0	110.5	S618	S618-T620 PolarHBondContact O-N 3.42Å; S618-T620 VanDerWaalsContact O-N 3.08Å
621	N	31.3	Very low	33.5	Very low	165 Å²	165	127.3 Å²	127.3	88%	0.882	73%	0.729	S	S	*	*			trans	-50.7	151.8	-174.7	-86.8	-32.2	0	0	0	115.9
622	R	34.9	Very low	33.2	Very low	232 Å²	232	129 Å²	129	88%	0.875	75%	0.745	S	S	*	*			trans	83.6	95.6	160.2	-77	-180	-178.9	168.8	0.6	118.7
623	S	33	Very low	33.1	Very low	119 Å²	119	126.7 Å²	126.7	83%	0.832	74%	0.736	S	S	*	*				25.4	96	115.5	-37	0	0	0	0	118.1
624	R	33.3	Very low	32.7	Very low	222 Å²	222	130 Å²	130	84%	0.838	75%	0.749	S	S	*	*				165.8	124.7	112.6	-109.5	177.1	159.7	151.3	-4.4	110.5
625	E	32.7	Very low	32.6	Very low	179 Å²	179	130 Å²	130	84%	0.836	75%	0.745	S	S	*	*			trans	52.2	90.1	152.3	-68	164.3	-151.6	0	0	117.9
626	G	36.6	Very low	32.6	Very low	68 Å²	68	126.9 Å²	126.9	70%	0.701	74%	0.739	S	S	*	*			trans	-155.9	157.3	165.8	0	0	0	0	0	110.9
627	P	40.2	Very low	32.6	Very low	123 Å²	123	127.3 Å²	127.3	80%	0.799	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-63	158	-168.6	27.3	-34.2	0	0	0	113.1
628	P	37.4	Very low	32.5	Very low	119 Å²	119	131 Å²	131	77%	0.773	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-60.5	135.9	-167.9	24.5	-34.3	0	0	0	112.2	S630	P628-S630 PolarHBondContact O-N 2.97Å
629	P	35.9	Very low	32.5	Very low	122 Å²	122	135.2 Å²	135.2	79%	0.792	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-70.3	128.8	177.8	27.9	-32.5	0	0	0	110.6	G631	P629-G631 PolarHBondContact O-N 2.95Å
630	S	30.7	Very low	32.6	Very low	132 Å²	132	129.4 Å²	129.4	92%	0.923	71%	0.709	S	S	*	*			trans	-58.3	102	168.6	-53.5	0	0	0	0	109.7	P628	P628-S630 PolarHBondContact O-N 2.97Å
631	G	32.6	Very low	32.4	Very low	46 Å²	46	126.1 Å²	126.1	47%	0.474	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-103.7	129.9	179.2	0	0	0	0	0	111.4	P629	P629-G631 PolarHBondContact O-N 2.95Å
632	T	28.4	Very low	32.5	Very low	109 Å²	109	123 Å²	123	67%	0.669	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-71.3	122.4	165	46.2	0	0	0	0	109.5
633	I	29.7	Very low	32.5	Very low	88 Å²	88	117.4 Å²	117.4	45%	0.451	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-91.4	118.1	178	-60.4	172.2	0	0	0	108.5	L635	I633-L635 HydrophobicContact CG2-CD2 4.25Å; I633-L635 HydrophobicContact CG2-CG 4.18Å
634	F	28	Very low	32.5	Very low	142 Å²	142	116.5 Å²	116.5	62%	0.623	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-94.6	121.6	165.4	-73.4	-88	0	0	0	108.8
635	L	29.4	Very low	32.4	Very low	91 Å²	91	110.1 Å²	110.1	48%	0.476	64%	0.638	S	S	.	*			trans	-96.6	114.2	174	-69.7	167	0	0	0	108.8	F611 I633	F611-L635 HydrophobicContact CD1-CD2 3.91Å; F611-L635 HydrophobicContact CG-CD2 4.45Å; I633-L635 HydrophobicContact CG2-CD2 4.25Å; I633-L635 HydrophobicContact CG2-CG 4.18Å
636	I	31.3	Very low	32.3	Very low	114 Å²	114	108.7 Å²	108.7	59%	0.585	63%	0.631	S	S	*	*			trans	-115.8	118.6	171.7	-56.5	172.1	0	0	0	107.6	Q638	I636-Q638 PolarHBondContact O-N 3.31Å
637	P	31.3	Very low	32.2	Very low	91 Å²	91	108.7 Å²	108.7	59%	0.591	62%	0.621	S	S	*	*	B	Isolated β-bridge	trans	-71.7	126.8	175.4	27.1	-30.6	0	0	0	111	F611	F611-P637 HydrophobicContact CE1-CB 4.44Å
638	Q	29.4	Very low	31.7	Very low	141 Å²	141	107.7 Å²	107.7	66%	0.659	61%	0.608	S	S	*	*			trans	-98	114.3	176.1	-124.8	-166.2	-9.5	0	0	110.5	I636	I636-Q638 PolarHBondContact O-N 3.31Å
639	K	30.8	Very low	31.4	Very low	204 Å²	204	104 Å²	104	89%	0.887	59%	0.585	S	S	*	*			trans	157.6	63.5	131.5	-155.9	176.1	-166.3	-179.3	0	109.6
640	L	31.8	Very low	31.1	Very low	82 Å²	82	106 Å²	106	43%	0.429	58%	0.577	S	S	.	*	S	Bend	trans	-123.7	135.4	162.4	-132.6	70	0	0	0	106.8	E644 L645 L648	L640-E644 HydrophobicContact CD2-CB 3.86Å; L640-E644 HydrophobicContact CG-CB 3.88Å; L640-L645 HydrophobicContact CB-CD1 3.61Å; L640-L648 HydrophobicContact CD2-CD1 3.27Å; L640-L648 HydrophobicContact CD2-CG 4.5Å
641	S	31.4	Very low	31.1	Very low	60 Å²	60	104.6 Å²	104.6	42%	0.42	56%	0.556	S	S	.	*			trans	-54.5	147.6	-177	67.1	0	0	0	0	110.1	V643 E644 L645	S641-V643 PolarHBondContact O-N 3.22Å; S641-E644 PolarHBondContact O-N 3.3Å; S641-E644 WeakPolarHBondContact OG-CG 3.38Å; S641-E644 PolarHBondContact OG-N 3.21Å; S641-E644 PolarHBondContact OG-OE2 2.8Å; S641-L645 PolarHBondContact O-N 3.06Å
642	S	33.7	Very low	31	Very low	100 Å²	100	105 Å²	105	70%	0.699	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-15	-177.9	57	0	0	0	0	113.8
643	V	35.7	Very low	31	Very low	114 Å²	114	104.9 Å²	104.9	69%	0.691	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-24.9	176.5	-174.6	0	0	0	0	112.1	S641	S641-V643 PolarHBondContact O-N 3.22Å
644	E	31.6	Very low	31.1	Very low	100 Å²	100	104.4 Å²	104.4	47%	0.467	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-22.7	175.2	-70.2	166.7	138.9	0	0	112.8	L640 S641 E646 S647 L648	L640-E644 HydrophobicContact CD2-CB 3.86Å; L640-E644 HydrophobicContact CG-CB 3.88Å; S641-E644 PolarHBondContact O-N 3.3Å; S641-E644 WeakPolarHBondContact OG-CG 3.38Å; S641-E644 PolarHBondContact OG-N 3.21Å; S641-E644 PolarHBondContact OG-OE2 2.8Å; E644-E646 VanDerWaalsContact C-N 3.34Å; E644-S647 WeakPolarHBondContact CA-OG 3.27Å; E644-S647 PolarHBondContact O-N 2.84Å; E644-S647 PolarHBondContact O-OG 3.28Å; E644-L648 PolarHBondContact O-N 3.29Å
645	L	32.6	Very low	31.2	Very low	87 Å²	87	98.7 Å²	98.7	46%	0.455	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-27.7	174.5	-146.5	88.9	0	0	0	112	L640 S641 S647 C649	L640-L645 HydrophobicContact CB-CD1 3.61Å; S641-L645 PolarHBondContact O-N 3.06Å; L645-S647 VanDerWaalsContact C-N 3.33Å; L645-C649 PolarHBondContact O-N 3.42Å
646	E	30.8	Very low	31.2	Very low	149 Å²	149	99.6 Å²	99.6	70%	0.696	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-26.6	170	-79.7	-174.4	162.7	0	0	112.1	E644 T652	E644-E646 VanDerWaalsContact C-N 3.34Å; E646-T652 WeakPolarHBondContact O-CB 3.36Å; E646-T652 WeakPolarHBondContact O-CG2 3.48Å; E646-T652 PolarHBondContact O-OG1 3.24Å
647	S	33.1	Very low	31.2	Very low	68 Å²	68	97.4 Å²	97.4	48%	0.476	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-10.9	177.8	62.8	0	0	0	0	114.6	E644 L645	E644-S647 WeakPolarHBondContact CA-OG 3.27Å; E644-S647 PolarHBondContact O-N 2.84Å; E644-S647 PolarHBondContact O-OG 3.28Å; L645-S647 VanDerWaalsContact C-N 3.33Å
648	L	30.5	Very low	31.4	Very low	102 Å²	102	97.8 Å²	97.8	53%	0.534	51%	0.508	S	S	.	.	S	Bend	trans	-116.5	4.4	-174.6	-87.3	150.2	0	0	0	114.5	L640 E644 W650	L640-L648 HydrophobicContact CD2-CD1 3.27Å; L640-L648 HydrophobicContact CD2-CG 4.5Å; E644-L648 PolarHBondContact O-N 3.29Å; L648-W650 PolarHBondContact O-N 3.22Å
649	C	30.6	Very low	31.6	Very low	43 Å²	43	97 Å²	97	29%	0.291	51%	0.509	S	S	.	.			trans	-63.2	133.4	168.9	-163.3	0	0	0	0	108.2	L645 E651 T652 M653	L645-C649 PolarHBondContact O-N 3.42Å; C649-E651 PolarHBondContact O-N 2.81Å; C649-E651 VanDerWaalsContact O-N 3.08Å; C649-T652 HydrophobicContact CB-CG2 4.39Å; C649-T652 WeakPolarHBondContact CB-OG1 3.41Å; C649-T652 PolarHBondContact N-OG1 3.45Å; C649-T652 CarbonylContact O-C 3.57Å; C649-T652 WeakPolarHBondContact O-CA 3.45Å; C649-T652 PolarHBondContact O-N 2.82Å; C649-T652 PolarHBondContact O-OG1 3.5Å; C649-M653 PolarHBondContact O-N 3.06Å
650	W	30.5	Very low	31.6	Very low	162 Å²	162	95 Å²	95	61%	0.614	50%	0.495	S	S	*	.	H	α-helix	trans	-57.3	-24.7	172.6	63.3	-83.9	0	0	0	110.7	L648 I654	L648-W650 PolarHBondContact O-N 3.22Å; W650-I654 HydrophobicContact CE3-CD1 3.52Å; W650-I654 HydrophobicContact CE3-CG1 4.48Å; W650-I654 HydrophobicContact CZ3-CD1 3.85Å; W650-I654 WeakPolarHBondContact O-CA 3.31Å; W650-I654 WeakPolarHBondContact O-CB 3.43Å; W650-I654 WeakPolarHBondContact O-CG1 3.44Å; W650-I654 PolarHBondContact O-N 3.1Å
651	E	29	Very low	31.8	Very low	103 Å²	103	94.7 Å²	94.7	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-72.7	-25.7	170.4	-64.3	-177.7	158.8	0	0	113.9	C649 G655	C649-E651 PolarHBondContact O-N 2.81Å; C649-E651 VanDerWaalsContact O-N 3.08Å; E651-G655 VanDerWaalsContact O-CA 3.31Å; E651-G655 WeakPolarHBondContact O-CA 3.32Å; E651-G655 PolarHBondContact O-N 3.47Å
652	T	30.6	Very low	32.2	Very low	54 Å²	54	96.4 Å²	96.4	33%	0.331	50%	0.504	S	S	.	.	H	α-helix	trans	-89.9	-26.4	171.9	47.8	0	0	0	0	112.9	E646 C649 E656	E646-T652 WeakPolarHBondContact O-CB 3.36Å; E646-T652 WeakPolarHBondContact O-CG2 3.48Å; E646-T652 PolarHBondContact O-OG1 3.24Å; C649-T652 HydrophobicContact CB-CG2 4.39Å; C649-T652 WeakPolarHBondContact CB-OG1 3.41Å; C649-T652 PolarHBondContact N-OG1 3.45Å; C649-T652 CarbonylContact O-C 3.57Å; C649-T652 WeakPolarHBondContact O-CA 3.45Å; C649-T652 PolarHBondContact O-N 2.82Å; C649-T652 PolarHBondContact O-OG1 3.5Å; T652-E656 VanDerWaalsContact O-CB 3.29Å; T652-E656 WeakPolarHBondContact O-CB 3.34Å; T652-E656 WeakPolarHBondContact O-CG 3.42Å; T652-E656 PolarHBondContact O-N 2.94Å
653	M	28.7	Very low	32.8	Very low	107 Å²	107	96.4 Å²	96.4	53%	0.527	49%	0.491	S	S	.	.	H	α-helix	trans	-72.8	-39.2	165.2	-80.6	-147.1	-74.6	0	0	112	C649 V657	C649-M653 PolarHBondContact O-N 3.06Å; M653-V657 VanDerWaalsContact O-CB 3.24Å; M653-V657 WeakPolarHBondContact O-CB 3.45Å; M653-V657 WeakPolarHBondContact O-CG2 3.31Å; M653-V657 PolarHBondContact O-N 2.9Å
654	I	31.4	Very low	33.5	Very low	79 Å²	79	94.8 Å²	94.8	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-68.6	-39.8	168.8	-69.8	178.4	0	0	0	109.3	W650 E656 V657 E658	W650-I654 HydrophobicContact CE3-CD1 3.52Å; W650-I654 HydrophobicContact CE3-CG1 4.48Å; W650-I654 HydrophobicContact CZ3-CD1 3.85Å; W650-I654 WeakPolarHBondContact O-CA 3.31Å; W650-I654 WeakPolarHBondContact O-CB 3.43Å; W650-I654 WeakPolarHBondContact O-CG1 3.44Å; W650-I654 PolarHBondContact O-N 3.1Å; I654-E656 PolarHBondContact O-N 3.35Å; I654-V657 CarbonylContact O-C 3.56Å; I654-V657 PolarHBondContact O-N 3.26Å; I654-E658 WeakPolarHBondContact O-CA 3.27Å; I654-E658 WeakPolarHBondContact O-CB 3.49Å; I654-E658 PolarHBondContact O-N 2.95Å
655	G	30.3	Very low	34.8	Very low	22 Å²	22	90.7 Å²	90.7	23%	0.227	47%	0.467	C	S	.	.	H	α-helix	trans	-59	-45.8	173.5	0	0	0	0	0	113.2	E651 E658 D659	E651-G655 VanDerWaalsContact O-CA 3.31Å; E651-G655 WeakPolarHBondContact O-CA 3.32Å; E651-G655 PolarHBondContact O-N 3.47Å; G655-E658 PolarHBondContact O-N 3.15Å; G655-D659 VanDerWaalsContact O-CB 3.25Å; G655-D659 WeakPolarHBondContact O-CB 3.48Å; G655-D659 VanDerWaalsContact O-CG 3.27Å; G655-D659 PolarHBondContact O-N 3.36Å
656	E	29.7	Very low	36.2	Very low	109 Å²	109	88.7 Å²	88.7	51%	0.509	46%	0.455	S	S	.	.	H	α-helix	trans	-71.7	-27.1	175.7	-85	-163.4	168.9	0	0	113.6	T652 I654 R660	T652-E656 VanDerWaalsContact O-CB 3.29Å; T652-E656 WeakPolarHBondContact O-CB 3.34Å; T652-E656 WeakPolarHBondContact O-CG 3.42Å; T652-E656 PolarHBondContact O-N 2.94Å; I654-E656 PolarHBondContact O-N 3.35Å; E656-R660 WeakPolarHBondContact O-CB 2.87Å; E656-R660 WeakPolarHBondContact O-CD 2.97Å; E656-R660 WeakPolarHBondContact O-CG 2.9Å; E656-R660 PolarHBondContact O-N 2.87Å; E656-R660 PolarHBondContact O-NE 3.4Å; E656-R660 IonicContact OE2-CZ 3.05Å; E656-R660 IonicContact OE2-NH2 2.99Å; E656-R660 PolarHBondContact OE2-NH2 3.1Å
657	V	31.3	Very low	37.7	Very low	68 Å²	68	82.2 Å²	82.2	41%	0.412	43%	0.425	S	S	.	.	H	α-helix	trans	-80.7	-35.6	175	170.2	0	0	0	0	110.8	M653 I654 R660 L661	M653-V657 VanDerWaalsContact O-CB 3.24Å; M653-V657 WeakPolarHBondContact O-CB 3.45Å; M653-V657 WeakPolarHBondContact O-CG2 3.31Å; M653-V657 PolarHBondContact O-N 2.9Å; I654-V657 CarbonylContact O-C 3.56Å; I654-V657 PolarHBondContact O-N 3.26Å; V657-R660 PolarHBondContact O-N 3.19Å; V657-L661 HydrophobicContact CG1-CD1 4.41Å; V657-L661 PolarHBondContact O-N 3.43Å; V657-L661 VanDerWaalsContact O-N 3.15Å
658	E	35.4	Very low	39.3	Very low	100 Å²	100	79.8 Å²	79.8	47%	0.467	41%	0.408	S	S	.	.	H	α-helix	trans	-75.7	-24.8	177.2	-168.8	165.1	-166.8	0	0	112	I654 G655 K663	I654-E658 WeakPolarHBondContact O-CA 3.27Å; I654-E658 WeakPolarHBondContact O-CB 3.49Å; I654-E658 PolarHBondContact O-N 2.95Å; G655-E658 PolarHBondContact O-N 3.15Å; E658-K663 VanDerWaalsContact CG-CE 3.49Å; E658-K663 WeakPolarHBondContact O-CE 3.2Å
659	D	33.7	Very low	40.7	Very low	125 Å²	125	76.1 Å²	76.1	67%	0.668	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-19.4	167.3	-76.9	-16.4	0	0	0	113.3	G655	G655-D659 VanDerWaalsContact O-CB 3.25Å; G655-D659 WeakPolarHBondContact O-CB 3.48Å; G655-D659 VanDerWaalsContact O-CG 3.27Å; G655-D659 PolarHBondContact O-N 3.36Å
660	R	32	Very low	42.2	Very low	160 Å²	160	74.6 Å²	74.6	60%	0.604	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-18	175.7	-83	179.4	-130.8	-135	2.8	114.3	E656 V657	E656-R660 WeakPolarHBondContact O-CB 2.87Å; E656-R660 WeakPolarHBondContact O-CD 2.97Å; E656-R660 WeakPolarHBondContact O-CG 2.9Å; E656-R660 PolarHBondContact O-N 2.87Å; E656-R660 PolarHBondContact O-NE 3.4Å; E656-R660 IonicContact OE2-CZ 3.05Å; E656-R660 IonicContact OE2-NH2 2.99Å; E656-R660 PolarHBondContact OE2-NH2 3.1Å; V657-R660 PolarHBondContact O-N 3.19Å
661	L	34.6	Very low	43.8	Very low	77 Å²	77	67.1 Å²	67.1	40%	0.403	35%	0.35	S	S	.	.	S	Bend	trans	-84.5	122.1	169.3	-85.5	143.8	0	0	0	108.3	V657 K663	V657-L661 HydrophobicContact CG1-CD1 4.41Å; V657-L661 PolarHBondContact O-N 3.43Å; V657-L661 VanDerWaalsContact O-N 3.15Å; L661-K663 PolarHBondContact O-N 2.98Å
662	P	41	Very low	45.6	Very low	95 Å²	95	63 Å²	63	62%	0.617	33%	0.331	S	S	*	.			trans	-60.3	106.9	172.1	25.3	-30.6	0	0	0	106.4	S664	P662-S664 PolarHBondContact O-N 3.28Å; P662-S664 PolarHBondContact O-OG 3.33Å
663	K	46	Very low	47.4	Very low	101 Å²	101	62.6 Å²	62.6	44%	0.439	33%	0.326	S	S	.	.			trans	-61.8	76.3	172.4	-74.8	175.8	179	161.7	0	107.4	E658 L661 C665	E658-K663 VanDerWaalsContact CG-CE 3.49Å; E658-K663 WeakPolarHBondContact O-CE 3.2Å; L661-K663 PolarHBondContact O-N 2.98Å; K663-C665 PolarHBondContact O-N 3.07Å
664	S	50.1	Low	49.4	Very low	80 Å²	80	58.6 Å²	58.6	56%	0.559	31%	0.306	S	S	*	.			trans	-78.2	102.7	-169.2	-66.3	0	0	0	0	105.6	P662 F666	P662-S664 PolarHBondContact O-N 3.28Å; P662-S664 PolarHBondContact O-OG 3.33Å; S664-F666 VanDerWaalsContact C-N 3.34Å; S664-F666 PolarHBondContact O-N 3.02Å
665	C	59.8	Low	51.5	Low	13 Å²	13	54.9 Å²	54.9	9%	0.088	29%	0.287	C	S	.	.			trans	-59.7	102.8	173	-172.4	0	0	0	0	107.9	K663 T667 C668 T669 C833	K663-C665 PolarHBondContact O-N 3.07Å; C665-T667 PolarHBondContact O-N 3.31Å; C665-T667 VanDerWaalsContact O-N 3.16Å; C665-C668 HydrophobicContact CB-CB 3.84Å; C665-C668 VanDerWaalsContact CB-SG 3.58Å; C665-C668 WeakPolarHBondContact O-CA 3.5Å; C665-C668 VanDerWaalsContact O-CB 3.31Å; C665-C668 WeakPolarHBondContact O-CB 2.84Å; C665-C668 PolarHBondContact O-N 3.38Å; C665-C668 PolarHBondContact SG-SG 2.93Å; C665-T669 PolarHBondContact O-N 3Å; C665-T669 VanDerWaalsContact O-N 3.1Å; C665-T669 PolarHBondContact O-OG1 3.05Å; C665-C833 WeakPolarHBondContact CA-SG 3.22Å; C665-C833 HydrophobicContact CB-CB 3.49Å; C665-C833 VanDerWaalsContact CB-CB 3.49Å; C665-C833 WeakPolarHBondContact CB-SG 3.45Å; C665-C833 WeakPolarHBondContact SG-CB 3.28Å; C665-C833 CovalentContact SG-SG 2Å; C665-C833 PolarHBondContact SG-SG 3.07Å
666	F	60.5	Low	53.7	Low	46 Å²	46	54.1 Å²	54.1	20%	0.202	28%	0.278	C	S	.	.	H	α-helix	trans	-53.7	-39.2	-179.5	168	-94.9	0	0	0	111.1	M446 L449 I450 S664 C668 T669 H670	M446-F666 HydrophobicContact CB-CE1 4Å; M446-F666 HydrophobicContact CB-CE2 4.29Å; M446-F666 HydrophobicContact CB-CZ 3.33Å; M446-F666 HydrophobicContact CG-CE1 4.1Å; M446-F666 HydrophobicContact CG-CZ 3.51Å; M446-F666 HydrophobicContact SD-CE1 3.78Å; M446-F666 HydrophobicContact SD-CZ 3.8Å; L449-F666 HydrophobicContact CB-CD2 3.77Å; L449-F666 HydrophobicContact CB-CE2 3.51Å; L449-F666 HydrophobicContact CD1-CD2 4.02Å; L449-F666 HydrophobicContact CD1-CE2 3.64Å; L449-F666 HydrophobicContact CG-CE2 4.19Å; I450-F666 HydrophobicContact CD1-CE1 4.24Å; I450-F666 HydrophobicContact CG1-CD1 4.46Å; I450-F666 HydrophobicContact CG1-CE1 4.37Å; I450-F666 HydrophobicContact CG1-CZ 4.47Å; S664-F666 VanDerWaalsContact C-N 3.34Å; S664-F666 PolarHBondContact O-N 3.02Å; F666-C668 VanDerWaalsContact C-N 3.27Å; F666-C668 PolarHBondContact O-N 3.33Å; F666-T669 PolarHBondContact O-N 3.31Å; F666-H670 AromaticContact CD2-CD2 3.84Å; F666-H670 AromaticContact CD2-NE2 3.89Å; F666-H670 AromaticContact CE1-CD2 3.5Å; F666-H670 VanDerWaalsContact CE1-CD2 3.5Å; F666-H670 WeakPolarHBondContact CE1-CD2 3.37Å; F666-H670 AromaticContact CE1-NE2 3.87Å; F666-H670 AromaticContact CE2-CD2 3.2Å; F666-H670 WeakPolarHBondContact CE2-CD2 3.05Å; F666-H670 AromaticContact CE2-NE2 2.9Å; F666-H670 WeakPolarHBondContact CE2-NE2 3.46Å; F666-H670 AromaticContact CZ-CD2 2.97Å; F666-H670 WeakPolarHBondContact CZ-CD2 3.36Å; F666-H670 AromaticContact CZ-CE1 3.97Å; F666-H670 AromaticContact CZ-NE2 2.87Å; F666-H670 WeakPolarHBondContact CZ-NE2 3.47Å; F666-H670 PolarHBondContact O-CD2 3.28Å; F666-H670 VanDerWaalsContact O-CD2 3.31Å; F666-H670 PolarHBondContact O-N 3.26Å
667	T	63.7	Low	55.9	Low	13 Å²	13	49.4 Å²	49.4	8%	0.08	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-35.9	172.1	-45.3	0	0	0	0	112.3	Y205 C665 L671 F743 S830	Y205-T667 HydrophobicContact CD1-CG2 3.37Å; Y205-T667 HydrophobicContact CE1-CG2 3.7Å; Y205-T667 HydrophobicContact CG-CG2 3.83Å; C665-T667 PolarHBondContact O-N 3.31Å; C665-T667 VanDerWaalsContact O-N 3.16Å; T667-L671 HydrophobicContact CG2-CD1 4.33Å; T667-L671 WeakPolarHBondContact O-CD1 3.48Å; T667-F743 HydrophobicContact CG2-CD1 3.93Å; T667-S830 PolarHBondContact OG1-OG 2.98Å
668	C	65.1	Low	58.3	Low	17 Å²	17	46.3 Å²	46.3	12%	0.115	24%	0.237	C	C	.	.	H	α-helix	trans	-72.7	-41	175.9	-67	0	0	0	0	113.2	G206 C665 F666 H670 L671 Q672	G206-C668 WeakPolarHBondContact CA-SG 3.32Å; G206-C668 PolarHBondContact N-SG 3.38Å; C665-C668 HydrophobicContact CB-CB 3.84Å; C665-C668 VanDerWaalsContact CB-SG 3.58Å; C665-C668 WeakPolarHBondContact O-CA 3.5Å; C665-C668 VanDerWaalsContact O-CB 3.31Å; C665-C668 WeakPolarHBondContact O-CB 2.84Å; C665-C668 PolarHBondContact O-N 3.38Å; C665-C668 PolarHBondContact SG-SG 2.93Å; F666-C668 VanDerWaalsContact C-N 3.27Å; F666-C668 PolarHBondContact O-N 3.33Å; C668-H670 VanDerWaalsContact C-N 3.26Å; C668-H670 PolarHBondContact O-N 3.06Å; C668-L671 WeakPolarHBondContact O-CB 3.38Å; C668-L671 PolarHBondContact O-N 3.21Å; C668-Q672 WeakPolarHBondContact O-CG 3.45Å; C668-Q672 PolarHBondContact O-N 3.38Å
669	T	61.4	Low	60.5	Low	24 Å²	24	43.2 Å²	43.2	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-57.5	-42.9	179.2	-48.9	0	0	0	0	110.9	E377 C665 F666 L671 Q672 E673	E377-T669 VanDerWaalsContact OE1-CG2 3.31Å; E377-T669 WeakPolarHBondContact OE1-CG2 3.25Å; C665-T669 PolarHBondContact O-N 3Å; C665-T669 VanDerWaalsContact O-N 3.1Å; C665-T669 PolarHBondContact O-OG1 3.05Å; F666-T669 PolarHBondContact O-N 3.31Å; T669-L671 VanDerWaalsContact C-N 3.26Å; T669-L671 PolarHBondContact O-N 3.33Å; T669-Q672 PolarHBondContact O-N 2.85Å; T669-E673 PolarHBondContact O-N 2.85Å
670	H	60.7	Low	62.7	Low	12 Å²	12	37.6 Å²	37.6	6%	0.056	20%	0.195	C	C	.	.	H	α-helix	trans	-61.4	-32.9	176.2	-86.9	-69.8	0	0	0	114.4	V442 M446 F666 C668 I674	V442-H670 WeakPolarHBondContact CG1-ND1 3.28Å; M446-H670 VanDerWaalsContact CG-CE1 3.41Å; M446-H670 WeakPolarHBondContact CG-CE1 3.04Å; F666-H670 AromaticContact CD2-CD2 3.84Å; F666-H670 AromaticContact CD2-NE2 3.89Å; F666-H670 AromaticContact CE1-CD2 3.5Å; F666-H670 VanDerWaalsContact CE1-CD2 3.5Å; F666-H670 WeakPolarHBondContact CE1-CD2 3.37Å; F666-H670 AromaticContact CE1-NE2 3.87Å; F666-H670 AromaticContact CE2-CD2 3.2Å; F666-H670 WeakPolarHBondContact CE2-CD2 3.05Å; F666-H670 AromaticContact CE2-NE2 2.9Å; F666-H670 WeakPolarHBondContact CE2-NE2 3.46Å; F666-H670 AromaticContact CZ-CD2 2.97Å; F666-H670 WeakPolarHBondContact CZ-CD2 3.36Å; F666-H670 AromaticContact CZ-CE1 3.97Å; F666-H670 AromaticContact CZ-NE2 2.87Å; F666-H670 WeakPolarHBondContact CZ-NE2 3.47Å; F666-H670 PolarHBondContact O-CD2 3.28Å; F666-H670 VanDerWaalsContact O-CD2 3.31Å; F666-H670 PolarHBondContact O-N 3.26Å; C668-H670 VanDerWaalsContact C-N 3.26Å; C668-H670 PolarHBondContact O-N 3.06Å; H670-I674 PolarHBondContact O-N 3.43Å
671	L	64.7	Low	65.1	Low	4 Å²	4	30.4 Å²	30.4	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-84.5	-32.2	-173.2	-86.5	50.8	0	0	0	110.9	F204 T667 C668 T669 E673 I674 A675 F743 C744	F204-L671 HydrophobicContact CD1-CB 4.02Å; F204-L671 HydrophobicContact CE1-CB 4.38Å; T667-L671 HydrophobicContact CG2-CD1 4.33Å; T667-L671 WeakPolarHBondContact O-CD1 3.48Å; C668-L671 WeakPolarHBondContact O-CB 3.38Å; C668-L671 PolarHBondContact O-N 3.21Å; T669-L671 VanDerWaalsContact C-N 3.26Å; T669-L671 PolarHBondContact O-N 3.33Å; L671-E673 PolarHBondContact O-N 3.14Å; L671-I674 PolarHBondContact O-N 3.01Å; L671-A675 WeakPolarHBondContact O-CB 3.31Å; L671-A675 PolarHBondContact O-N 3.5Å; L671-F743 HydrophobicContact CD1-CB 3.08Å; L671-F743 HydrophobicContact CD1-CD1 4.19Å; L671-F743 HydrophobicContact CD1-CD2 4.21Å; L671-F743 HydrophobicContact CD1-CG 3.63Å; L671-F743 HydrophobicContact CD2-CB 3.43Å; L671-F743 VanDerWaalsContact CD2-CB 3.43Å; L671-F743 WeakPolarHBondContact CD2-O 3.03Å; L671-F743 HydrophobicContact CG-CB 3.35Å; L671-F743 HydrophobicContact CG-CG 4.4Å; L671-C744 HydrophobicContact CD2-CB 4.19Å; L671-C744 HydrophobicContact CG-CB 4.32Å
672	Q	67.9	Low	67.6	Low	16 Å²	16	28.1 Å²	28.1	8%	0.075	16%	0.156	C	C	.	.	H	α-helix	trans	-56.8	-44.4	169.4	-74.2	174.5	-23	0	0	109.5	F194 F204 C668 T669 I674 A675 K676	F194-Q672 HydrophobicContact CB-CG 4.3Å; F194-Q672 PolarHBondContact O-NE2 3.41Å; F204-Q672 HydrophobicContact CD1-CG 4.25Å; F204-Q672 HydrophobicContact CE1-CB 4.42Å; F204-Q672 HydrophobicContact CE1-CG 3.73Å; F204-Q672 HydrophobicContact CE2-CG 4.44Å; F204-Q672 HydrophobicContact CZ-CG 3.85Å; C668-Q672 WeakPolarHBondContact O-CG 3.45Å; C668-Q672 PolarHBondContact O-N 3.38Å; T669-Q672 PolarHBondContact O-N 2.85Å; Q672-I674 PolarHBondContact O-N 3.24Å; Q672-A675 PolarHBondContact O-N 2.87Å; Q672-K676 WeakPolarHBondContact O-CB 3.48Å; Q672-K676 WeakPolarHBondContact O-CG 3.37Å; Q672-K676 PolarHBondContact O-N 3.38Å
673	E	67.7	Low	69.8	Low	46 Å²	46	26.6 Å²	26.6	22%	0.215	15%	0.145	C	C	.	.	H	α-helix	trans	-63.5	-39.2	176.6	-66.3	-54.2	131	0	0	113.4	T669 L671 K676 L677	T669-E673 PolarHBondContact O-N 2.85Å; L671-E673 PolarHBondContact O-N 3.14Å; E673-K676 IonicContact OE1-NZ 2.9Å; E673-K676 PolarHBondContact OE1-NZ 3.14Å; E673-L677 WeakPolarHBondContact O-CB 3.4Å; E673-L677 PolarHBondContact O-N 3.12Å
674	I	71.4	Confident	71.5	Confident	24 Å²	24	23.9 Å²	23.9	12%	0.123	14%	0.135	C	C	.	.	H	α-helix	trans	-68	-40.6	174.7	-64	168.7	0	0	0	111.2	H670 L671 Q672 L677 V678 L739 L747	H670-I674 PolarHBondContact O-N 3.43Å; L671-I674 PolarHBondContact O-N 3.01Å; Q672-I674 PolarHBondContact O-N 3.24Å; I674-L677 WeakPolarHBondContact O-CB 3.19Å; I674-L677 PolarHBondContact O-N 3.44Å; I674-V678 WeakPolarHBondContact O-CG2 3.45Å; I674-V678 PolarHBondContact O-N 3.3Å; I674-L739 HydrophobicContact CD1-CD2 3.87Å; I674-L747 HydrophobicContact CG2-CD2 4.2Å
675	A	75.5	Confident	73.1	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.7	-44.6	177.3	0	0	0	0	0	111.2	F194 F204 L671 Q672 L677 V678 T679 L747	F194-A675 HydrophobicContact CD2-CB 4.45Å; F194-A675 HydrophobicContact CE2-CB 4.32Å; F194-A675 HydrophobicContact CZ-CB 4.37Å; F204-A675 HydrophobicContact CE1-CB 4.16Å; F204-A675 HydrophobicContact CZ-CB 4.36Å; L671-A675 WeakPolarHBondContact O-CB 3.31Å; L671-A675 PolarHBondContact O-N 3.5Å; Q672-A675 PolarHBondContact O-N 2.87Å; A675-L677 VanDerWaalsContact C-N 3.34Å; A675-L677 PolarHBondContact O-N 2.95Å; A675-V678 PolarHBondContact O-N 3.23Å; A675-T679 PolarHBondContact O-N 2.9Å; A675-T679 PolarHBondContact O-OG1 2.81Å; A675-L747 HydrophobicContact CB-CD1 4.49Å
676	K	75.8	Confident	74.5	Confident	7 Å²	7	21.5 Å²	21.5	3%	0.03	12%	0.116	C	C	.	.	H	α-helix	trans	-56	-47.6	169.8	-71.2	176.5	-161.4	-174.3	0	110.8	D193 F194 P391 Q672 E673 V678 T679 M680	D193-K676 WeakPolarHBondContact O-CE 3.42Å; D193-K676 WeakPolarHBondContact OD1-CE 3.41Å; D193-K676 IonicContact OD1-NZ 3.46Å; D193-K676 PolarHBondContact OD1-NZ 3.49Å; F194-K676 HydrophobicContact CD2-CG 3.69Å; F194-K676 HydrophobicContact CE2-CG 4.1Å; P391-K676 HydrophobicContact CG-CB 4.46Å; Q672-K676 WeakPolarHBondContact O-CB 3.48Å; Q672-K676 WeakPolarHBondContact O-CG 3.37Å; Q672-K676 PolarHBondContact O-N 3.38Å; E673-K676 IonicContact OE1-NZ 2.9Å; E673-K676 PolarHBondContact OE1-NZ 3.14Å; K676-V678 VanDerWaalsContact C-N 3.3Å; K676-V678 PolarHBondContact O-N 2.8Å; K676-T679 WeakPolarHBondContact CA-OG1 3.15Å; K676-T679 PolarHBondContact O-N 3.42Å; K676-T679 PolarHBondContact O-OG1 3.45Å; K676-M680 WeakPolarHBondContact O-CB 3.48Å; K676-M680 WeakPolarHBondContact O-CG 3.32Å; K676-M680 PolarHBondContact O-N 3.02Å
677	L	75.9	Confident	75.7	Confident	9 Å²	9	21.1 Å²	21.1	5%	0.047	12%	0.122	C	C	.	.	H	α-helix	trans	-56.7	-44.6	177.7	-177.3	68.7	0	0	0	112.1	P391 V394 L438 E673 I674 A675 D681 M736	P391-L677 HydrophobicContact CB-CD1 3.97Å; P391-L677 HydrophobicContact CG-CB 4.48Å; P391-L677 HydrophobicContact CG-CD1 4.35Å; V394-L677 HydrophobicContact CB-CD1 4.23Å; V394-L677 HydrophobicContact CG1-CD1 4.26Å; L438-L677 HydrophobicContact CD1-CD2 4.5Å; L438-L677 HydrophobicContact CD2-CD2 3.43Å; L438-L677 VanDerWaalsContact CD2-CD2 3.43Å; E673-L677 WeakPolarHBondContact O-CB 3.4Å; E673-L677 PolarHBondContact O-N 3.12Å; I674-L677 WeakPolarHBondContact O-CB 3.19Å; I674-L677 PolarHBondContact O-N 3.44Å; A675-L677 VanDerWaalsContact C-N 3.34Å; A675-L677 PolarHBondContact O-N 2.95Å; L677-D681 WeakPolarHBondContact O-CB 3.3Å; L677-D681 PolarHBondContact O-N 3.01Å; L677-M736 HydrophobicContact CD2-SD 3.76Å; L677-M736 HydrophobicContact CG-SD 4.14Å
678	V	81.3	Confident	76.5	Confident	3 Å²	3	21.5 Å²	21.5	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-65.9	-38.3	179.2	173	0	0	0	0	112	I674 A675 K676 L682 L747 K754	I674-V678 WeakPolarHBondContact O-CG2 3.45Å; I674-V678 PolarHBondContact O-N 3.3Å; A675-V678 PolarHBondContact O-N 3.23Å; K676-V678 VanDerWaalsContact C-N 3.3Å; K676-V678 PolarHBondContact O-N 2.8Å; V678-L682 PolarHBondContact O-N 3.46Å; V678-L747 HydrophobicContact CG2-CD1 4.46Å; V678-K754 HydrophobicContact CG1-CD 3.92Å; V678-K754 PolarHBondContact O-NZ 2.81Å
679	T	82.5	Confident	77.4	Confident	36 Å²	36	20.8 Å²	20.8	22%	0.221	12%	0.12	C	C	.	.	H	α-helix	trans	-76.1	-42.7	178.1	54.1	0	0	0	0	113.1	F194 A675 K676 D681 L682 V683 M750	F194-T679 HydrophobicContact CE2-CG2 4.13Å; F194-T679 HydrophobicContact CZ-CG2 3.63Å; A675-T679 PolarHBondContact O-N 2.9Å; A675-T679 PolarHBondContact O-OG1 2.81Å; K676-T679 WeakPolarHBondContact CA-OG1 3.15Å; K676-T679 PolarHBondContact O-N 3.42Å; K676-T679 PolarHBondContact O-OG1 3.45Å; T679-D681 VanDerWaalsContact C-N 3.25Å; T679-D681 PolarHBondContact O-N 3.31Å; T679-L682 WeakPolarHBondContact O-CA 3.26Å; T679-L682 VanDerWaalsContact O-CB 3.31Å; T679-L682 WeakPolarHBondContact O-CB 3.06Å; T679-L682 PolarHBondContact O-N 3.46Å; T679-V683 WeakPolarHBondContact O-CG2 3.44Å; T679-V683 PolarHBondContact O-N 2.87Å; T679-M750 HydrophobicContact CG2-CE 3.66Å
680	M	79.7	Confident	78.5	Confident	6 Å²	6	23.1 Å²	23.1	3%	0.03	13%	0.131	C	C	.	.	H	α-helix	trans	-62.2	-37.6	174.4	-62.3	-54.9	164.6	0	0	111.1	W192 I388 P391 K676 L682 V683 M684	W192-M680 HydrophobicContact CD2-CE 4.45Å; W192-M680 VanDerWaalsContact CE2-CE 3.5Å; W192-M680 HydrophobicContact CG-CE 4.45Å; W192-M680 HydrophobicContact CZ2-CE 3.95Å; W192-M680 HydrophobicContact CZ2-SD 3.73Å; I388-M680 HydrophobicContact CB-CE 4.4Å; I388-M680 HydrophobicContact CD1-CE 4.14Å; I388-M680 HydrophobicContact CG1-CE 4.08Å; I388-M680 HydrophobicContact CG2-CE 3.33Å; I388-M680 HydrophobicContact CG2-CG 3.7Å; I388-M680 HydrophobicContact CG2-SD 3.47Å; I388-M680 WeakPolarHBondContact CG2-SD 3.34Å; P391-M680 HydrophobicContact CB-CB 3.55Å; P391-M680 HydrophobicContact CB-CG 3.54Å; P391-M680 HydrophobicContact CG-CG 4.24Å; K676-M680 WeakPolarHBondContact O-CB 3.48Å; K676-M680 WeakPolarHBondContact O-CG 3.32Å; K676-M680 PolarHBondContact O-N 3.02Å; M680-L682 VanDerWaalsContact C-N 3.28Å; M680-L682 PolarHBondContact O-N 3.12Å; M680-V683 PolarHBondContact O-N 3.02Å; M680-V683 VanDerWaalsContact O-N 3.15Å; M680-M684 WeakPolarHBondContact O-CB 3.15Å; M680-M684 VanDerWaalsContact O-CG 3.28Å; M680-M684 WeakPolarHBondContact O-CG 3.48Å; M680-M684 PolarHBondContact O-N 3.03Å
681	D	82.3	Confident	79.4	Confident	9 Å²	9	26.4 Å²	26.4	5%	0.048	15%	0.152	C	C	.	.	H	α-helix	trans	-61.3	-37.5	173.5	-179.3	73.5	0	0	0	111.7	S395 L677 T679 N685 K754	S395-D681 VanDerWaalsContact OG-CA 3.23Å; S395-D681 WeakPolarHBondContact OG-CA 3.24Å; S395-D681 WeakPolarHBondContact OG-CB 3.12Å; S395-D681 PolarHBondContact OG-OD1 3.35Å; L677-D681 WeakPolarHBondContact O-CB 3.3Å; L677-D681 PolarHBondContact O-N 3.01Å; T679-D681 VanDerWaalsContact C-N 3.25Å; T679-D681 PolarHBondContact O-N 3.31Å; D681-N685 VanDerWaalsContact CG-ND2 3.27Å; D681-N685 WeakPolarHBondContact O-CB 3.33Å; D681-N685 PolarHBondContact O-N 3.2Å; D681-N685 PolarHBondContact O-ND2 3.4Å; D681-N685 PolarHBondContact OD1-ND2 3.15Å; D681-N685 PolarHBondContact OD2-ND2 3.48Å; D681-K754 WeakPolarHBondContact OD2-CE 3.35Å; D681-K754 IonicContact OD2-NZ 2.66Å; D681-K754 PolarHBondContact OD2-NZ 3.28Å
682	L	86.8	Confident	79.9	Confident	29 Å²	29	28.8 Å²	28.8	15%	0.152	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-48.9	171.6	172.2	60.7	0	0	0	111.4	V678 T679 M680 M684 N685 V686 K754 I757	V678-L682 PolarHBondContact O-N 3.46Å; T679-L682 WeakPolarHBondContact O-CA 3.26Å; T679-L682 VanDerWaalsContact O-CB 3.31Å; T679-L682 WeakPolarHBondContact O-CB 3.06Å; T679-L682 PolarHBondContact O-N 3.46Å; M680-L682 VanDerWaalsContact C-N 3.28Å; M680-L682 PolarHBondContact O-N 3.12Å; L682-M684 PolarHBondContact O-N 2.99Å; L682-N685 PolarHBondContact O-N 2.78Å; L682-V686 HydrophobicContact CD1-CG2 3.89Å; L682-V686 WeakPolarHBondContact O-CG2 3.47Å; L682-V686 PolarHBondContact O-N 3.01Å; L682-K754 HydrophobicContact CB-CD 4.17Å; L682-K754 HydrophobicContact CB-CG 4.05Å; L682-K754 HydrophobicContact CD1-CG 4.07Å; L682-K754 HydrophobicContact CD2-CB 4.37Å; L682-K754 HydrophobicContact CD2-CG 4.29Å; L682-K754 HydrophobicContact CG-CG 4.35Å; L682-I757 HydrophobicContact CD1-CB 4.21Å; L682-I757 HydrophobicContact CD1-CG2 3.89Å; L682-I757 HydrophobicContact CD2-CD1 3.88Å
683	V	86.5	Confident	80.3	Confident	64 Å²	64	28.9 Å²	28.9	39%	0.388	17%	0.168	S	C	.	.	H	α-helix	trans	-59.8	-48.9	-179	175.1	0	0	0	0	110.7	W192 T679 M680 N685 V686 A687	W192-V683 HydrophobicContact CH2-CG2 3.91Å; W192-V683 HydrophobicContact CZ2-CG2 4.28Å; T679-V683 WeakPolarHBondContact O-CG2 3.44Å; T679-V683 PolarHBondContact O-N 2.87Å; M680-V683 PolarHBondContact O-N 3.02Å; M680-V683 VanDerWaalsContact O-N 3.15Å; V683-N685 PolarHBondContact O-N 3.41Å; V683-V686 PolarHBondContact O-N 3.3Å; V683-A687 VanDerWaalsContact O-CB 3.27Å; V683-A687 WeakPolarHBondContact O-CB 3.28Å; V683-A687 PolarHBondContact O-N 3.31Å
684	M	82.8	Confident	81	Confident	44 Å²	44	30.3 Å²	30.3	22%	0.217	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-37.4	179	-67.1	-57.9	-70	0	0	112.2	F396 L399 M680 L682 S688	F396-M684 HydrophobicContact CB-CE 4.29Å; F396-M684 HydrophobicContact CD2-CE 4.38Å; L399-M684 HydrophobicContact CD1-CB 3.85Å; L399-M684 WeakPolarHBondContact CD1-O 3.49Å; M680-M684 WeakPolarHBondContact O-CB 3.15Å; M680-M684 VanDerWaalsContact O-CG 3.28Å; M680-M684 WeakPolarHBondContact O-CG 3.48Å; M680-M684 PolarHBondContact O-N 3.03Å; L682-M684 PolarHBondContact O-N 2.99Å; M684-S688 VanDerWaalsContact O-CB 3.24Å; M684-S688 WeakPolarHBondContact O-CB 3.43Å; M684-S688 PolarHBondContact O-N 3.44Å; M684-S688 PolarHBondContact O-OG 3.05Å
685	N	83.8	Confident	81.4	Confident	5 Å²	5	33.4 Å²	33.4	3%	0.027	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-44.3	172.2	-83.6	-57.3	0	0	0	111.6	L399 D681 L682 V683 S688 I689	L399-N685 VanDerWaalsContact CD2-OD1 3.25Å; L399-N685 WeakPolarHBondContact CD2-OD1 3.2Å; D681-N685 VanDerWaalsContact CG-ND2 3.27Å; D681-N685 WeakPolarHBondContact O-CB 3.33Å; D681-N685 PolarHBondContact O-N 3.2Å; D681-N685 PolarHBondContact O-ND2 3.4Å; D681-N685 PolarHBondContact OD1-ND2 3.15Å; D681-N685 PolarHBondContact OD2-ND2 3.48Å; L682-N685 PolarHBondContact O-N 2.78Å; V683-N685 PolarHBondContact O-N 3.41Å; N685-S688 WeakPolarHBondContact CA-OG 3.47Å; N685-S688 PolarHBondContact O-OG 3.38Å; N685-I689 WeakPolarHBondContact O-CD1 3.35Å; N685-I689 WeakPolarHBondContact O-CG1 3.4Å; N685-I689 PolarHBondContact O-N 2.83Å
686	V	87.4	Confident	81.5	Confident	38 Å²	38	36.7 Å²	36.7	23%	0.23	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-46.1	177.5	172.8	0	0	0	0	110.8	L682 V683 S688 I689 L690 I757 T761	L682-V686 HydrophobicContact CD1-CG2 3.89Å; L682-V686 WeakPolarHBondContact O-CG2 3.47Å; L682-V686 PolarHBondContact O-N 3.01Å; V683-V686 PolarHBondContact O-N 3.3Å; V686-S688 PolarHBondContact O-N 2.92Å; V686-I689 PolarHBondContact O-N 2.89Å; V686-L690 HydrophobicContact CG1-CD1 4.13Å; V686-L690 WeakPolarHBondContact O-CG 3.22Å; V686-L690 PolarHBondContact O-N 3.32Å; V686-I757 HydrophobicContact CG2-CG2 4.27Å; V686-T761 HydrophobicContact CG1-CG2 4.37Å; V686-T761 HydrophobicContact CG2-CG2 4.39Å
687	A	85.7	Confident	81.5	Confident	38 Å²	38	36.6 Å²	36.6	31%	0.314	20%	0.203	S	C	.	.	H	α-helix	trans	-61.3	-42.1	178.3	0	0	0	0	0	111.9	V683 L690 T691	V683-A687 VanDerWaalsContact O-CB 3.27Å; V683-A687 WeakPolarHBondContact O-CB 3.28Å; V683-A687 PolarHBondContact O-N 3.31Å; A687-L690 PolarHBondContact O-N 3.49Å; A687-T691 VanDerWaalsContact O-CB 3.3Å; A687-T691 WeakPolarHBondContact O-CB 3.38Å; A687-T691 PolarHBondContact O-N 3.12Å; A687-T691 PolarHBondContact O-OG1 3.4Å
688	S	81.9	Confident	81.7	Confident	21 Å²	21	39.1 Å²	39.1	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-69	-35.9	176	59	0	0	0	0	112.8	M684 N685 V686 L690 T691 V692	M684-S688 VanDerWaalsContact O-CB 3.24Å; M684-S688 WeakPolarHBondContact O-CB 3.43Å; M684-S688 PolarHBondContact O-N 3.44Å; M684-S688 PolarHBondContact O-OG 3.05Å; N685-S688 WeakPolarHBondContact CA-OG 3.47Å; N685-S688 PolarHBondContact O-OG 3.38Å; V686-S688 PolarHBondContact O-N 2.92Å; S688-L690 VanDerWaalsContact C-N 3.33Å; S688-T691 PolarHBondContact O-N 3.05Å; S688-V692 WeakPolarHBondContact O-CA 3.21Å; S688-V692 WeakPolarHBondContact O-CB 3.39Å; S688-V692 WeakPolarHBondContact O-CG2 3.19Å; S688-V692 PolarHBondContact O-N 3.44Å
689	I	84.1	Confident	81.6	Confident	2 Å²	2	46 Å²	46	1%	0.01	24%	0.242	C	C	.	.	I	π-helix	trans	-61.6	-45	172.2	-66.6	158.2	0	0	0	110	N685 V686 D693 F694 T761 R762 A765	N685-I689 WeakPolarHBondContact O-CD1 3.35Å; N685-I689 WeakPolarHBondContact O-CG1 3.4Å; N685-I689 PolarHBondContact O-N 2.83Å; V686-I689 PolarHBondContact O-N 2.89Å; I689-D693 WeakPolarHBondContact O-CA 3.4Å; I689-D693 VanDerWaalsContact O-CB 3.31Å; I689-D693 WeakPolarHBondContact O-CB 3.45Å; I689-D693 PolarHBondContact O-N 3.2Å; I689-F694 PolarHBondContact O-N 3.08Å; I689-T761 HydrophobicContact CB-CG2 4.33Å; I689-T761 HydrophobicContact CD1-CG2 3.78Å; I689-T761 HydrophobicContact CG2-CG2 4.06Å; I689-R762 HydrophobicContact CD1-CG 3.96Å; I689-R762 VanDerWaalsContact CD1-NE 3.26Å; I689-A765 HydrophobicContact CG2-CB 3.45Å; I689-A765 VanDerWaalsContact CG2-CB 3.45Å
690	L	83.3	Confident	81.3	Confident	73 Å²	73	44.3 Å²	44.3	38%	0.382	23%	0.231	S	C	.	.	I	π-helix	trans	-65.7	-40.5	177.4	-68.3	170.7	0	0	0	112.2	V686 A687 S688 F694 L695 W764	V686-L690 HydrophobicContact CG1-CD1 4.13Å; V686-L690 WeakPolarHBondContact O-CG 3.22Å; V686-L690 PolarHBondContact O-N 3.32Å; A687-L690 PolarHBondContact O-N 3.49Å; S688-L690 VanDerWaalsContact C-N 3.33Å; L690-F694 WeakPolarHBondContact O-CA 3.41Å; L690-F694 WeakPolarHBondContact O-CB 3.24Å; L690-F694 PolarHBondContact O-N 2.81Å; L690-L695 PolarHBondContact O-N 3.07Å; L690-W764 HydrophobicContact CD2-CH2 3.97Å; L690-W764 HydrophobicContact CD2-CZ3 3.77Å
691	T	79.4	Confident	81.1	Confident	80 Å²	80	51.7 Å²	51.7	49%	0.491	26%	0.259	S	S	.	.	I	π-helix	trans	-78.4	-46.3	-176.5	-51.4	0	0	0	0	111.6	A687 S688 L695	A687-T691 VanDerWaalsContact O-CB 3.3Å; A687-T691 WeakPolarHBondContact O-CB 3.38Å; A687-T691 PolarHBondContact O-N 3.12Å; A687-T691 PolarHBondContact O-OG1 3.4Å; S688-T691 PolarHBondContact O-N 3.05Å; T691-L695 HydrophobicContact CG2-CD1 3.81Å; T691-L695 VanDerWaalsContact O-CB 3.22Å; T691-L695 WeakPolarHBondContact O-CB 3.27Å
692	V	75.6	Confident	80.9	Confident	55 Å²	55	57.9 Å²	57.9	33%	0.333	29%	0.286	S	S	.	.	I	π-helix	trans	-87.5	-37.9	-172	-179.2	0	0	0	0	112.5	S688 R696	S688-V692 WeakPolarHBondContact O-CA 3.21Å; S688-V692 WeakPolarHBondContact O-CB 3.39Å; S688-V692 WeakPolarHBondContact O-CG2 3.19Å; S688-V692 PolarHBondContact O-N 3.44Å; V692-R696 WeakPolarHBondContact O-CB 3.43Å; V692-R696 PolarHBondContact O-NE 3.49Å
693	D	77.7	Confident	80.3	Confident	18 Å²	18	57.5 Å²	57.5	10%	0.096	29%	0.285	C	S	.	.	I	π-helix	trans	-92.8	-47.7	-179.4	-63.8	-27.8	0	0	0	110.6	I689 R696 G697 R762 C769	I689-D693 WeakPolarHBondContact O-CA 3.4Å; I689-D693 VanDerWaalsContact O-CB 3.31Å; I689-D693 WeakPolarHBondContact O-CB 3.45Å; I689-D693 PolarHBondContact O-N 3.2Å; D693-R696 IonicContact OD1-NH2 3.28Å; D693-R696 PolarHBondContact OD1-NH2 2.94Å; D693-R696 VanDerWaalsContact OD1-NH2 3.09Å; D693-G697 PolarHBondContact O-N 3.38Å; D693-R762 IonicContact OD2-NH1 2.64Å; D693-C769 HydrophobicContact CB-CB 4.28Å; D693-C769 WeakPolarHBondContact O-CB 3.42Å
694	F	81	Confident	79.5	Confident	75 Å²	75	57.5 Å²	57.5	33%	0.329	29%	0.285	S	S	.	.	I	π-helix	trans	-75.2	-51.6	-177.4	174.5	-90.7	0	0	0	113.2	I689 L690 R696 G697 L698 W764	I689-F694 PolarHBondContact O-N 3.08Å; L690-F694 WeakPolarHBondContact O-CA 3.41Å; L690-F694 WeakPolarHBondContact O-CB 3.24Å; L690-F694 PolarHBondContact O-N 2.81Å; F694-R696 VanDerWaalsContact C-N 3.35Å; F694-R696 PolarHBondContact O-N 3.15Å; F694-G697 PolarHBondContact O-N 3.48Å; F694-L698 HydrophobicContact CE1-CD2 4.09Å; F694-L698 HydrophobicContact CZ-CD2 4.32Å; F694-L698 VanDerWaalsContact O-CB 3.25Å; F694-L698 WeakPolarHBondContact O-CB 3.34Å; F694-L698 PolarHBondContact O-N 3.01Å; F694-W764 HydrophobicContact CB-CH2 4.3Å; F694-W764 AromaticContact CD2-CH2 3.7Å; F694-W764 HydrophobicContact CD2-CH2 3.7Å; F694-W764 HydrophobicContact CD2-CZ2 4.24Å; F694-W764 HydrophobicContact CE2-CH2 4.32Å; F694-W764 HydrophobicContact CG-CH2 4.19Å
695	L	81	Confident	78.8	Confident	89 Å²	89	60.2 Å²	60.2	47%	0.466	31%	0.309	S	S	.	.	I	π-helix	trans	-65.4	-37.1	177.8	-57.1	172.6	0	0	0	112.2	L690 T691 L698 W699	L690-L695 PolarHBondContact O-N 3.07Å; T691-L695 HydrophobicContact CG2-CD1 3.81Å; T691-L695 VanDerWaalsContact O-CB 3.22Å; T691-L695 WeakPolarHBondContact O-CB 3.27Å; L695-L698 PolarHBondContact O-N 3.29Å; L695-W699 WeakPolarHBondContact O-CB 3.16Å; L695-W699 PolarHBondContact O-N 3.4Å
696	R	77.8	Confident	78.1	Confident	70 Å²	70	71.2 Å²	71.2	26%	0.264	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-47.8	173.7	-179.2	171.7	53.3	154.2	-7.6	111.6	V692 D693 F694 L698 W699 V700 P716	V692-R696 WeakPolarHBondContact O-CB 3.43Å; V692-R696 PolarHBondContact O-NE 3.49Å; D693-R696 IonicContact OD1-NH2 3.28Å; D693-R696 PolarHBondContact OD1-NH2 2.94Å; D693-R696 VanDerWaalsContact OD1-NH2 3.09Å; F694-R696 VanDerWaalsContact C-N 3.35Å; F694-R696 PolarHBondContact O-N 3.15Å; R696-L698 VanDerWaalsContact C-N 3.3Å; R696-L698 PolarHBondContact O-N 3.24Å; R696-W699 PolarHBondContact O-N 3.42Å; R696-V700 VanDerWaalsContact O-CG2 3.28Å; R696-V700 WeakPolarHBondContact O-CG2 3.31Å; R696-V700 PolarHBondContact O-N 3.32Å; R696-P716 HydrophobicContact CG-CB 4.21Å
697	G	75.6	Confident	77	Confident	5 Å²	5	76.7 Å²	76.7	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-63	-37.8	177.1	0	0	0	0	0	112.6	D693 F694 R701	D693-G697 PolarHBondContact O-N 3.38Å; F694-G697 PolarHBondContact O-N 3.48Å; G697-R701 WeakPolarHBondContact O-CG 3.39Å; G697-R701 PolarHBondContact O-N 2.99Å; G697-R701 VanDerWaalsContact O-N 3.16Å
698	L	80.6	Confident	76	Confident	62 Å²	62	81.2 Å²	81.2	33%	0.325	39%	0.394	S	S	.	.	H	α-helix	trans	-67.3	-44.3	176.3	-163	66.1	0	0	0	111.4	F694 L695 R696 R701 F702	F694-L698 HydrophobicContact CE1-CD2 4.09Å; F694-L698 HydrophobicContact CZ-CD2 4.32Å; F694-L698 VanDerWaalsContact O-CB 3.25Å; F694-L698 WeakPolarHBondContact O-CB 3.34Å; F694-L698 PolarHBondContact O-N 3.01Å; L695-L698 PolarHBondContact O-N 3.29Å; R696-L698 VanDerWaalsContact C-N 3.3Å; R696-L698 PolarHBondContact O-N 3.24Å; L698-R701 PolarHBondContact O-N 2.95Å; L698-F702 HydrophobicContact CD1-CD2 3.87Å; L698-F702 HydrophobicContact CD1-CE2 3.34Å; L698-F702 HydrophobicContact CD1-CZ 4.33Å; L698-F702 HydrophobicContact CD2-CD2 4.46Å; L698-F702 HydrophobicContact CD2-CE2 4.05Å; L698-F702 HydrophobicContact CG-CD2 3.63Å; L698-F702 HydrophobicContact CG-CE2 3.48Å; L698-F702 VanDerWaalsContact CG-CE2 3.48Å; L698-F702 VanDerWaalsContact O-CD2 3.29Å; L698-F702 WeakPolarHBondContact O-CD2 3.32Å; L698-F702 PolarHBondContact O-N 3.41Å
699	W	78.8	Confident	75	Confident	148 Å²	148	88.5 Å²	88.5	56%	0.561	42%	0.419	S	S	*	.	H	α-helix	trans	-60.9	-47.5	177.3	-170.2	-80.7	0	0	0	111.5	L695 R696 R701 F702 C703	L695-W699 WeakPolarHBondContact O-CB 3.16Å; L695-W699 PolarHBondContact O-N 3.4Å; R696-W699 PolarHBondContact O-N 3.42Å; W699-R701 VanDerWaalsContact C-N 3.3Å; W699-R701 PolarHBondContact O-N 2.85Å; W699-F702 PolarHBondContact O-N 2.75Å; W699-C703 VanDerWaalsContact CE2-SG 3.57Å; W699-C703 VanDerWaalsContact O-CB 3.23Å; W699-C703 WeakPolarHBondContact O-CB 3.39Å; W699-C703 PolarHBondContact O-N 3.03Å
700	V	75	Confident	74	Confident	0 Å²	0	94 Å²	94	0%	0	45%	0.448	C	S	.	.	H	α-helix	trans	-59	-44.3	176.2	175.2	0	0	0	0	110.3	R696 T704 P716 Y718	R696-V700 VanDerWaalsContact O-CG2 3.28Å; R696-V700 WeakPolarHBondContact O-CG2 3.31Å; R696-V700 PolarHBondContact O-N 3.32Å; V700-T704 VanDerWaalsContact O-CB 3.22Å; V700-T704 WeakPolarHBondContact O-CB 3.34Å; V700-T704 PolarHBondContact O-N 3.34Å; V700-T704 VanDerWaalsContact O-N 3.17Å; V700-T704 PolarHBondContact O-OG1 3.02Å; V700-P716 HydrophobicContact CG2-CG 4.27Å; V700-P716 WeakPolarHBondContact CG2-O 3.45Å; V700-Y718 HydrophobicContact CB-CE1 4.24Å; V700-Y718 HydrophobicContact CG1-CD1 4.3Å; V700-Y718 HydrophobicContact CG1-CD2 4.2Å; V700-Y718 HydrophobicContact CG1-CE1 3.82Å; V700-Y718 HydrophobicContact CG1-CE2 3.75Å; V700-Y718 HydrophobicContact CG1-CG 4.47Å
701	R	75.3	Confident	73.2	Confident	160 Å²	160	91.1 Å²	91.1	60%	0.604	43%	0.433	S	S	*	.	H	α-helix	trans	-66.9	-44.8	179.9	-74.2	-177.9	-179.8	170.1	7.2	113.7	G697 L698 W699 T768	G697-R701 WeakPolarHBondContact O-CG 3.39Å; G697-R701 PolarHBondContact O-N 2.99Å; G697-R701 VanDerWaalsContact O-N 3.16Å; L698-R701 PolarHBondContact O-N 2.95Å; W699-R701 VanDerWaalsContact C-N 3.3Å; W699-R701 PolarHBondContact O-N 2.85Å; R701-T768 PolarHBondContact NH2-O 2.94Å
702	F	78.3	Confident	72.4	Confident	140 Å²	140	92.9 Å²	92.9	61%	0.614	44%	0.436	S	S	*	.	H	α-helix	trans	-74.2	-47.6	-179.2	-79	-66.1	0	0	0	112.5	L698 W699 T704 S705	L698-F702 HydrophobicContact CD1-CD2 3.87Å; L698-F702 HydrophobicContact CD1-CE2 3.34Å; L698-F702 HydrophobicContact CD1-CZ 4.33Å; L698-F702 HydrophobicContact CD2-CD2 4.46Å; L698-F702 HydrophobicContact CD2-CE2 4.05Å; L698-F702 HydrophobicContact CG-CD2 3.63Å; L698-F702 HydrophobicContact CG-CE2 3.48Å; L698-F702 VanDerWaalsContact CG-CE2 3.48Å; L698-F702 VanDerWaalsContact O-CD2 3.29Å; L698-F702 WeakPolarHBondContact O-CD2 3.32Å; L698-F702 PolarHBondContact O-N 3.41Å; W699-F702 PolarHBondContact O-N 2.75Å; F702-T704 VanDerWaalsContact C-N 3.33Å; F702-T704 PolarHBondContact O-N 2.84Å; F702-S705 PolarHBondContact O-N 3.01Å
703	C	74.3	Confident	71.7	Confident	20 Å²	20	95.1 Å²	95.1	14%	0.135	45%	0.45	C	S	.	.	H	α-helix	trans	-73.5	-22.9	-174.8	-65.1	0	0	0	0	113.1	W699 S705 W706 W707 L711	W699-C703 VanDerWaalsContact CE2-SG 3.57Å; W699-C703 VanDerWaalsContact O-CB 3.23Å; W699-C703 WeakPolarHBondContact O-CB 3.39Å; W699-C703 PolarHBondContact O-N 3.03Å; C703-S705 PolarHBondContact O-N 3.33Å; C703-W706 PolarHBondContact O-N 2.59Å; C703-W706 VanDerWaalsContact O-N 3.09Å; C703-W707 WeakPolarHBondContact O-CB 3.35Å; C703-W707 PolarHBondContact O-N 3.46Å; C703-L711 HydrophobicContact CB-CD2 4Å
704	T	69.5	Low	70.8	Confident	65 Å²	65	97.7 Å²	97.7	40%	0.399	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.6	173.3	-63.7	0	0	0	0	111.8	V700 F702 W706	V700-T704 VanDerWaalsContact O-CB 3.22Å; V700-T704 WeakPolarHBondContact O-CB 3.34Å; V700-T704 PolarHBondContact O-N 3.34Å; V700-T704 VanDerWaalsContact O-N 3.17Å; V700-T704 PolarHBondContact O-OG1 3.02Å; F702-T704 VanDerWaalsContact C-N 3.33Å; F702-T704 PolarHBondContact O-N 2.84Å; T704-W706 VanDerWaalsContact C-N 3.35Å
705	S	68.7	Low	69.7	Low	101 Å²	101	101.5 Å²	101.5	71%	0.706	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-21.7	178.6	-170.6	0	0	0	0	113.3	F702 C703	F702-S705 PolarHBondContact O-N 3.01Å; C703-S705 PolarHBondContact O-N 3.33Å
706	W	68.4	Low	68.6	Low	235 Å²	235	98.5 Å²	98.5	89%	0.89	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-18.5	-171.8	-76.2	42.6	0	0	0	113.8	C703 T704	C703-W706 PolarHBondContact O-N 2.59Å; C703-W706 VanDerWaalsContact O-N 3.09Å; T704-W706 VanDerWaalsContact C-N 3.35Å
707	W	65.3	Low	68.1	Low	154 Å²	154	99.1 Å²	99.1	58%	0.583	47%	0.474	S	S	*	.			trans	-114.9	132.7	-173.8	-128.6	-57.6	0	0	0	112	C703 W709	C703-W707 WeakPolarHBondContact O-CB 3.35Å; C703-W707 PolarHBondContact O-N 3.46Å; W707-W709 PolarHBondContact O-N 3.13Å
708	C	64.1	Low	67.8	Low	132 Å²	132	101 Å²	101	89%	0.892	48%	0.48	S	S	*	.	S	Bend	trans	-69.5	2.6	178	-57	0	0	0	0	114.9
709	W	60.7	Low	67.4	Low	174 Å²	174	98.1 Å²	98.1	66%	0.659	47%	0.465	S	S	*	.	S	Bend	trans	-94.3	131.4	177.7	-77.1	15.2	0	0	0	109.4	W707 L711	W707-W709 PolarHBondContact O-N 3.13Å; W709-L711 HydrophobicContact CB-CD1 3.85Å; W709-L711 WeakPolarHBondContact O-CD1 3.28Å; W709-L711 PolarHBondContact O-N 3.47Å
710	N	63.5	Low	67.2	Low	118 Å²	118	94.6 Å²	94.6	63%	0.631	46%	0.455	S	S	*	.			trans	-70.1	77.8	173.2	-69.2	-37.7	0	0	0	110	E712 T713 V714	N710-E712 PolarHBondContact O-N 3.07Å; N710-E712 VanDerWaalsContact O-N 3.11Å; N710-T713 PolarHBondContact O-N 3.01Å; N710-T713 PolarHBondContact O-OG1 3.29Å; N710-T713 VanDerWaalsContact O-OG1 3.06Å; N710-V714 PolarHBondContact O-N 3.43Å
711	L	66.2	Low	67.5	Low	13 Å²	13	95.1 Å²	95.1	7%	0.068	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.3	175.1	-97.4	73.6	0	0	0	112.6	C703 W709 T713 V714 P716	C703-L711 HydrophobicContact CB-CD2 4Å; W709-L711 HydrophobicContact CB-CD1 3.85Å; W709-L711 WeakPolarHBondContact O-CD1 3.28Å; W709-L711 PolarHBondContact O-N 3.47Å; L711-T713 PolarHBondContact O-N 3.37Å; L711-V714 CarbonylContact C-O 3.49Å; L711-V714 WeakPolarHBondContact CA-O 3.42Å; L711-P716 HydrophobicContact CD2-CG 4.35Å
712	E	62.8	Low	67.5	Low	117 Å²	117	89.6 Å²	89.6	55%	0.547	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.1	171.6	-176.5	161.8	-146.9	0	0	112.8	N710 Y718	N710-E712 PolarHBondContact O-N 3.07Å; N710-E712 VanDerWaalsContact O-N 3.11Å; E712-Y718 HydrophobicContact CB-CE2 4.41Å; E712-Y718 HydrophobicContact CG-CD2 4.21Å; E712-Y718 HydrophobicContact CG-CE2 3.91Å
713	T	60.5	Low	67.6	Low	101 Å²	101	83.6 Å²	83.6	62%	0.62	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-16.3	-177.8	61.7	0	0	0	0	114	N710 L711	N710-T713 PolarHBondContact O-N 3.01Å; N710-T713 PolarHBondContact O-OG1 3.29Å; N710-T713 VanDerWaalsContact O-OG1 3.06Å; L711-T713 PolarHBondContact O-N 3.37Å
714	V	59.3	Low	67.8	Low	73 Å²	73	83.5 Å²	83.5	44%	0.442	41%	0.414	S	S	.	.	S	Bend	trans	-122.4	141.2	-176.7	-178.6	0	0	0	0	109	N710 L711	N710-V714 PolarHBondContact O-N 3.43Å; L711-V714 CarbonylContact C-O 3.49Å; L711-V714 WeakPolarHBondContact CA-O 3.42Å
715	F	58.2	Low	68.2	Low	155 Å²	155	81.1 Å²	81.1	68%	0.68	40%	0.398	S	S	*	.	S	Bend	trans	-42.6	124.5	-174.3	-173.3	-91.8	0	0	0	112.4	M407	M407-F715 HydrophobicContact CE-CD2 4.22Å; M407-F715 HydrophobicContact CE-CE2 3.61Å; M407-F715 HydrophobicContact SD-CD2 4.46Å; M407-F715 HydrophobicContact SD-CE2 4.11Å
716	P	58.4	Low	68.9	Low	25 Å²	25	76.9 Å²	76.9	16%	0.162	37%	0.368	C	S	.	.	S	Bend	cis	-96.4	91.5	14.4	36	-30.2	0	0	0	113	R696 V700 L711	R696-P716 HydrophobicContact CG-CB 4.21Å; V700-P716 HydrophobicContact CG2-CG 4.27Å; V700-P716 WeakPolarHBondContact CG2-O 3.45Å; L711-P716 HydrophobicContact CD2-CG 4.35Å
717	E	66.2	Low	69.8	Low	83 Å²	83	65.7 Å²	65.7	39%	0.388	33%	0.325	S	S	.	.			trans	-44.2	149.3	169.8	-175.6	-179.1	-171.4	0	0	112.1	K410	K410-E717 IonicContact NZ-OE2 2.67Å
718	Y	70.1	Confident	70.6	Confident	44 Å²	44	58.9 Å²	58.9	17%	0.173	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-51.4	148.2	173.5	-77.7	-76.1	0	0	0	111.9	V700 E712 E720 I771	V700-Y718 HydrophobicContact CB-CE1 4.24Å; V700-Y718 HydrophobicContact CG1-CD1 4.3Å; V700-Y718 HydrophobicContact CG1-CD2 4.2Å; V700-Y718 HydrophobicContact CG1-CE1 3.82Å; V700-Y718 HydrophobicContact CG1-CE2 3.75Å; V700-Y718 HydrophobicContact CG1-CG 4.47Å; E712-Y718 HydrophobicContact CB-CE2 4.41Å; E712-Y718 HydrophobicContact CG-CD2 4.21Å; E712-Y718 HydrophobicContact CG-CE2 3.91Å; Y718-E720 PolarHBondContact O-N 3.13Å; Y718-I771 HydrophobicContact CD1-CD1 4.15Å; Y718-I771 HydrophobicContact CD1-CG1 4.47Å; Y718-I771 HydrophobicContact CD2-CD1 3.34Å; Y718-I771 HydrophobicContact CD2-CG1 4.44Å; Y718-I771 HydrophobicContact CE2-CD1 4.1Å; Y718-I771 HydrophobicContact CG-CD1 3.36Å; Y718-I771 HydrophobicContact CG-CG1 4Å
719	G	71.3	Confident	71.5	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	119.6	178.4	0	0	0	0	0	113.3	N770 I771	G719-N770 CarbonylContact O-C 3.59Å; G719-N770 WeakPolarHBondContact O-CA 3.25Å; G719-N770 WeakPolarHBondContact O-CB 3.16Å; G719-N770 PolarHBondContact O-OD1 2.83Å; G719-I771 PolarHBondContact O-N 2.83Å
720	E	74.7	Confident	72.8	Confident	75 Å²	75	45.4 Å²	45.4	35%	0.35	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133.3	163.3	-66	-161.3	144.4	0	0	110.2	Y718 K722 A774	Y718-E720 PolarHBondContact O-N 3.13Å; E720-K722 PolarHBondContact O-N 3.42Å; E720-A774 PolarHBondContact OE1-N 3.39Å
721	F	81.3	Confident	74	Confident	11 Å²	11	39.9 Å²	39.9	5%	0.048	20%	0.202	C	C	.	.			trans	-74.6	92.9	173.3	-175.1	-102.9	0	0	0	111.3	V127 Y130 F131 V723 N726 V766 N770	V127-F721 HydrophobicContact CB-CD1 4.3Å; V127-F721 HydrophobicContact CG1-CD1 3.65Å; V127-F721 HydrophobicContact CG1-CE1 3.85Å; V127-F721 HydrophobicContact CG1-CG 4.44Å; V127-F721 HydrophobicContact CG2-CD1 4.07Å; Y130-F721 HydrophobicContact CD1-CE1 4.19Å; Y130-F721 AromaticContact CD1-CZ 3.64Å; Y130-F721 HydrophobicContact CD1-CZ 3.64Å; Y130-F721 HydrophobicContact CE1-CZ 4.01Å; Y130-F721 HydrophobicContact CG-CE1 4.24Å; Y130-F721 AromaticContact CG-CZ 3.99Å; Y130-F721 HydrophobicContact CG-CZ 3.99Å; F131-F721 HydrophobicContact CE2-CZ 4.46Å; F721-V723 HydrophobicContact CD1-CG2 3.85Å; F721-V723 HydrophobicContact CE1-CG2 3.9Å; F721-V723 PolarHBondContact O-N 3.16Å; F721-N726 WeakPolarHBondContact CE2-ND2 3.3Å; F721-N726 HydrophobicContact CZ-CB 4.48Å; F721-N726 WeakPolarHBondContact CZ-ND2 3.38Å; F721-V766 HydrophobicContact CB-CG2 4.31Å; F721-V766 HydrophobicContact CD1-CG2 4.3Å; F721-V766 HydrophobicContact CD2-CG2 3.18Å; F721-V766 HydrophobicContact CE1-CG2 4.44Å; F721-V766 HydrophobicContact CE2-CG2 3.34Å; F721-V766 HydrophobicContact CG-CG2 3.68Å; F721-V766 HydrophobicContact CZ-CG2 4Å; F721-N770 HydrophobicContact CB-CB 4.26Å
722	K	76.8	Confident	74.8	Confident	43 Å²	43	39.9 Å²	39.9	19%	0.187	20%	0.202	C	C	.	.			trans	-77.5	93.1	177.6	-62.2	-179.4	-167.2	159.5	0	112	E406 E720 A724 E725 N726	E406-K722 WeakPolarHBondContact OE1-CE 3.48Å; E406-K722 IonicContact OE1-NZ 3.24Å; E406-K722 PolarHBondContact OE1-NZ 2.91Å; E406-K722 VanDerWaalsContact OE2-CE 3.24Å; E406-K722 WeakPolarHBondContact OE2-CE 3.44Å; E406-K722 IonicContact OE2-NZ 3.38Å; E406-K722 PolarHBondContact OE2-NZ 3.26Å; E720-K722 PolarHBondContact O-N 3.42Å; K722-A724 VanDerWaalsContact C-N 3.26Å; K722-A724 PolarHBondContact O-N 3.31Å; K722-E725 HydrophobicContact CB-CB 4.32Å; K722-E725 HydrophobicContact CB-CG 4.23Å; K722-E725 HydrophobicContact CD-CG 4.13Å; K722-E725 VanDerWaalsContact CD-OE1 3.25Å; K722-E725 WeakPolarHBondContact CD-OE1 3.12Å; K722-E725 WeakPolarHBondContact CD-OE2 3.48Å; K722-E725 IonicContact NZ-OE1 2.78Å; K722-E725 PolarHBondContact NZ-OE1 3.36Å; K722-E725 IonicContact NZ-OE2 3.48Å; K722-E725 PolarHBondContact NZ-OE2 3.19Å; K722-E725 VanDerWaalsContact NZ-OE2 3.15Å; K722-E725 PolarHBondContact O-N 3.36Å; K722-N726 PolarHBondContact O-N 3.31Å; K722-N726 PolarHBondContact O-ND2 3.08Å
723	V	80.5	Confident	75.8	Confident	14 Å²	14	34.5 Å²	34.5	9%	0.085	18%	0.177	C	C	.	.	H	α-helix	trans	-48.6	-46.2	177.5	177.6	0	0	0	0	112.2	V126 F721 V727 Y805	V126-V723 HydrophobicContact CG1-CG2 4.2Å; F721-V723 HydrophobicContact CD1-CG2 3.85Å; F721-V723 HydrophobicContact CE1-CG2 3.9Å; F721-V723 PolarHBondContact O-N 3.16Å; V723-V727 HydrophobicContact CG1-CG2 4.3Å; V723-V727 WeakPolarHBondContact O-CB 3.27Å; V723-V727 VanDerWaalsContact O-CG2 3.24Å; V723-V727 WeakPolarHBondContact O-CG2 3.41Å; V723-V727 PolarHBondContact O-N 3.3Å; V723-Y805 WeakPolarHBondContact CG1-OH 3.32Å
724	A	77.7	Confident	77.3	Confident	19 Å²	19	29.9 Å²	29.9	16%	0.157	15%	0.148	C	C	.	.	H	α-helix	trans	-72.9	-34.8	-170.1	0	0	0	0	0	113.8	L424 K722 L728	L424-A724 HydrophobicContact CD1-CB 3.84Å; L424-A724 HydrophobicContact CD2-CB 3.42Å; L424-A724 VanDerWaalsContact CD2-CB 3.42Å; L424-A724 HydrophobicContact CG-CB 4.23Å; K722-A724 VanDerWaalsContact C-N 3.26Å; K722-A724 PolarHBondContact O-N 3.31Å; A724-L728 WeakPolarHBondContact O-CB 3.3Å; A724-L728 PolarHBondContact O-N 3.48Å; A724-L728 VanDerWaalsContact O-N 3.14Å
725	E	78.2	Confident	78.6	Confident	14 Å²	14	26.4 Å²	26.4	7%	0.065	13%	0.127	C	C	.	.	H	α-helix	trans	-68.3	-48.2	174.5	-63	-177	-178.4	0	0	110.2	Q423 I427 K722 V727 L728 H729	Q423-E725 PolarHBondContact NE2-OE1 3.4Å; I427-E725 HydrophobicContact CD1-CG 3.86Å; K722-E725 HydrophobicContact CB-CB 4.32Å; K722-E725 HydrophobicContact CB-CG 4.23Å; K722-E725 HydrophobicContact CD-CG 4.13Å; K722-E725 VanDerWaalsContact CD-OE1 3.25Å; K722-E725 WeakPolarHBondContact CD-OE1 3.12Å; K722-E725 WeakPolarHBondContact CD-OE2 3.48Å; K722-E725 IonicContact NZ-OE1 2.78Å; K722-E725 PolarHBondContact NZ-OE1 3.36Å; K722-E725 IonicContact NZ-OE2 3.48Å; K722-E725 PolarHBondContact NZ-OE2 3.19Å; K722-E725 VanDerWaalsContact NZ-OE2 3.15Å; K722-E725 PolarHBondContact O-N 3.36Å; E725-V727 VanDerWaalsContact C-N 3.34Å; E725-V727 PolarHBondContact O-N 3.18Å; E725-L728 WeakPolarHBondContact O-CA 3.4Å; E725-L728 WeakPolarHBondContact O-CB 3.34Å; E725-L728 PolarHBondContact O-N 3.14Å; E725-H729 PolarHBondContact O-CD2 3.34Å; E725-H729 PolarHBondContact O-N 3.34Å
726	N	83.4	Confident	79.6	Confident	13 Å²	13	19.6 Å²	19.6	7%	0.07	10%	0.098	C	C	.	.	H	α-helix	trans	-61.4	-39.2	177.5	-70.4	-28.5	0	0	0	112.6	Y130 F721 K722 L728 H729 V730 R762	Y130-N726 HydrophobicContact CD2-CB 4.1Å; Y130-N726 HydrophobicContact CE2-CB 3.7Å; F721-N726 WeakPolarHBondContact CE2-ND2 3.3Å; F721-N726 HydrophobicContact CZ-CB 4.48Å; F721-N726 WeakPolarHBondContact CZ-ND2 3.38Å; K722-N726 PolarHBondContact O-N 3.31Å; K722-N726 PolarHBondContact O-ND2 3.08Å; N726-L728 VanDerWaalsContact C-N 3.3Å; N726-L728 PolarHBondContact O-N 3.19Å; N726-H729 PolarHBondContact O-N 2.95Å; N726-V730 WeakPolarHBondContact O-CG2 3.41Å; N726-V730 PolarHBondContact O-N 3.41Å; N726-V730 VanDerWaalsContact O-N 3.16Å; N726-R762 VanDerWaalsContact OD1-CZ 3.24Å; N726-R762 PolarHBondContact OD1-NH1 3.25Å; N726-R762 VanDerWaalsContact OD1-NH1 3.17Å; N726-R762 PolarHBondContact OD1-NH2 3.49Å
727	V	86.4	Confident	81.1	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.5	-40.9	172.8	169.6	0	0	0	0	110.9	Y130 F133 V723 E725 V730 I731 Y805	Y130-V727 HydrophobicContact CD2-CG2 3.73Å; F133-V727 HydrophobicContact CD1-CG1 4.1Å; F133-V727 HydrophobicContact CD1-CG2 4.37Å; F133-V727 HydrophobicContact CE1-CG1 3.77Å; F133-V727 HydrophobicContact CZ-CG1 4.21Å; V723-V727 HydrophobicContact CG1-CG2 4.3Å; V723-V727 WeakPolarHBondContact O-CB 3.27Å; V723-V727 VanDerWaalsContact O-CG2 3.24Å; V723-V727 WeakPolarHBondContact O-CG2 3.41Å; V723-V727 PolarHBondContact O-N 3.3Å; E725-V727 VanDerWaalsContact C-N 3.34Å; E725-V727 PolarHBondContact O-N 3.18Å; V727-V730 PolarHBondContact O-N 2.87Å; V727-I731 HydrophobicContact CG1-CD1 3.58Å; V727-I731 HydrophobicContact CG1-CG1 4.17Å; V727-I731 VanDerWaalsContact O-CG1 3.3Å; V727-I731 WeakPolarHBondContact O-CG1 3.27Å; V727-I731 PolarHBondContact O-N 2.96Å; V727-Y805 HydrophobicContact CB-CD1 4.22Å; V727-Y805 HydrophobicContact CB-CE1 4.13Å; V727-Y805 HydrophobicContact CG1-CD1 3.5Å; V727-Y805 VanDerWaalsContact CG1-CD1 3.5Å; V727-Y805 HydrophobicContact CG1-CE1 3.94Å; V727-Y805 HydrophobicContact CG1-CG 3.86Å; V727-Y805 HydrophobicContact CG2-CD1 4.35Å; V727-Y805 HydrophobicContact CG2-CE1 4.07Å; V727-Y805 HydrophobicContact CG2-CE2 4.32Å
728	L	83.2	Confident	82.1	Confident	10 Å²	10	14.9 Å²	14.9	5%	0.052	7%	0.073	C	C	.	.	H	α-helix	trans	-67.4	-37	-178	-173.9	64.1	0	0	0	111.7	I427 L428 Y431 A724 E725 N726 I731 N732 L808	I427-L728 HydrophobicContact CB-CD2 3.76Å; I427-L728 HydrophobicContact CG2-CD2 3.35Å; L428-L728 HydrophobicContact CD1-CD1 3.95Å; Y431-L728 HydrophobicContact CD2-CD1 4.08Å; Y431-L728 HydrophobicContact CD2-CD2 3.78Å; Y431-L728 HydrophobicContact CD2-CG 3.46Å; Y431-L728 VanDerWaalsContact CD2-CG 3.46Å; Y431-L728 HydrophobicContact CE2-CB 4.12Å; Y431-L728 HydrophobicContact CE2-CD2 3.7Å; Y431-L728 HydrophobicContact CE2-CG 3.44Å; Y431-L728 VanDerWaalsContact CE2-CG 3.44Å; A724-L728 WeakPolarHBondContact O-CB 3.3Å; A724-L728 PolarHBondContact O-N 3.48Å; A724-L728 VanDerWaalsContact O-N 3.14Å; E725-L728 WeakPolarHBondContact O-CA 3.4Å; E725-L728 WeakPolarHBondContact O-CB 3.34Å; E725-L728 PolarHBondContact O-N 3.14Å; N726-L728 VanDerWaalsContact C-N 3.3Å; N726-L728 PolarHBondContact O-N 3.19Å; L728-I731 PolarHBondContact O-N 2.94Å; L728-N732 WeakPolarHBondContact O-CB 3.09Å; L728-N732 PolarHBondContact O-N 2.79Å; L728-L808 HydrophobicContact CD1-CD1 4.33Å; L728-L808 HydrophobicContact CD1-CD2 3.57Å; L728-L808 HydrophobicContact CD1-CG 4.4Å
729	H	82.4	Confident	82.6	Confident	20 Å²	20	14.1 Å²	14.1	9%	0.093	7%	0.072	C	C	.	.	H	α-helix	trans	-59.7	-46.1	169.5	-73.7	-82.3	0	0	0	112.3	T398 Y431 E725 N726 I731 N732 N733	T398-H729 PolarHBondContact O-CE1 3.04Å; Y431-H729 AromaticContact CZ-CE1 4Å; Y431-H729 PolarHBondContact OH-CE1 2.79Å; Y431-H729 PolarHBondContact OH-ND1 3.04Å; Y431-H729 PolarHBondContact OH-NE2 3.15Å; Y431-H729 VanDerWaalsContact OH-NE2 3.09Å; E725-H729 PolarHBondContact O-CD2 3.34Å; E725-H729 PolarHBondContact O-N 3.34Å; N726-H729 PolarHBondContact O-N 2.95Å; H729-I731 VanDerWaalsContact C-N 3.29Å; H729-I731 PolarHBondContact O-N 2.88Å; H729-N732 PolarHBondContact O-N 2.84Å; H729-N733 WeakPolarHBondContact O-CB 3.49Å; H729-N733 PolarHBondContact O-N 3.29Å
730	V	88	Confident	83	Confident	4 Å²	4	14 Å²	14	2%	0.024	7%	0.071	C	C	.	.	H	α-helix	trans	-62.5	-37.9	177.6	174.5	0	0	0	0	111.2	Y130 F133 I137 N726 V727 Q734 L758	Y130-V730 HydrophobicContact CE2-CG2 3.88Å; F133-V730 HydrophobicContact CE1-CG1 4.22Å; I137-V730 HydrophobicContact CD1-CG1 3.67Å; N726-V730 WeakPolarHBondContact O-CG2 3.41Å; N726-V730 PolarHBondContact O-N 3.41Å; N726-V730 VanDerWaalsContact O-N 3.16Å; V727-V730 PolarHBondContact O-N 2.87Å; V730-Q734 PolarHBondContact O-N 3.01Å; V730-L758 HydrophobicContact CG2-CD2 4.31Å
731	I	88.3	Confident	83.5	Confident	1 Å²	1	10.5 Å²	10.5	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-69.6	-41.8	177.2	-68.2	170.1	0	0	0	111.4	F133 V727 L728 H729 N733 Q734 G735 L808 L809 I812	F133-I731 HydrophobicContact CE1-CD1 4.35Å; F133-I731 HydrophobicContact CE1-CG1 3.95Å; F133-I731 HydrophobicContact CZ-CD1 3.94Å; F133-I731 HydrophobicContact CZ-CG1 3.76Å; V727-I731 HydrophobicContact CG1-CD1 3.58Å; V727-I731 HydrophobicContact CG1-CG1 4.17Å; V727-I731 VanDerWaalsContact O-CG1 3.3Å; V727-I731 WeakPolarHBondContact O-CG1 3.27Å; V727-I731 PolarHBondContact O-N 2.96Å; L728-I731 PolarHBondContact O-N 2.94Å; H729-I731 VanDerWaalsContact C-N 3.29Å; H729-I731 PolarHBondContact O-N 2.88Å; I731-N733 VanDerWaalsContact C-N 3.32Å; I731-N733 PolarHBondContact O-N 3.24Å; I731-Q734 WeakPolarHBondContact O-CB 3.47Å; I731-Q734 PolarHBondContact O-N 2.85Å; I731-Q734 VanDerWaalsContact O-N 3.14Å; I731-G735 PolarHBondContact O-N 2.73Å; I731-L808 HydrophobicContact CD1-CB 4.16Å; I731-L808 HydrophobicContact CD1-CD2 3.48Å; I731-L808 VanDerWaalsContact CD1-CD2 3.48Å; I731-L808 HydrophobicContact CD1-CG 3.67Å; I731-L808 HydrophobicContact CG2-CG 4.19Å; I731-L809 HydrophobicContact CG1-CD1 4.33Å; I731-L809 HydrophobicContact CG2-CD1 4.14Å; I731-I812 HydrophobicContact CG2-CB 4.35Å; I731-I812 HydrophobicContact CG2-CD1 4.46Å; I731-I812 HydrophobicContact CG2-CG2 3.61Å
732	N	82.5	Confident	83.6	Confident	13 Å²	13	10.4 Å²	10.4	7%	0.07	5%	0.054	C	C	.	.	H	α-helix	trans	-60.1	-44.7	175.5	-170.2	52.5	0	0	0	111.1	Y431 L728 H729 Q734 G735 M736	Y431-N732 HydrophobicContact CD2-CB 3.95Å; Y431-N732 HydrophobicContact CE2-CB 4.46Å; L728-N732 WeakPolarHBondContact O-CB 3.09Å; L728-N732 PolarHBondContact O-N 2.79Å; H729-N732 PolarHBondContact O-N 2.84Å; N732-Q734 VanDerWaalsContact C-N 3.32Å; N732-Q734 PolarHBondContact O-N 2.62Å; N732-G735 PolarHBondContact O-N 3.5Å; N732-G735 VanDerWaalsContact O-N 3.12Å; N732-M736 PolarHBondContact O-N 3.37Å
733	N	85.4	Confident	83.6	Confident	4 Å²	4	9.5 Å²	9.5	2%	0.021	5%	0.051	C	C	.	.	H	α-helix	trans	-58.6	-41.9	172.8	-179.6	58.3	0	0	0	112.4	H729 I731 G735 M736 I737 N751 K754	H729-N733 WeakPolarHBondContact O-CB 3.49Å; H729-N733 PolarHBondContact O-N 3.29Å; I731-N733 VanDerWaalsContact C-N 3.32Å; I731-N733 PolarHBondContact O-N 3.24Å; N733-G735 VanDerWaalsContact C-N 3.32Å; N733-G735 PolarHBondContact O-N 3.25Å; N733-M736 HydrophobicContact CB-CE 4.29Å; N733-M736 PolarHBondContact O-N 2.78Å; N733-I737 VanDerWaalsContact O-CD1 3.23Å; N733-I737 WeakPolarHBondContact O-CD1 3.31Å; N733-I737 WeakPolarHBondContact O-CG1 3.25Å; N733-I737 PolarHBondContact O-N 3.5Å; N733-N751 PolarHBondContact ND2-OD1 2.75Å; N733-K754 WeakPolarHBondContact OD1-CE 3.27Å; N733-K754 PolarHBondContact OD1-NZ 2.85Å
734	Q	90.2	Very high	83.7	Confident	4 Å²	4	9 Å²	9	2%	0.019	5%	0.047	C	C	.	.	H	α-helix	trans	-61.3	-39.5	174.6	-168.9	61.1	40.5	0	0	112.8	I137 N141 V730 I731 N732 I737 W738 L809	I137-Q734 VanDerWaalsContact CG2-OE1 3.27Å; N141-Q734 PolarHBondContact ND2-OE1 2.94Å; N141-Q734 PolarHBondContact OD1-NE2 3.24Å; N141-Q734 PolarHBondContact OD1-OE1 2.83Å; V730-Q734 PolarHBondContact O-N 3.01Å; I731-Q734 WeakPolarHBondContact O-CB 3.47Å; I731-Q734 PolarHBondContact O-N 2.85Å; I731-Q734 VanDerWaalsContact O-N 3.14Å; N732-Q734 VanDerWaalsContact C-N 3.32Å; N732-Q734 PolarHBondContact O-N 2.62Å; Q734-I737 PolarHBondContact O-N 3.07Å; Q734-W738 HydrophobicContact CG-CD2 4.24Å; Q734-W738 HydrophobicContact CG-CE3 4.36Å; Q734-W738 HydrophobicContact CG-CH2 3.92Å; Q734-W738 HydrophobicContact CG-CZ2 3.75Å; Q734-W738 HydrophobicContact CG-CZ3 4.2Å; Q734-W738 VanDerWaalsContact NE2-NE1 3.16Å; Q734-W738 PolarHBondContact O-N 2.77Å; Q734-L809 HydrophobicContact CB-CD1 4.05Å; Q734-L809 HydrophobicContact CG-CD1 3.85Å
735	G	86.5	Confident	84.1	Confident	0 Å²	0	8 Å²	8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-60.7	-43.7	174.9	0	0	0	0	0	112.9	I731 N732 N733 I737 W738 L739 C816	I731-G735 PolarHBondContact O-N 2.73Å; N732-G735 PolarHBondContact O-N 3.5Å; N732-G735 VanDerWaalsContact O-N 3.12Å; N733-G735 VanDerWaalsContact C-N 3.32Å; N733-G735 PolarHBondContact O-N 3.25Å; G735-I737 VanDerWaalsContact C-N 3.31Å; G735-I737 PolarHBondContact O-N 3.07Å; G735-W738 PolarHBondContact O-N 3.22Å; G735-L739 PolarHBondContact O-N 3.5Å; G735-L739 VanDerWaalsContact O-N 3.09Å; G735-C816 VanDerWaalsContact C-SG 3.58Å; G735-C816 WeakPolarHBondContact CA-SG 3.23Å; G735-C816 PolarHBondContact O-SG 3.28Å
736	M	81.1	Confident	84.5	Confident	12 Å²	12	9.2 Å²	9.2	6%	0.059	5%	0.046	C	C	.	.	H	α-helix	trans	-61.3	-38.1	177.3	-68.1	-172.1	-72.4	0	0	112.5	F435 L677 N732 N733 L739 G740	F435-M736 HydrophobicContact CE2-CG 4.35Å; L677-M736 HydrophobicContact CD2-SD 3.76Å; L677-M736 HydrophobicContact CG-SD 4.14Å; N732-M736 PolarHBondContact O-N 3.37Å; N733-M736 HydrophobicContact CB-CE 4.29Å; N733-M736 PolarHBondContact O-N 2.78Å; M736-L739 PolarHBondContact O-N 3.25Å; M736-G740 PolarHBondContact O-N 3.15Å
737	I	88.2	Confident	84.7	Confident	1 Å²	1	8.6 Å²	8.6	1%	0.005	4%	0.043	C	C	.	.	H	α-helix	trans	-68.7	-40.4	179.6	-63.1	148.5	0	0	0	111.4	N733 Q734 G735 L739 G740 M741 P748 N751	N733-I737 VanDerWaalsContact O-CD1 3.23Å; N733-I737 WeakPolarHBondContact O-CD1 3.31Å; N733-I737 WeakPolarHBondContact O-CG1 3.25Å; N733-I737 PolarHBondContact O-N 3.5Å; Q734-I737 PolarHBondContact O-N 3.07Å; G735-I737 VanDerWaalsContact C-N 3.31Å; G735-I737 PolarHBondContact O-N 3.07Å; I737-L739 VanDerWaalsContact C-N 3.27Å; I737-L739 PolarHBondContact O-N 2.9Å; I737-G740 PolarHBondContact O-N 3.31Å; I737-M741 VanDerWaalsContact O-CB 3.28Å; I737-M741 WeakPolarHBondContact O-CB 3.49Å; I737-M741 WeakPolarHBondContact O-CG 3.49Å; I737-M741 PolarHBondContact O-N 3.12Å; I737-P748 HydrophobicContact CG2-CB 4.39Å; I737-P748 HydrophobicContact CG2-CG 4.02Å; I737-N751 HydrophobicContact CD1-CB 3.42Å; I737-N751 VanDerWaalsContact CD1-CB 3.42Å; I737-N751 WeakPolarHBondContact CD1-ND2 3.29Å; I737-N751 VanDerWaalsContact CD1-OD1 3.3Å; I737-N751 WeakPolarHBondContact CD1-OD1 3.29Å; I737-N751 HydrophobicContact CG1-CB 3.98Å
738	W	88.1	Confident	84.9	Confident	8 Å²	8	8.6 Å²	8.6	3%	0.03	4%	0.043	C	C	.	.	H	α-helix	trans	-66.7	-31.1	175.5	-68.8	-30.2	0	0	0	113.1	I241 Q734 G735 M741 L809 I812 M813 C816	I241-W738 HydrophobicContact CD1-CH2 3.61Å; I241-W738 HydrophobicContact CD1-CZ2 3.99Å; Q734-W738 HydrophobicContact CG-CD2 4.24Å; Q734-W738 HydrophobicContact CG-CE3 4.36Å; Q734-W738 HydrophobicContact CG-CH2 3.92Å; Q734-W738 HydrophobicContact CG-CZ2 3.75Å; Q734-W738 HydrophobicContact CG-CZ3 4.2Å; Q734-W738 VanDerWaalsContact NE2-NE1 3.16Å; Q734-W738 PolarHBondContact O-N 2.77Å; G735-W738 PolarHBondContact O-N 3.22Å; W738-M741 WeakPolarHBondContact O-CG 3.43Å; W738-L809 HydrophobicContact CH2-CD1 3.66Å; W738-L809 HydrophobicContact CH2-CG 3.85Å; W738-L809 HydrophobicContact CZ3-CD1 4.04Å; W738-L809 HydrophobicContact CZ3-CG 4.46Å; W738-I812 HydrophobicContact CZ3-CG2 4.01Å; W738-M813 HydrophobicContact CD2-CG 4.29Å; W738-M813 HydrophobicContact CE3-CB 3.81Å; W738-M813 HydrophobicContact CE3-CG 3.8Å; W738-M813 HydrophobicContact CH2-CB 3.86Å; W738-M813 HydrophobicContact CH2-CG 3.91Å; W738-M813 HydrophobicContact CZ2-CG 4.4Å; W738-M813 VanDerWaalsContact CZ3-CA 3.45Å; W738-M813 HydrophobicContact CZ3-CB 3.3Å; W738-M813 HydrophobicContact CZ3-CG 3.6Å; W738-C816 HydrophobicContact CB-CB 4.24Å
739	L	81.2	Confident	85.3	Confident	28 Å²	28	9.4 Å²	9.4	15%	0.147	5%	0.051	C	C	.	.	H	α-helix	trans	-68.9	-41.3	172.9	-175.6	141.7	0	0	0	111.7	F435 I439 I674 G735 M736 I737 P819	F435-L739 HydrophobicContact CE1-CD1 4.24Å; F435-L739 HydrophobicContact CE2-CB 4.48Å; F435-L739 HydrophobicContact CE2-CD1 3.98Å; F435-L739 HydrophobicContact CZ-CB 4.16Å; F435-L739 HydrophobicContact CZ-CD1 3.45Å; F435-L739 VanDerWaalsContact CZ-CD1 3.45Å; F435-L739 HydrophobicContact CZ-CG 4.44Å; I439-L739 HydrophobicContact CD1-CD1 3.65Å; I439-L739 HydrophobicContact CG1-CD1 3.56Å; I674-L739 HydrophobicContact CD1-CD2 3.87Å; G735-L739 PolarHBondContact O-N 3.5Å; G735-L739 VanDerWaalsContact O-N 3.09Å; M736-L739 PolarHBondContact O-N 3.25Å; I737-L739 VanDerWaalsContact C-N 3.27Å; I737-L739 PolarHBondContact O-N 2.9Å; L739-P819 HydrophobicContact CD1-CB 4.47Å
740	G	79.2	Confident	85.6	Confident	1 Å²	1	10.3 Å²	10.3	1%	0.01	6%	0.056	C	C	.	.	H	α-helix	trans	-83.5	-23.8	-177	0	0	0	0	0	115.5	M736 I737 F742 F743 C744	M736-G740 PolarHBondContact O-N 3.15Å; I737-G740 PolarHBondContact O-N 3.31Å; G740-F742 VanDerWaalsContact C-N 3.3Å; G740-F742 PolarHBondContact O-N 2.95Å; G740-F743 PolarHBondContact O-N 2.88Å; G740-C744 PolarHBondContact O-N 3.47Å
741	M	84.7	Confident	85.8	Confident	1 Å²	1	10.1 Å²	10.1	1%	0.005	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.3	-169.8	61.2	170.9	-70.2	0	0	115	N230 V233 L234 I737 W738 F743 C744 P748	N230-M741 PolarHBondContact OD1-O 3.2Å; V233-M741 HydrophobicContact CB-CE 3.85Å; V233-M741 HydrophobicContact CG1-CE 3.26Å; V233-M741 HydrophobicContact CG1-SD 4.14Å; L234-M741 HydrophobicContact CD2-SD 3.88Å; L234-M741 HydrophobicContact CG-SD 4.41Å; I737-M741 VanDerWaalsContact O-CB 3.28Å; I737-M741 WeakPolarHBondContact O-CB 3.49Å; I737-M741 WeakPolarHBondContact O-CG 3.49Å; I737-M741 PolarHBondContact O-N 3.12Å; W738-M741 WeakPolarHBondContact O-CG 3.43Å; M741-F743 PolarHBondContact O-N 2.65Å; M741-C744 WeakPolarHBondContact CA-O 3.32Å; M741-C744 CarbonylContact O-C 3.6Å; M741-P748 HydrophobicContact CB-CG 4.38Å
742	F	83	Confident	86	Confident	8 Å²	8	10.7 Å²	10.7	4%	0.035	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-29.4	177.2	177.5	-103.3	0	0	0	111.5	Y226 F227 N230 G740 V820 I824 F836 F842	Y226-F742 HydrophobicContact CE1-CE2 4.48Å; Y226-F742 WeakPolarHBondContact CE1-O 3.25Å; Y226-F742 VanDerWaalsContact CZ-O 3.28Å; Y226-F742 PolarHBondContact OH-O 3.32Å; F227-F742 HydrophobicContact CD2-CE2 4.41Å; N230-F742 HydrophobicContact CB-CD2 4.12Å; N230-F742 WeakPolarHBondContact OD1-CA 3.35Å; G740-F742 VanDerWaalsContact C-N 3.3Å; G740-F742 PolarHBondContact O-N 2.95Å; F742-V820 HydrophobicContact CB-CG1 3.87Å; F742-V820 HydrophobicContact CG-CG1 4.13Å; F742-I824 HydrophobicContact CD1-CD1 4.42Å; F742-I824 HydrophobicContact CD1-CG1 4.35Å; F742-I824 HydrophobicContact CD2-CD1 4.01Å; F742-I824 HydrophobicContact CE1-CD1 4.23Å; F742-I824 HydrophobicContact CE1-CG1 3.83Å; F742-I824 HydrophobicContact CE2-CD1 3.78Å; F742-I824 HydrophobicContact CE2-CG1 4.14Å; F742-I824 HydrophobicContact CG-CD1 4.32Å; F742-I824 HydrophobicContact CZ-CD1 3.9Å; F742-I824 HydrophobicContact CZ-CG1 3.72Å; F742-F836 HydrophobicContact CE2-CE2 4.4Å; F742-F836 AromaticContact CZ-CE2 3.88Å; F742-F836 HydrophobicContact CZ-CE2 3.88Å; F742-F842 AromaticContact CE1-CD1 3.97Å; F742-F842 HydrophobicContact CE1-CD1 3.97Å; F742-F842 HydrophobicContact CE1-CE1 4.04Å; F742-F842 AromaticContact CZ-CD1 3.84Å; F742-F842 HydrophobicContact CZ-CD1 3.84Å; F742-F842 HydrophobicContact CZ-CE1 4.33Å; F742-F842 HydrophobicContact CZ-CG 4.37Å
743	F	78.2	Confident	86.4	Confident	25 Å²	25	15.3 Å²	15.3	11%	0.11	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-39.4	-179.6	-50.3	-81.4	0	0	0	111.3	Y205 Y226 T667 L671 G740 M741 P745 V823	Y205-F743 VanDerWaalsContact CB-O 3.27Å; Y205-F743 WeakPolarHBondContact CB-O 3.12Å; Y205-F743 PolarHBondContact N-O 3.48Å; Y226-F743 PolarHBondContact OH-O 3.14Å; T667-F743 HydrophobicContact CG2-CD1 3.93Å; L671-F743 HydrophobicContact CD1-CB 3.08Å; L671-F743 HydrophobicContact CD1-CD1 4.19Å; L671-F743 HydrophobicContact CD1-CD2 4.21Å; L671-F743 HydrophobicContact CD1-CG 3.63Å; L671-F743 HydrophobicContact CD2-CB 3.43Å; L671-F743 VanDerWaalsContact CD2-CB 3.43Å; L671-F743 WeakPolarHBondContact CD2-O 3.03Å; L671-F743 HydrophobicContact CG-CB 3.35Å; L671-F743 HydrophobicContact CG-CG 4.4Å; G740-F743 PolarHBondContact O-N 2.88Å; M741-F743 PolarHBondContact O-N 2.65Å; F743-P745 VanDerWaalsContact O-CD 3.25Å; F743-P745 WeakPolarHBondContact O-CD 3.31Å; F743-V823 HydrophobicContact CE1-CG1 4.1Å; F743-V823 HydrophobicContact CZ-CB 4.15Å; F743-V823 HydrophobicContact CZ-CG1 3.82Å; F743-V823 HydrophobicContact CZ-CG2 4.13Å
744	C	81.2	Confident	86.7	Confident	2 Å²	2	15.3 Å²	15.3	1%	0.014	8%	0.081	C	C	.	.			trans	-109	89.7	177	-177.6	0	0	0	0	109.4	L203 L671 G740 M741 L746 L747	L203-C744 WeakPolarHBondContact CD1-SG 3.32Å; L203-C744 PolarHBondContact O-SG 3.17Å; L671-C744 HydrophobicContact CD2-CB 4.19Å; L671-C744 HydrophobicContact CG-CB 4.32Å; G740-C744 PolarHBondContact O-N 3.47Å; M741-C744 WeakPolarHBondContact CA-O 3.32Å; M741-C744 CarbonylContact O-C 3.6Å; C744-L746 PolarHBondContact O-N 2.87Å; C744-L747 HydrophobicContact CB-CB 4.04Å; C744-L747 VanDerWaalsContact O-CB 3.23Å; C744-L747 WeakPolarHBondContact O-CB 3.36Å; C744-L747 PolarHBondContact O-N 3.41Å; C744-L747 VanDerWaalsContact O-N 3.14Å
745	P	85.8	Confident	86.8	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.2	-171.1	23.7	-34.2	0	0	0	113.4	M148 I152 Y208 Y226 F743 P748	M148-P745 VanDerWaalsContact CE-CA 3.43Å; M148-P745 HydrophobicContact CE-CB 3.32Å; M148-P745 WeakPolarHBondContact CG-O 3.33Å; I152-P745 HydrophobicContact CD1-CB 4.36Å; I152-P745 HydrophobicContact CG2-CB 4.48Å; Y208-P745 HydrophobicContact CD2-CG 4.38Å; Y208-P745 HydrophobicContact CE2-CG 3.35Å; Y208-P745 VanDerWaalsContact OH-CG 3.31Å; Y208-P745 WeakPolarHBondContact OH-CG 3.46Å; Y226-P745 HydrophobicContact CE2-CB 4.27Å; Y226-P745 HydrophobicContact CE2-CG 4.09Å; F743-P745 VanDerWaalsContact O-CD 3.25Å; F743-P745 WeakPolarHBondContact O-CD 3.31Å; P745-P748 WeakPolarHBondContact O-CD 3.48Å
746	L	87.2	Confident	87	Confident	38 Å²	38	17.5 Å²	17.5	20%	0.199	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	5	-177.9	-149.2	70	0	0	0	113.2	T153 L203 C744 P748 A749 M750	T153-L746 HydrophobicContact CG2-CD1 3.95Å; L203-L746 HydrophobicContact CD1-CB 3.72Å; C744-L746 PolarHBondContact O-N 2.87Å; L746-P748 VanDerWaalsContact C-CD 3.42Å; L746-P748 VanDerWaalsContact C-N 3.34Å; L746-A749 HydrophobicContact CD1-CB 4.14Å; L746-A749 HydrophobicContact CG-CB 3.92Å; L746-A749 VanDerWaalsContact O-CB 3.31Å; L746-A749 WeakPolarHBondContact O-CB 3.24Å; L746-A749 PolarHBondContact O-N 3.49Å; L746-M750 PolarHBondContact O-N 3.49Å
747	L	88.1	Confident	87.5	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-55.5	-38.6	173.1	-161.1	68.7	0	0	0	113.6	I674 A675 V678 C744 A749 M750 N751	I674-L747 HydrophobicContact CG2-CD2 4.2Å; A675-L747 HydrophobicContact CB-CD1 4.49Å; V678-L747 HydrophobicContact CG2-CD1 4.46Å; C744-L747 HydrophobicContact CB-CB 4.04Å; C744-L747 VanDerWaalsContact O-CB 3.23Å; C744-L747 WeakPolarHBondContact O-CB 3.36Å; C744-L747 PolarHBondContact O-N 3.41Å; C744-L747 VanDerWaalsContact O-N 3.14Å; L747-A749 PolarHBondContact O-N 3.28Å; L747-M750 HydrophobicContact CD1-SD 4.4Å; L747-M750 PolarHBondContact O-N 3.07Å; L747-N751 PolarHBondContact O-N 3.35Å
748	P	91.5	Very high	87.6	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-60.6	-31.1	173.4	-24.9	36.9	0	0	0	113.5	I144 I737 M741 P745 L746 N751 N752	I144-P748 HydrophobicContact CB-CB 4.4Å; I144-P748 HydrophobicContact CG2-CB 3.81Å; I144-P748 HydrophobicContact CG2-CG 3.68Å; I737-P748 HydrophobicContact CG2-CB 4.39Å; I737-P748 HydrophobicContact CG2-CG 4.02Å; M741-P748 HydrophobicContact CB-CG 4.38Å; P745-P748 WeakPolarHBondContact O-CD 3.48Å; L746-P748 VanDerWaalsContact C-CD 3.42Å; L746-P748 VanDerWaalsContact C-N 3.34Å; P748-N751 PolarHBondContact O-N 3.26Å; P748-N752 PolarHBondContact O-N 3.24Å; P748-N752 PolarHBondContact O-ND2 3.01Å
749	A	90.8	Very high	87.6	Confident	27 Å²	27	20.4 Å²	20.4	22%	0.223	11%	0.11	C	C	.	.	H	α-helix	trans	-71.8	-44.3	176.9	0	0	0	0	0	111.4	L746 L747 N751 N752 I753	L746-A749 HydrophobicContact CD1-CB 4.14Å; L746-A749 HydrophobicContact CG-CB 3.92Å; L746-A749 VanDerWaalsContact O-CB 3.31Å; L746-A749 WeakPolarHBondContact O-CB 3.24Å; L746-A749 PolarHBondContact O-N 3.49Å; L747-A749 PolarHBondContact O-N 3.28Å; A749-N751 PolarHBondContact O-N 3.28Å; A749-N752 WeakPolarHBondContact O-CB 3.45Å; A749-N752 PolarHBondContact O-N 2.98Å; A749-I753 PolarHBondContact O-N 2.85Å
750	M	89	Confident	88.1	Confident	39 Å²	39	24.2 Å²	24.2	19%	0.192	12%	0.123	C	C	.	.	H	α-helix	trans	-56.7	-40.5	170.1	-72.7	-178.3	68.6	0	0	111.3	F194 L203 T679 L746 L747 N752 I753 K754	F194-M750 HydrophobicContact CE1-CE 3.73Å; F194-M750 HydrophobicContact CZ-CE 3.66Å; L203-M750 HydrophobicContact CD1-CG 4.07Å; L203-M750 HydrophobicContact CD1-SD 3.56Å; L203-M750 VanDerWaalsContact CD1-SD 3.56Å; L203-M750 HydrophobicContact CD2-SD 3.47Å; L203-M750 WeakPolarHBondContact CD2-SD 3.33Å; L203-M750 HydrophobicContact CG-SD 4.13Å; T679-M750 HydrophobicContact CG2-CE 3.66Å; L746-M750 PolarHBondContact O-N 3.49Å; L747-M750 HydrophobicContact CD1-SD 4.4Å; L747-M750 PolarHBondContact O-N 3.07Å; M750-N752 VanDerWaalsContact C-N 3.33Å; M750-N752 PolarHBondContact O-N 3.43Å; M750-I753 WeakPolarHBondContact O-CB 3.17Å; M750-I753 PolarHBondContact O-N 2.88Å; M750-K754 PolarHBondContact O-N 3.35Å
751	N	91.5	Very high	88.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.9	-31.5	176.6	-176	59.5	0	0	0	113.5	N141 N733 I737 L747 P748 A749 I753 K754 L755	N141-N751 PolarHBondContact ND2-ND2 2.88Å; N733-N751 PolarHBondContact ND2-OD1 2.75Å; I737-N751 HydrophobicContact CD1-CB 3.42Å; I737-N751 VanDerWaalsContact CD1-CB 3.42Å; I737-N751 WeakPolarHBondContact CD1-ND2 3.29Å; I737-N751 VanDerWaalsContact CD1-OD1 3.3Å; I737-N751 WeakPolarHBondContact CD1-OD1 3.29Å; I737-N751 HydrophobicContact CG1-CB 3.98Å; L747-N751 PolarHBondContact O-N 3.35Å; P748-N751 PolarHBondContact O-N 3.26Å; A749-N751 PolarHBondContact O-N 3.28Å; N751-I753 VanDerWaalsContact C-N 3.28Å; N751-I753 PolarHBondContact O-N 3.24Å; N751-K754 CarbonylContact O-C 3.58Å; N751-K754 WeakPolarHBondContact O-CB 3.37Å; N751-K754 PolarHBondContact O-N 2.88Å; N751-L755 VanDerWaalsContact ND2-CD1 3.33Å; N751-L755 WeakPolarHBondContact ND2-CD1 3.32Å; N751-L755 WeakPolarHBondContact O-CB 3.26Å; N751-L755 VanDerWaalsContact O-CG 3.28Å; N751-L755 WeakPolarHBondContact O-CG 3.26Å; N751-L755 PolarHBondContact O-N 2.97Å
752	N	92.6	Very high	88.7	Confident	13 Å²	13	26.3 Å²	26.3	7%	0.07	13%	0.134	C	C	.	.	H	α-helix	trans	-60.6	-42.1	173.6	-72.6	-32.2	0	0	0	111	F138 N141 L142 S145 P748 A749 M750 L755 V756	F138-N752 HydrophobicContact CD2-CB 4.32Å; F138-N752 HydrophobicContact CE2-CB 4.01Å; N141-N752 WeakPolarHBondContact CB-OD1 3.38Å; N141-N752 PolarHBondContact O-ND2 2.83Å; L142-N752 WeakPolarHBondContact CA-ND2 3.32Å; L142-N752 PolarHBondContact N-ND2 2.87Å; L142-N752 PolarHBondContact N-OD1 2.91Å; S145-N752 PolarHBondContact OG-ND2 3.47Å; P748-N752 PolarHBondContact O-N 3.24Å; P748-N752 PolarHBondContact O-ND2 3.01Å; A749-N752 WeakPolarHBondContact O-CB 3.45Å; A749-N752 PolarHBondContact O-N 2.98Å; M750-N752 VanDerWaalsContact C-N 3.33Å; M750-N752 PolarHBondContact O-N 3.43Å; N752-L755 PolarHBondContact O-N 3.42Å; N752-V756 VanDerWaalsContact O-CG2 3.26Å; N752-V756 WeakPolarHBondContact O-CG2 3.42Å; N752-V756 PolarHBondContact O-N 3.4Å
753	I	91.4	Very high	89	Confident	110 Å²	110	26.3 Å²	26.3	56%	0.564	14%	0.135	S	C	*	.	H	α-helix	trans	-61.2	-47.9	173.7	-59	171.3	0	0	0	110	A749 M750 N751 L755 V756 I757	A749-I753 PolarHBondContact O-N 2.85Å; M750-I753 WeakPolarHBondContact O-CB 3.17Å; M750-I753 PolarHBondContact O-N 2.88Å; N751-I753 VanDerWaalsContact C-N 3.28Å; N751-I753 PolarHBondContact O-N 3.24Å; I753-L755 VanDerWaalsContact C-N 3.34Å; I753-L755 PolarHBondContact O-N 3.06Å; I753-V756 PolarHBondContact O-N 2.84Å; I753-I757 HydrophobicContact CG2-CD1 3.98Å; I753-I757 WeakPolarHBondContact O-CG1 3.15Å; I753-I757 PolarHBondContact O-N 3.48Å
754	K	91.1	Very high	89.5	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.017	15%	0.15	C	C	.	.	H	α-helix	trans	-54.9	-46.1	175.4	179	173.8	-177.9	171.3	0	112.5	V678 D681 L682 N733 M750 N751 I757 L758	V678-K754 HydrophobicContact CG1-CD 3.92Å; V678-K754 PolarHBondContact O-NZ 2.81Å; D681-K754 WeakPolarHBondContact OD2-CE 3.35Å; D681-K754 IonicContact OD2-NZ 2.66Å; D681-K754 PolarHBondContact OD2-NZ 3.28Å; L682-K754 HydrophobicContact CB-CD 4.17Å; L682-K754 HydrophobicContact CB-CG 4.05Å; L682-K754 HydrophobicContact CD1-CG 4.07Å; L682-K754 HydrophobicContact CD2-CB 4.37Å; L682-K754 HydrophobicContact CD2-CG 4.29Å; L682-K754 HydrophobicContact CG-CG 4.35Å; N733-K754 WeakPolarHBondContact OD1-CE 3.27Å; N733-K754 PolarHBondContact OD1-NZ 2.85Å; M750-K754 PolarHBondContact O-N 3.35Å; N751-K754 CarbonylContact O-C 3.58Å; N751-K754 WeakPolarHBondContact O-CB 3.37Å; N751-K754 PolarHBondContact O-N 2.88Å; K754-I757 PolarHBondContact O-N 3.13Å; K754-L758 WeakPolarHBondContact O-CB 3.39Å; K754-L758 PolarHBondContact O-N 3.21Å
755	L	91.6	Very high	89.8	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-67	-35.4	-179.8	-72.6	176.1	0	0	0	112.4	L134 I137 F138 N751 N752 I753 L759	L134-L755 HydrophobicContact CD2-CB 4.37Å; L134-L755 HydrophobicContact CD2-CD2 4.47Å; L134-L755 HydrophobicContact CG-CD2 4.39Å; I137-L755 HydrophobicContact CG2-CD1 3.87Å; F138-L755 HydrophobicContact CB-CD1 4.16Å; F138-L755 HydrophobicContact CD2-CB 4.4Å; N751-L755 VanDerWaalsContact ND2-CD1 3.33Å; N751-L755 WeakPolarHBondContact ND2-CD1 3.32Å; N751-L755 WeakPolarHBondContact O-CB 3.26Å; N751-L755 VanDerWaalsContact O-CG 3.28Å; N751-L755 WeakPolarHBondContact O-CG 3.26Å; N751-L755 PolarHBondContact O-N 2.97Å; N752-L755 PolarHBondContact O-N 3.42Å; I753-L755 VanDerWaalsContact C-N 3.34Å; I753-L755 PolarHBondContact O-N 3.06Å; L755-L759 VanDerWaalsContact O-CB 3.25Å; L755-L759 WeakPolarHBondContact O-CB 3.47Å; L755-L759 PolarHBondContact O-N 3.32Å
756	V	91.4	Very high	89.8	Confident	48 Å²	48	30.2 Å²	30.2	29%	0.291	15%	0.149	S	C	.	.	H	α-helix	trans	-63.2	-52.8	173.7	172.3	0	0	0	0	109.7	W112 F138 N752 I753 L758 L759 Y760	W112-V756 HydrophobicContact CZ3-CG2 4.17Å; F138-V756 HydrophobicContact CD2-CG2 4.39Å; F138-V756 HydrophobicContact CE2-CG2 3.84Å; N752-V756 VanDerWaalsContact O-CG2 3.26Å; N752-V756 WeakPolarHBondContact O-CG2 3.42Å; N752-V756 PolarHBondContact O-N 3.4Å; I753-V756 PolarHBondContact O-N 2.84Å; V756-L758 VanDerWaalsContact C-N 3.34Å; V756-L758 PolarHBondContact O-N 2.81Å; V756-L759 WeakPolarHBondContact O-CB 3.4Å; V756-L759 PolarHBondContact O-N 3.31Å; V756-Y760 HydrophobicContact CG1-CD2 3.9Å; V756-Y760 HydrophobicContact CG1-CE2 3.91Å; V756-Y760 VanDerWaalsContact O-CD2 3.28Å; V756-Y760 WeakPolarHBondContact O-CD2 3.35Å; V756-Y760 PolarHBondContact O-N 3.49Å
757	I	91.5	Very high	89.6	Confident	67 Å²	67	31.9 Å²	31.9	34%	0.344	16%	0.157	S	C	.	.	H	α-helix	trans	-58	-49.1	178.7	-64.3	166.6	0	0	0	109.9	L682 V686 I753 K754 L759 Y760 T761	L682-I757 HydrophobicContact CD1-CB 4.21Å; L682-I757 HydrophobicContact CD1-CG2 3.89Å; L682-I757 HydrophobicContact CD2-CD1 3.88Å; V686-I757 HydrophobicContact CG2-CG2 4.27Å; I753-I757 HydrophobicContact CG2-CD1 3.98Å; I753-I757 WeakPolarHBondContact O-CG1 3.15Å; I753-I757 PolarHBondContact O-N 3.48Å; K754-I757 PolarHBondContact O-N 3.13Å; I757-L759 VanDerWaalsContact C-N 3.32Å; I757-L759 PolarHBondContact O-N 3.21Å; I757-Y760 PolarHBondContact O-N 3.2Å; I757-Y760 VanDerWaalsContact O-N 3.17Å; I757-T761 WeakPolarHBondContact O-CB 3.34Å; I757-T761 PolarHBondContact O-N 3.11Å; I757-T761 PolarHBondContact O-OG1 3.39Å
758	L	89.6	Confident	89.3	Confident	12 Å²	12	34.3 Å²	34.3	6%	0.063	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-39.8	-179.4	-167.9	154.1	0	0	0	112.3	Y130 L134 V730 K754 V756 R762	Y130-L758 WeakPolarHBondContact OH-CD2 3.07Å; L134-L758 HydrophobicContact CD1-CD2 3.61Å; V730-L758 HydrophobicContact CG2-CD2 4.31Å; K754-L758 WeakPolarHBondContact O-CB 3.39Å; K754-L758 PolarHBondContact O-N 3.21Å; V756-L758 VanDerWaalsContact C-N 3.34Å; V756-L758 PolarHBondContact O-N 2.81Å; L758-R762 HydrophobicContact CD2-CG 3.96Å; L758-R762 HydrophobicContact CG-CG 4.4Å; L758-R762 VanDerWaalsContact O-CB 3.22Å; L758-R762 WeakPolarHBondContact O-CB 3.45Å; L758-R762 VanDerWaalsContact O-CG 3.27Å; L758-R762 WeakPolarHBondContact O-CG 3.38Å; L758-R762 PolarHBondContact O-N 2.98Å
759	L	89.5	Confident	88.6	Confident	4 Å²	4	35 Å²	35	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-49.8	174.7	178.4	101.5	0	0	0	111.1	W112 F131 L134 L755 V756 I757 A763	W112-L759 HydrophobicContact CB-CD2 3.69Å; W112-L759 HydrophobicContact CD2-CD1 4.33Å; W112-L759 HydrophobicContact CD2-CD2 3.35Å; W112-L759 HydrophobicContact CD2-CG 4.48Å; W112-L759 HydrophobicContact CE3-CD2 3.19Å; W112-L759 HydrophobicContact CE3-CG 4.5Å; W112-L759 HydrophobicContact CG-CD1 4.31Å; W112-L759 HydrophobicContact CG-CD2 3.54Å; W112-L759 HydrophobicContact CZ3-CD2 3.97Å; F131-L759 HydrophobicContact CD1-CD1 3.77Å; F131-L759 HydrophobicContact CD1-CG 4.48Å; L134-L759 HydrophobicContact CD1-CB 4.26Å; L134-L759 HydrophobicContact CD1-CD1 4.29Å; L134-L759 HydrophobicContact CD2-CB 3.98Å; L134-L759 HydrophobicContact CD2-CD1 3.78Å; L134-L759 HydrophobicContact CD2-CG 4.49Å; L134-L759 HydrophobicContact CG-CD1 4.47Å; L755-L759 VanDerWaalsContact O-CB 3.25Å; L755-L759 WeakPolarHBondContact O-CB 3.47Å; L755-L759 PolarHBondContact O-N 3.32Å; V756-L759 WeakPolarHBondContact O-CB 3.4Å; V756-L759 PolarHBondContact O-N 3.31Å; I757-L759 VanDerWaalsContact C-N 3.32Å; I757-L759 PolarHBondContact O-N 3.21Å; L759-A763 WeakPolarHBondContact O-CB 3.3Å; L759-A763 PolarHBondContact O-N 3.06Å
760	Y	90.6	Very high	87.9	Confident	108 Å²	108	34.3 Å²	34.3	42%	0.424	17%	0.169	S	C	.	.	H	α-helix	trans	-66.2	-44.7	-178.6	-82.9	-80.9	0	0	0	111.9	K115 V756 I757 A763 W764	K115-Y760 HydrophobicContact CD-CD1 4.4Å; K115-Y760 HydrophobicContact CD-CE1 3.92Å; K115-Y760 VanDerWaalsContact CE-CE1 3.49Å; V756-Y760 HydrophobicContact CG1-CD2 3.9Å; V756-Y760 HydrophobicContact CG1-CE2 3.91Å; V756-Y760 VanDerWaalsContact O-CD2 3.28Å; V756-Y760 WeakPolarHBondContact O-CD2 3.35Å; V756-Y760 PolarHBondContact O-N 3.49Å; I757-Y760 PolarHBondContact O-N 3.2Å; I757-Y760 VanDerWaalsContact O-N 3.17Å; Y760-A763 PolarHBondContact O-N 2.99Å; Y760-W764 VanDerWaalsContact O-CB 3.29Å; Y760-W764 WeakPolarHBondContact O-CB 3.02Å; Y760-W764 PolarHBondContact O-N 3.38Å
761	T	88.6	Confident	87	Confident	25 Å²	25	35.9 Å²	35.9	15%	0.153	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-44.9	178.6	-53.8	0	0	0	0	111.6	V686 I689 I757 W764 A765	V686-T761 HydrophobicContact CG1-CG2 4.37Å; V686-T761 HydrophobicContact CG2-CG2 4.39Å; I689-T761 HydrophobicContact CB-CG2 4.33Å; I689-T761 HydrophobicContact CD1-CG2 3.78Å; I689-T761 HydrophobicContact CG2-CG2 4.06Å; I757-T761 WeakPolarHBondContact O-CB 3.34Å; I757-T761 PolarHBondContact O-N 3.11Å; I757-T761 PolarHBondContact O-OG1 3.39Å; T761-W764 PolarHBondContact O-N 3.33Å; T761-A765 WeakPolarHBondContact O-CB 3.48Å; T761-A765 PolarHBondContact O-N 3.38Å
762	R	89.4	Confident	85.7	Confident	20 Å²	20	38.1 Å²	38.1	8%	0.075	19%	0.192	C	C	.	.	H	α-helix	trans	-70	-37.5	176.8	-70.3	-72.1	-171.3	174.9	1.3	112.2	Y130 F131 I689 D693 N726 L758 W764 A765 V766	Y130-R762 HydrophobicContact CE1-CB 4.35Å; F131-R762 HydrophobicContact CE1-CB 4.39Å; I689-R762 HydrophobicContact CD1-CG 3.96Å; I689-R762 VanDerWaalsContact CD1-NE 3.26Å; D693-R762 IonicContact OD2-NH1 2.64Å; N726-R762 VanDerWaalsContact OD1-CZ 3.24Å; N726-R762 PolarHBondContact OD1-NH1 3.25Å; N726-R762 VanDerWaalsContact OD1-NH1 3.17Å; N726-R762 PolarHBondContact OD1-NH2 3.49Å; L758-R762 HydrophobicContact CD2-CG 3.96Å; L758-R762 HydrophobicContact CG-CG 4.4Å; L758-R762 VanDerWaalsContact O-CB 3.22Å; L758-R762 WeakPolarHBondContact O-CB 3.45Å; L758-R762 VanDerWaalsContact O-CG 3.27Å; L758-R762 WeakPolarHBondContact O-CG 3.38Å; L758-R762 PolarHBondContact O-N 2.98Å; R762-W764 VanDerWaalsContact C-N 3.32Å; R762-A765 PolarHBondContact O-N 2.88Å; R762-V766 WeakPolarHBondContact O-CB 3.47Å; R762-V766 WeakPolarHBondContact O-CG2 3.12Å; R762-V766 PolarHBondContact O-N 3.42Å
763	A	88.9	Confident	84.1	Confident	9 Å²	9	39.7 Å²	39.7	7%	0.074	21%	0.207	C	C	.	.	H	α-helix	trans	-63.7	-40.1	174.7	0	0	0	0	0	111.4	I119 F131 L759 Y760 M767	I119-A763 HydrophobicContact CD1-CB 3.89Å; F131-A763 HydrophobicContact CE1-CB 3.88Å; F131-A763 HydrophobicContact CZ-CB 4.28Å; L759-A763 WeakPolarHBondContact O-CB 3.3Å; L759-A763 PolarHBondContact O-N 3.06Å; Y760-A763 PolarHBondContact O-N 2.99Å; A763-M767 WeakPolarHBondContact O-CG 3.28Å; A763-M767 PolarHBondContact O-N 3.07Å
764	W	88.7	Confident	82.2	Confident	108 Å²	108	38.7 Å²	38.7	41%	0.409	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-54.6	173.7	173.9	79.5	0	0	0	111	L690 F694 Y760 T761 R762 V766 M767 T768	L690-W764 HydrophobicContact CD2-CH2 3.97Å; L690-W764 HydrophobicContact CD2-CZ3 3.77Å; F694-W764 HydrophobicContact CB-CH2 4.3Å; F694-W764 AromaticContact CD2-CH2 3.7Å; F694-W764 HydrophobicContact CD2-CH2 3.7Å; F694-W764 HydrophobicContact CD2-CZ2 4.24Å; F694-W764 HydrophobicContact CE2-CH2 4.32Å; F694-W764 HydrophobicContact CG-CH2 4.19Å; Y760-W764 VanDerWaalsContact O-CB 3.29Å; Y760-W764 WeakPolarHBondContact O-CB 3.02Å; Y760-W764 PolarHBondContact O-N 3.38Å; T761-W764 PolarHBondContact O-N 3.33Å; R762-W764 VanDerWaalsContact C-N 3.32Å; W764-V766 VanDerWaalsContact C-N 3.29Å; W764-V766 PolarHBondContact O-N 3.2Å; W764-M767 PolarHBondContact O-N 3.33Å; W764-T768 HydrophobicContact CG-CG2 4.48Å; W764-T768 PolarHBondContact O-N 3.31Å; W764-T768 PolarHBondContact O-OG1 3.05Å
765	A	87.3	Confident	80.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-57.8	-38.5	-179.3	0	0	0	0	0	113.3	I689 T761 R762 M767 T768 C769 N770	I689-A765 HydrophobicContact CG2-CB 3.45Å; I689-A765 VanDerWaalsContact CG2-CB 3.45Å; T761-A765 WeakPolarHBondContact O-CB 3.48Å; T761-A765 PolarHBondContact O-N 3.38Å; R762-A765 PolarHBondContact O-N 2.88Å; A765-M767 VanDerWaalsContact C-N 3.35Å; A765-T768 PolarHBondContact O-N 3.19Å; A765-C769 PolarHBondContact O-N 2.87Å; A765-N770 PolarHBondContact O-N 3.5Å
766	V	85.7	Confident	78	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-42.6	174.6	167.7	0	0	0	0	111.7	I119 F123 V127 F131 F721 R762 W764	I119-V766 HydrophobicContact CG2-CG1 4.26Å; F123-V766 HydrophobicContact CD2-CG1 3.8Å; F123-V766 HydrophobicContact CE1-CG1 4.36Å; F123-V766 HydrophobicContact CE2-CG1 3.55Å; F123-V766 HydrophobicContact CG-CG1 4.33Å; F123-V766 HydrophobicContact CZ-CG1 3.87Å; F123-V766 WeakPolarHBondContact CZ-O 3.47Å; V127-V766 HydrophobicContact CG1-CG1 4.11Å; F131-V766 HydrophobicContact CZ-CG2 4.19Å; F721-V766 HydrophobicContact CB-CG2 4.31Å; F721-V766 HydrophobicContact CD1-CG2 4.3Å; F721-V766 HydrophobicContact CD2-CG2 3.18Å; F721-V766 HydrophobicContact CE1-CG2 4.44Å; F721-V766 HydrophobicContact CE2-CG2 3.34Å; F721-V766 HydrophobicContact CG-CG2 3.68Å; F721-V766 HydrophobicContact CZ-CG2 4Å; R762-V766 WeakPolarHBondContact O-CB 3.47Å; R762-V766 WeakPolarHBondContact O-CG2 3.12Å; R762-V766 PolarHBondContact O-N 3.42Å; W764-V766 VanDerWaalsContact C-N 3.29Å; W764-V766 PolarHBondContact O-N 3.2Å
767	M	82.4	Confident	75.6	Confident	72 Å²	72	49.8 Å²	49.8	36%	0.355	27%	0.268	S	S	.	.	H	α-helix	trans	-77.9	-21.9	-176.6	-68.1	-68.3	-53.2	0	0	113.5	I119 F123 A763 W764 A765	I119-M767 HydrophobicContact CG1-CG 4.29Å; I119-M767 HydrophobicContact CG1-SD 3.91Å; F123-M767 HydrophobicContact CD2-SD 4.44Å; F123-M767 HydrophobicContact CE2-SD 3.77Å; A763-M767 WeakPolarHBondContact O-CG 3.28Å; A763-M767 PolarHBondContact O-N 3.07Å; W764-M767 PolarHBondContact O-N 3.33Å; A765-M767 VanDerWaalsContact C-N 3.35Å
768	T	82.3	Confident	73.4	Confident	51 Å²	51	55.8 Å²	55.8	31%	0.313	29%	0.286	S	S	.	.	H	α-helix	trans	-104.1	-39.8	-174	52.6	0	0	0	0	114.4	R701 W764 A765	R701-T768 PolarHBondContact NH2-O 2.94Å; W764-T768 HydrophobicContact CG-CG2 4.48Å; W764-T768 PolarHBondContact O-N 3.31Å; W764-T768 PolarHBondContact O-OG1 3.05Å; A765-T768 PolarHBondContact O-N 3.19Å
769	C	76	Confident	70.6	Confident	16 Å²	16	56.5 Å²	56.5	11%	0.108	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-21.1	-164.3	-61.5	0	0	0	0	114.5	D693 A765	D693-C769 HydrophobicContact CB-CB 4.28Å; D693-C769 WeakPolarHBondContact O-CB 3.42Å; A765-C769 PolarHBondContact O-N 2.87Å
770	N	76.4	Confident	68.2	Low	13 Å²	13	58.9 Å²	58.9	7%	0.07	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	144.5	-171.1	-66.9	-30	0	0	0	113.5	F123 G719 F721 A765	F123-N770 WeakPolarHBondContact CE1-O 2.99Å; G719-N770 CarbonylContact O-C 3.59Å; G719-N770 WeakPolarHBondContact O-CA 3.25Å; G719-N770 WeakPolarHBondContact O-CB 3.16Å; G719-N770 PolarHBondContact O-OD1 2.83Å; F721-N770 HydrophobicContact CB-CB 4.26Å; A765-N770 PolarHBondContact O-N 3.5Å
771	I	71.1	Confident	66	Low	71 Å²	71	58.1 Å²	58.1	36%	0.364	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	145.1	174.1	-63.9	-171.7	0	0	0	109.5	Y718 G719 A773	Y718-I771 HydrophobicContact CD1-CD1 4.15Å; Y718-I771 HydrophobicContact CD1-CG1 4.47Å; Y718-I771 HydrophobicContact CD2-CD1 3.34Å; Y718-I771 HydrophobicContact CD2-CG1 4.44Å; Y718-I771 HydrophobicContact CE2-CD1 4.1Å; Y718-I771 HydrophobicContact CG-CD1 3.36Å; Y718-I771 HydrophobicContact CG-CG1 4Å; G719-I771 PolarHBondContact O-N 2.83Å; I771-A773 PolarHBondContact O-N 3.05Å
772	P	64.3	Low	63.6	Low	48 Å²	48	58.6 Å²	58.6	31%	0.312	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-59.4	131.8	170.7	24.5	-34.5	0	0	0	111.1	F123 A774	F123-P772 HydrophobicContact CD1-CB 3.97Å; F123-P772 HydrophobicContact CD1-CG 4.44Å; P772-A774 PolarHBondContact O-N 3.02Å
773	A	57.4	Low	61.2	Low	46 Å²	46	59.2 Å²	59.2	38%	0.38	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-55.4	130.2	178.6	0	0	0	0	0	111.7	I771 E775	I771-A773 PolarHBondContact O-N 3.05Å; A773-E775 PolarHBondContact O-N 2Å
774	A	51.9	Low	58.7	Low	89 Å²	89	60.2 Å²	60.2	74%	0.736	32%	0.319	S	S	*	.	S	Bend	trans	-65.2	-26.7	-176.3	0	0	0	0	0	112.8	E720 P772	E720-A774 PolarHBondContact OE1-N 3.39Å; P772-A774 PolarHBondContact O-N 3.02Å
775	E	51.4	Low	56.4	Low	110 Å²	110	59 Å²	59	51%	0.514	32%	0.315	S	S	.	.	S	Bend	trans	-94.6	100.9	178.5	-65.9	-160.4	173.4	0	0	112.4	P416 A773 F777	P416-E775 WeakPolarHBondContact CB-OE2 3.34Å; A773-E775 PolarHBondContact O-N 2Å; E775-F777 PolarHBondContact O-N 2.88Å
776	V	43.7	Very low	54.1	Low	75 Å²	75	62.1 Å²	62.1	46%	0.455	34%	0.34	S	S	.	.			trans	-68.1	98	178.8	-157.9	0	0	0	0	110.8	A288 R778 A779	A288-V776 HydrophobicContact CB-CG2 4.23Å; V776-R778 PolarHBondContact O-N 2.94Å; V776-A779 HydrophobicContact CG1-CB 4.12Å
777	F	42	Very low	51.9	Low	101 Å²	101	66.4 Å²	66.4	44%	0.443	37%	0.366	S	S	.	.			trans	-60.7	98.3	169.7	-80.2	-78.5	0	0	0	110.7	L420 E775 A779	L420-F777 HydrophobicContact CD2-CD1 4.43Å; L420-F777 HydrophobicContact CD2-CE1 3.49Å; L420-F777 VanDerWaalsContact CD2-CE1 3.49Å; L420-F777 HydrophobicContact CD2-CE2 3.8Å; L420-F777 HydrophobicContact CD2-CZ 3.14Å; L420-F777 HydrophobicContact CG-CZ 4.35Å; E775-F777 PolarHBondContact O-N 2.88Å; F777-A779 VanDerWaalsContact C-N 3.31Å; F777-A779 PolarHBondContact O-N 3.36Å
778	R	44	Very low	49.8	Very low	193 Å²	193	70.4 Å²	70.4	73%	0.728	38%	0.384	S	S	*	.			trans	30.5	56.2	163.2	-150.4	175.1	-178.6	177.6	-0.7	115.3	V776 S780	V776-R778 PolarHBondContact O-N 2.94Å; R778-S780 PolarHBondContact O-N 3.14Å; R778-S780 VanDerWaalsContact O-N 3.11Å
779	A	31.1	Very low	47.4	Very low	27 Å²	27	72.7 Å²	72.7	22%	0.223	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-67.5	5.1	161.5	0	0	0	0	0	112.7	V776 F777 K781 F782	V776-A779 HydrophobicContact CG1-CB 4.12Å; F777-A779 VanDerWaalsContact C-N 3.31Å; F777-A779 PolarHBondContact O-N 3.36Å; A779-K781 PolarHBondContact O-N 2.97Å; A779-F782 HydrophobicContact CB-CB 4.26Å; A779-F782 WeakPolarHBondContact O-CA 3.27Å; A779-F782 WeakPolarHBondContact O-CB 3.49Å; A779-F782 PolarHBondContact O-N 3.49Å
780	S	39.8	Very low	45.7	Very low	53 Å²	53	79.6 Å²	79.6	37%	0.371	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-66.9	-3.8	-178.4	68.2	0	0	0	0	114.6	R778	R778-S780 PolarHBondContact O-N 3.14Å; R778-S780 VanDerWaalsContact O-N 3.11Å
781	K	44.4	Very low	44	Very low	93 Å²	93	87.8 Å²	87.8	40%	0.404	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-96.9	4.2	167.8	-70.5	-168.4	177.3	-170.7	0	113.3	A779 R785	A779-K781 PolarHBondContact O-N 2.97Å; K781-R785 PolarHBondContact O-NE 3.42Å; K781-R785 PolarHBondContact O-NH2 3.38Å
782	F	38.1	Very low	41.9	Very low	34 Å²	34	93.2 Å²	93.2	15%	0.149	49%	0.49	C	S	.	.	S	Bend	trans	-74.2	-45	-173.2	-173.7	-111.7	0	0	0	111	S125 D273 A779 F799	S125-F782 WeakPolarHBondContact OG-CD2 3.27Å; S125-F782 WeakPolarHBondContact OG-CE2 3.24Å; D273-F782 WeakPolarHBondContact OD2-CE1 3.1Å; A779-F782 HydrophobicContact CB-CB 4.26Å; A779-F782 WeakPolarHBondContact O-CA 3.27Å; A779-F782 WeakPolarHBondContact O-CB 3.49Å; A779-F782 PolarHBondContact O-N 3.49Å; F782-F799 AromaticContact CD2-CD1 3.68Å; F782-F799 HydrophobicContact CD2-CD1 3.68Å; F782-F799 AromaticContact CD2-CE1 3Å; F782-F799 HydrophobicContact CD2-CE1 3Å; F782-F799 HydrophobicContact CD2-CE2 4.26Å; F782-F799 AromaticContact CD2-CZ 3.39Å; F782-F799 HydrophobicContact CD2-CZ 3.39Å; F782-F799 AromaticContact CE2-CD1 3.79Å; F782-F799 HydrophobicContact CE2-CD1 3.79Å; F782-F799 HydrophobicContact CE2-CD2 4.12Å; F782-F799 AromaticContact CE2-CE1 3.11Å; F782-F799 HydrophobicContact CE2-CE1 3.11Å; F782-F799 AromaticContact CE2-CE2 3.46Å; F782-F799 HydrophobicContact CE2-CE2 3.46Å; F782-F799 VanDerWaalsContact CE2-CE2 3.46Å; F782-F799 HydrophobicContact CE2-CG 4.3Å; F782-F799 AromaticContact CE2-CZ 2.94Å; F782-F799 HydrophobicContact CE2-CZ 2.94Å; F782-F799 AromaticContact CG-CE1 3.98Å; F782-F799 HydrophobicContact CG-CE1 3.98Å; F782-F799 HydrophobicContact CG-CZ 4.32Å; F782-F799 HydrophobicContact CZ-CE1 4.17Å; F782-F799 HydrophobicContact CZ-CE2 4.09Å; F782-F799 AromaticContact CZ-CZ 3.63Å; F782-F799 HydrophobicContact CZ-CZ 3.63Å
783	V	39.3	Very low	40.1	Very low	34 Å²	34	94.7 Å²	94.7	21%	0.206	51%	0.514	C	S	.	.	G	3₁₀ helix	trans	-96	-19.6	-168	-150.4	0	0	0	0	115.4	T270 R785 A786	T270-V783 HydrophobicContact CG2-CB 3.28Å; T270-V783 HydrophobicContact CG2-CG1 3.03Å; T270-V783 HydrophobicContact CG2-CG2 4.26Å; V783-R785 PolarHBondContact O-N 2.92Å; V783-A786 PolarHBondContact O-N 3.46Å
784	N	36	Very low	38.9	Very low	29 Å²	29	100.9 Å²	100.9	16%	0.155	53%	0.528	C	S	.	.	G	3₁₀ helix	trans	-62.5	-6.2	169.7	-70.5	-6.9	0	0	0	113.8	T259 W266	T259-N784 HydrophobicContact CG2-CB 4.4Å; W266-N784 WeakPolarHBondContact CB-OD1 3.33Å
785	R	39.4	Very low	37.9	Very low	84 Å²	84	105.7 Å²	105.7	32%	0.317	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-102.3	-20.9	-173.7	-118.9	179.9	-66.8	177.7	1.5	114.4	K781 V783	K781-R785 PolarHBondContact O-NE 3.42Å; K781-R785 PolarHBondContact O-NH2 3.38Å; V783-R785 PolarHBondContact O-N 2.92Å
786	A	38.8	Very low	37.1	Very low	66 Å²	66	104.5 Å²	104.5	55%	0.545	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-30	-176.2	0	0	0	0	0	113.3	V783 Q788 T789	V783-A786 PolarHBondContact O-N 3.46Å; A786-Q788 PolarHBondContact O-N 2.86Å; A786-T789 PolarHBondContact O-OG1 3.37Å
787	V	40.9	Very low	36.6	Very low	89 Å²	89	105.7 Å²	105.7	54%	0.539	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-14.8	-174.1	-179	0	0	0	0	112.9	W266	W266-V787 HydrophobicContact CH2-CB 3.96Å; W266-V787 HydrophobicContact CH2-CG1 3.65Å; W266-V787 HydrophobicContact CZ3-CB 3.73Å; W266-V787 HydrophobicContact CZ3-CG1 3.72Å; W266-V787 HydrophobicContact CZ3-CG2 3.86Å
788	Q	37.2	Very low	36.4	Very low	157 Å²	157	106 Å²	106	73%	0.734	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-1.6	-176.7	-155.5	135.5	22.8	0	0	114.2	A786	A786-Q788 PolarHBondContact O-N 2.86Å
789	T	33.4	Very low	36.2	Very low	98 Å²	98	98.4 Å²	98.4	60%	0.601	51%	0.509	S	S	*	.			trans	-101.9	19.3	-174.4	50	0	0	0	0	114.1	A786 E791	A786-T789 PolarHBondContact O-OG1 3.37Å; T789-E791 VanDerWaalsContact C-N 3.3Å; T789-E791 PolarHBondContact O-N 3.42Å
790	H	38.7	Very low	37.1	Very low	162 Å²	162	98.2 Å²	98.2	75%	0.75	50%	0.503	S	S	*	.	S	Bend	trans	-84.4	3.9	-176.3	-145	-83.6	0	0	0	114.7
791	E	42.3	Very low	37.6	Very low	184 Å²	184	99.4 Å²	99.4	86%	0.86	51%	0.511	S	S	*	.	S	Bend	trans	-127.1	-2.9	-168.7	-139.8	168.2	-165.7	0	0	116.4	T789	T789-E791 VanDerWaalsContact C-N 3.3Å; T789-E791 PolarHBondContact O-N 3.42Å
792	Q	26.3	Very low	38.5	Very low	185 Å²	185	97.4 Å²	97.4	86%	0.864	51%	0.509	S	S	*	.	S	Bend	trans	-143.1	115.5	169.6	-84.4	-175.6	-25.4	0	0	111.2
793	G	27.3	Very low	40.1	Very low	80 Å²	80	97.9 Å²	97.9	83%	0.825	51%	0.513	S	S	*	.			trans	-59.9	152.5	-175.5	0	0	0	0	0	115
794	R	32.1	Very low	41.9	Very low	176 Å²	176	101 Å²	101	66%	0.664	52%	0.524	S	S	*	.			trans	75.9	40.5	157.4	-141.3	-172.6	-74.3	-164.3	-6.1	118	C99	C99-R794 PolarHBondContact O-NH2 2.71Å
795	Q	29.6	Very low	44	Very low	189 Å²	189	101 Å²	101	88%	0.883	52%	0.522	S	S	*	.			trans	-125.1	83.8	152.3	-80.7	-173.9	11.3	0	0	110.2	I797	Q795-I797 PolarHBondContact O-N 2.87Å
796	L	34.2	Very low	46.3	Very low	86 Å²	86	97 Å²	97	45%	0.45	51%	0.507	S	S	.	.			trans	-65.1	97.2	174.9	-156.4	140.5	0	0	0	108.8	E113 H798	E113-L796 WeakPolarHBondContact OE1-CD2 3.34Å; L796-H798 PolarHBondContact O-N 2.72Å
797	I	34.8	Very low	48.4	Very low	99 Å²	99	97.3 Å²	97.3	51%	0.508	50%	0.502	S	S	.	.			trans	53.3	65.4	142.3	-48.7	171.9	0	0	0	113.7	Q795 F799	Q795-I797 PolarHBondContact O-N 2.87Å; I797-F799 VanDerWaalsContact C-N 3.25Å; I797-F799 HydrophobicContact CG2-CD2 3.1Å; I797-F799 HydrophobicContact CG2-CE2 3.09Å; I797-F799 HydrophobicContact CG2-CG 4.07Å; I797-F799 HydrophobicContact CG2-CZ 4.06Å; I797-F799 PolarHBondContact O-N 2.81Å; I797-F799 VanDerWaalsContact O-N 3.11Å
798	H	37.2	Very low	50.4	Low	107 Å²	107	93.7 Å²	93.7	50%	0.495	48%	0.479	S	S	.	.			trans	-82.5	76.3	160.9	-100.2	-61.6	0	0	0	109.7	L796 R800	L796-H798 PolarHBondContact O-N 2.72Å; H798-R800 PolarHBondContact O-N 3.34Å
799	F	40	Very low	52.9	Low	35 Å²	35	86.3 Å²	86.3	15%	0.154	45%	0.445	C	S	.	.			trans	-57.4	104	164.6	-86.5	-62.5	0	0	0	109.5	E120 I132 F782 I797	E120-F799 WeakPolarHBondContact OE1-CD2 3.24Å; E120-F799 WeakPolarHBondContact OE1-CE2 3.36Å; I132-F799 HydrophobicContact CD1-CB 4.27Å; F782-F799 AromaticContact CD2-CD1 3.68Å; F782-F799 HydrophobicContact CD2-CD1 3.68Å; F782-F799 AromaticContact CD2-CE1 3Å; F782-F799 HydrophobicContact CD2-CE1 3Å; F782-F799 HydrophobicContact CD2-CE2 4.26Å; F782-F799 AromaticContact CD2-CZ 3.39Å; F782-F799 HydrophobicContact CD2-CZ 3.39Å; F782-F799 AromaticContact CE2-CD1 3.79Å; F782-F799 HydrophobicContact CE2-CD1 3.79Å; F782-F799 HydrophobicContact CE2-CD2 4.12Å; F782-F799 AromaticContact CE2-CE1 3.11Å; F782-F799 HydrophobicContact CE2-CE1 3.11Å; F782-F799 AromaticContact CE2-CE2 3.46Å; F782-F799 HydrophobicContact CE2-CE2 3.46Å; F782-F799 VanDerWaalsContact CE2-CE2 3.46Å; F782-F799 HydrophobicContact CE2-CG 4.3Å; F782-F799 AromaticContact CE2-CZ 2.94Å; F782-F799 HydrophobicContact CE2-CZ 2.94Å; F782-F799 AromaticContact CG-CE1 3.98Å; F782-F799 HydrophobicContact CG-CE1 3.98Å; F782-F799 HydrophobicContact CG-CZ 4.32Å; F782-F799 HydrophobicContact CZ-CE1 4.17Å; F782-F799 HydrophobicContact CZ-CE2 4.09Å; F782-F799 AromaticContact CZ-CZ 3.63Å; F782-F799 HydrophobicContact CZ-CZ 3.63Å; I797-F799 VanDerWaalsContact C-N 3.25Å; I797-F799 HydrophobicContact CG2-CD2 3.1Å; I797-F799 HydrophobicContact CG2-CE2 3.09Å; I797-F799 HydrophobicContact CG2-CG 4.07Å; I797-F799 HydrophobicContact CG2-CZ 4.06Å; I797-F799 PolarHBondContact O-N 2.81Å; I797-F799 VanDerWaalsContact O-N 3.11Å
800	R	49	Very low	55.5	Low	23 Å²	23	83 Å²	83	9%	0.087	42%	0.424	C	S	.	.			trans	-145.2	92.5	171.7	-130.4	153.6	162.3	177.3	-23.4	114.6	I132 W136 H798 Y806	I132-R800 PolarHBondContact O-NH1 3.11Å; W136-R800 VanDerWaalsContact CB-NH1 3.29Å; H798-R800 PolarHBondContact O-N 3.34Å; R800-Y806 WeakPolarHBondContact CD-OH 3.45Å; R800-Y806 VanDerWaalsContact NE-CZ 3.27Å; R800-Y806 PolarHBondContact NE-OH 3.36Å; R800-Y806 PolarHBondContact NH2-OH 3.1Å
801	S	51.6	Low	57.7	Low	77 Å²	77	78.6 Å²	78.6	54%	0.538	41%	0.405	S	S	.	.			trans	-104.4	128.5	150.3	167.1	0	0	0	0	104.5
802	S	62.8	Low	59.8	Low	52 Å²	52	70.1 Å²	70.1	36%	0.364	37%	0.365	S	S	.	.			cis	-133.7	148.2	26.2	176	0	0	0	0	110.8	F804	S802-F804 PolarHBondContact O-N 2.99Å; S802-F804 VanDerWaalsContact OG-CB 3.29Å; S802-F804 WeakPolarHBondContact OG-CB 3.12Å; S802-F804 PolarHBondContact OG-N 3.37Å
803	N	71.9	Confident	62.8	Low	43 Å²	43	61.7 Å²	61.7	23%	0.23	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-18.5	171.7	-74.9	-56.9	0	0	0	113	M245 N248 Y805 Y806 V807	M245-N803 PolarHBondContact O-OD1 2.82Å; N248-N803 WeakPolarHBondContact CB-OD1 3.29Å; N803-Y805 VanDerWaalsContact C-N 3.35Å; N803-Y805 PolarHBondContact O-N 3.19Å; N803-Y806 PolarHBondContact O-N 3.2Å; N803-Y806 VanDerWaalsContact O-N 3.15Å; N803-V807 WeakPolarHBondContact O-CG2 3.45Å; N803-V807 PolarHBondContact O-N 3.18Å; N803-V807 VanDerWaalsContact O-N 3.09Å
804	F	75.6	Confident	65.6	Low	100 Å²	100	62.9 Å²	62.9	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-47.6	-49.5	178.2	179.5	-106.2	0	0	0	113.8	S802 Y806 V807 L808	S802-F804 PolarHBondContact O-N 2.99Å; S802-F804 VanDerWaalsContact OG-CB 3.29Å; S802-F804 WeakPolarHBondContact OG-CB 3.12Å; S802-F804 PolarHBondContact OG-N 3.37Å; F804-Y806 VanDerWaalsContact C-N 3.27Å; F804-Y806 PolarHBondContact O-N 3.09Å; F804-V807 PolarHBondContact O-N 3.37Å; F804-L808 HydrophobicContact CE1-CD2 4.45Å; F804-L808 WeakPolarHBondContact O-CB 3.39Å; F804-L808 PolarHBondContact O-N 3.21Å
805	Y	82.1	Confident	68	Low	29 Å²	29	57.2 Å²	57.2	11%	0.114	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-34.2	-176.6	-55.6	-41.2	0	0	0	113	V723 V727 N803 L809	V723-Y805 WeakPolarHBondContact CG1-OH 3.32Å; V727-Y805 HydrophobicContact CB-CD1 4.22Å; V727-Y805 HydrophobicContact CB-CE1 4.13Å; V727-Y805 HydrophobicContact CG1-CD1 3.5Å; V727-Y805 VanDerWaalsContact CG1-CD1 3.5Å; V727-Y805 HydrophobicContact CG1-CE1 3.94Å; V727-Y805 HydrophobicContact CG1-CG 3.86Å; V727-Y805 HydrophobicContact CG2-CD1 4.35Å; V727-Y805 HydrophobicContact CG2-CE1 4.07Å; V727-Y805 HydrophobicContact CG2-CE2 4.32Å; N803-Y805 VanDerWaalsContact C-N 3.35Å; N803-Y805 PolarHBondContact O-N 3.19Å; Y805-L809 WeakPolarHBondContact O-CB 2.83Å; Y805-L809 PolarHBondContact O-N 3.06Å
806	Y	86	Confident	70.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-79.1	-32.8	178.5	-56.6	-82.9	0	0	0	112.8	W136 K244 N248 R800 N803 F804 L808 L809 L810	W136-Y806 HydrophobicContact CD2-CE1 4.31Å; W136-Y806 HydrophobicContact CE3-CE1 4.06Å; W136-Y806 HydrophobicContact CH2-CD1 4.04Å; W136-Y806 AromaticContact CH2-CE1 3.97Å; W136-Y806 HydrophobicContact CH2-CE1 3.97Å; W136-Y806 HydrophobicContact CZ2-CE1 4.22Å; W136-Y806 HydrophobicContact CZ3-CD1 4.04Å; W136-Y806 AromaticContact CZ3-CE1 3.9Å; W136-Y806 HydrophobicContact CZ3-CE1 3.9Å; K244-Y806 HydrophobicContact CB-CE1 4.02Å; K244-Y806 VanDerWaalsContact CE-OH 3.24Å; K244-Y806 WeakPolarHBondContact CE-OH 3.18Å; K244-Y806 HydrophobicContact CG-CD1 4.33Å; K244-Y806 HydrophobicContact CG-CE1 3.41Å; K244-Y806 VanDerWaalsContact CG-CE1 3.41Å; K244-Y806 VanDerWaalsContact CG-CZ 3.49Å; K244-Y806 WeakPolarHBondContact CG-OH 3.48Å; N248-Y806 WeakPolarHBondContact ND2-CE2 3.27Å; N248-Y806 PolarHBondContact ND2-OH 3.46Å; R800-Y806 WeakPolarHBondContact CD-OH 3.45Å; R800-Y806 VanDerWaalsContact NE-CZ 3.27Å; R800-Y806 PolarHBondContact NE-OH 3.36Å; R800-Y806 PolarHBondContact NH2-OH 3.1Å; N803-Y806 PolarHBondContact O-N 3.2Å; N803-Y806 VanDerWaalsContact O-N 3.15Å; F804-Y806 VanDerWaalsContact C-N 3.27Å; F804-Y806 PolarHBondContact O-N 3.09Å; Y806-L808 VanDerWaalsContact C-N 3.29Å; Y806-L809 PolarHBondContact O-N 3.48Å; Y806-L810 VanDerWaalsContact O-CB 3.29Å; Y806-L810 WeakPolarHBondContact O-CB 3.27Å; Y806-L810 PolarHBondContact O-N 2.7Å
807	V	83.1	Confident	72.8	Confident	73 Å²	73	46.9 Å²	46.9	44%	0.442	24%	0.244	S	C	.	.	H	α-helix	trans	-63.2	-44.6	173.5	172.3	0	0	0	0	109.2	M245 N803 F804 L810 L811	M245-V807 HydrophobicContact CE-CB 4.26Å; M245-V807 HydrophobicContact CE-CG2 3.64Å; M245-V807 HydrophobicContact SD-CG2 3.94Å; N803-V807 WeakPolarHBondContact O-CG2 3.45Å; N803-V807 PolarHBondContact O-N 3.18Å; N803-V807 VanDerWaalsContact O-N 3.09Å; F804-V807 PolarHBondContact O-N 3.37Å; V807-L810 PolarHBondContact O-N 2.86Å; V807-L811 PolarHBondContact O-N 3.43Å
808	L	84.4	Confident	74.9	Confident	12 Å²	12	48.3 Å²	48.3	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-45.4	175.6	175	54.9	0	0	0	112.4	L428 F432 L728 I731 F804 Y806 L810 L811 I812	L428-L808 HydrophobicContact CD1-CD1 3.08Å; L428-L808 HydrophobicContact CD1-CD2 4.31Å; L428-L808 HydrophobicContact CD1-CG 4.29Å; F432-L808 HydrophobicContact CZ-CD1 4.34Å; L728-L808 HydrophobicContact CD1-CD1 4.33Å; L728-L808 HydrophobicContact CD1-CD2 3.57Å; L728-L808 HydrophobicContact CD1-CG 4.4Å; I731-L808 HydrophobicContact CD1-CB 4.16Å; I731-L808 HydrophobicContact CD1-CD2 3.48Å; I731-L808 VanDerWaalsContact CD1-CD2 3.48Å; I731-L808 HydrophobicContact CD1-CG 3.67Å; I731-L808 HydrophobicContact CG2-CG 4.19Å; F804-L808 HydrophobicContact CE1-CD2 4.45Å; F804-L808 WeakPolarHBondContact O-CB 3.39Å; F804-L808 PolarHBondContact O-N 3.21Å; Y806-L808 VanDerWaalsContact C-N 3.29Å; L808-L810 VanDerWaalsContact C-N 3.3Å; L808-L810 PolarHBondContact O-N 3.42Å; L808-L811 WeakPolarHBondContact O-CB 3.44Å; L808-L811 PolarHBondContact O-N 3.19Å; L808-I812 PolarHBondContact O-N 2.88Å; L808-I812 VanDerWaalsContact O-N 3.07Å
809	L	88.6	Confident	76.7	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-37.4	176.2	-175.5	66.6	0	0	0	112.8	W136 I241 I731 Q734 W738 Y805 Y806 I812 M813	W136-L809 HydrophobicContact CH2-CD2 4.25Å; W136-L809 HydrophobicContact CZ3-CD2 3.68Å; I241-L809 HydrophobicContact CD1-CD2 3.96Å; I241-L809 HydrophobicContact CD1-CG 4Å; I241-L809 HydrophobicContact CG1-CD2 3.84Å; I241-L809 HydrophobicContact CG1-CG 4.38Å; I731-L809 HydrophobicContact CG1-CD1 4.33Å; I731-L809 HydrophobicContact CG2-CD1 4.14Å; Q734-L809 HydrophobicContact CB-CD1 4.05Å; Q734-L809 HydrophobicContact CG-CD1 3.85Å; W738-L809 HydrophobicContact CH2-CD1 3.66Å; W738-L809 HydrophobicContact CH2-CG 3.85Å; W738-L809 HydrophobicContact CZ3-CD1 4.04Å; W738-L809 HydrophobicContact CZ3-CG 4.46Å; Y805-L809 WeakPolarHBondContact O-CB 2.83Å; Y805-L809 PolarHBondContact O-N 3.06Å; Y806-L809 PolarHBondContact O-N 3.48Å; L809-I812 HydrophobicContact CD1-CG2 4.37Å; L809-I812 VanDerWaalsContact O-CG2 3.29Å; L809-I812 WeakPolarHBondContact O-CG2 3.49Å; L809-M813 PolarHBondContact O-N 3.19Å; L809-M813 VanDerWaalsContact O-N 3.12Å
810	L	88.7	Confident	78.4	Confident	30 Å²	30	42.9 Å²	42.9	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-69.9	-37.6	176.4	-178.3	156.8	0	0	0	111.7	F238 I241 L242 M245 Y806 V807 L808 M813 F814	F238-L810 HydrophobicContact CE2-CD1 4.33Å; I241-L810 HydrophobicContact CG2-CB 4.02Å; I241-L810 HydrophobicContact CG2-CD1 4.46Å; L242-L810 HydrophobicContact CD2-CD1 3.61Å; L242-L810 HydrophobicContact CG-CD1 4.27Å; M245-L810 HydrophobicContact CE-CB 4.44Å; M245-L810 HydrophobicContact CE-CD1 3.99Å; Y806-L810 VanDerWaalsContact O-CB 3.29Å; Y806-L810 WeakPolarHBondContact O-CB 3.27Å; Y806-L810 PolarHBondContact O-N 2.7Å; V807-L810 PolarHBondContact O-N 2.86Å; L808-L810 VanDerWaalsContact C-N 3.3Å; L808-L810 PolarHBondContact O-N 3.42Å; L810-M813 WeakPolarHBondContact O-CB 3.2Å; L810-M813 PolarHBondContact O-N 3.32Å; L810-F814 HydrophobicContact CD2-CD2 3.64Å; L810-F814 HydrophobicContact CD2-CE2 3.34Å; L810-F814 HydrophobicContact CD2-CZ 4.5Å; L810-F814 HydrophobicContact CG-CD2 4.45Å; L810-F814 HydrophobicContact CG-CE2 4.11Å; L810-F814 WeakPolarHBondContact O-CD2 3.3Å; L810-F814 PolarHBondContact O-N 3.23Å
811	L	85.4	Confident	79.9	Confident	69 Å²	69	43.4 Å²	43.4	36%	0.361	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-49.4	175.6	-166.7	173.7	0	0	0	110.6	F432 V807 L808 M813 F814 I815	F432-L811 HydrophobicContact CE1-CD2 3.76Å; F432-L811 HydrophobicContact CE2-CD1 4.37Å; F432-L811 HydrophobicContact CE2-CD2 3.96Å; F432-L811 HydrophobicContact CZ-CD1 4.23Å; F432-L811 HydrophobicContact CZ-CD2 3.3Å; F432-L811 HydrophobicContact CZ-CG 4.29Å; V807-L811 PolarHBondContact O-N 3.43Å; L808-L811 WeakPolarHBondContact O-CB 3.44Å; L808-L811 PolarHBondContact O-N 3.19Å; L811-M813 VanDerWaalsContact C-N 3.29Å; L811-M813 PolarHBondContact O-N 2.81Å; L811-F814 PolarHBondContact O-N 3.29Å; L811-I815 HydrophobicContact CD2-CD1 3.27Å; L811-I815 HydrophobicContact CD2-CG1 3.91Å; L811-I815 PolarHBondContact O-N 2.82Å; L811-I815 VanDerWaalsContact O-N 3.14Å
812	I	85.7	Confident	81.2	Confident	5 Å²	5	43.5 Å²	43.5	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-34.8	179.8	-159.7	147.6	0	0	0	111.9	F432 I731 W738 L808 L809 F814 I815 C816	F432-I812 HydrophobicContact CE1-CB 4.26Å; F432-I812 HydrophobicContact CE1-CD1 4.04Å; F432-I812 HydrophobicContact CE1-CG1 4.17Å; I731-I812 HydrophobicContact CG2-CB 4.35Å; I731-I812 HydrophobicContact CG2-CD1 4.46Å; I731-I812 HydrophobicContact CG2-CG2 3.61Å; W738-I812 HydrophobicContact CZ3-CG2 4.01Å; L808-I812 PolarHBondContact O-N 2.88Å; L808-I812 VanDerWaalsContact O-N 3.07Å; L809-I812 HydrophobicContact CD1-CG2 4.37Å; L809-I812 VanDerWaalsContact O-CG2 3.29Å; L809-I812 WeakPolarHBondContact O-CG2 3.49Å; I812-F814 VanDerWaalsContact C-N 3.32Å; I812-F814 PolarHBondContact O-N 3.02Å; I812-I815 PolarHBondContact O-N 3.48Å; I812-I815 VanDerWaalsContact O-N 3.15Å; I812-C816 PolarHBondContact O-N 3.46Å; I812-C816 PolarHBondContact O-SG 2.81Å
813	M	88	Confident	81.7	Confident	9 Å²	9	41.6 Å²	41.6	4%	0.044	22%	0.218	C	C	.	.	H	α-helix	trans	-55.3	-47.2	173.8	-163.6	-158	73.1	0	0	111.7	F238 I241 W738 L809 L810 L811 C816 V817	F238-M813 HydrophobicContact CB-CE 3.89Å; F238-M813 HydrophobicContact CB-SD 3.69Å; F238-M813 HydrophobicContact CD2-CE 3.36Å; F238-M813 HydrophobicContact CD2-SD 3.99Å; F238-M813 HydrophobicContact CE2-CE 4.18Å; F238-M813 HydrophobicContact CG-CE 3.98Å; F238-M813 HydrophobicContact CG-SD 4.33Å; I241-M813 HydrophobicContact CD1-SD 4.25Å; W738-M813 HydrophobicContact CD2-CG 4.29Å; W738-M813 HydrophobicContact CE3-CB 3.81Å; W738-M813 HydrophobicContact CE3-CG 3.8Å; W738-M813 HydrophobicContact CH2-CB 3.86Å; W738-M813 HydrophobicContact CH2-CG 3.91Å; W738-M813 HydrophobicContact CZ2-CG 4.4Å; W738-M813 VanDerWaalsContact CZ3-CA 3.45Å; W738-M813 HydrophobicContact CZ3-CB 3.3Å; W738-M813 HydrophobicContact CZ3-CG 3.6Å; L809-M813 PolarHBondContact O-N 3.19Å; L809-M813 VanDerWaalsContact O-N 3.12Å; L810-M813 WeakPolarHBondContact O-CB 3.2Å; L810-M813 PolarHBondContact O-N 3.32Å; L811-M813 VanDerWaalsContact C-N 3.29Å; L811-M813 PolarHBondContact O-N 2.81Å; M813-C816 PolarHBondContact O-N 2.84Å; M813-V817 VanDerWaalsContact O-CG2 3.25Å; M813-V817 WeakPolarHBondContact O-CG2 3.38Å; M813-V817 PolarHBondContact O-N 2.94Å
814	F	86.5	Confident	82	Confident	105 Å²	105	41 Å²	41	46%	0.461	21%	0.214	S	C	.	.	H	α-helix	trans	-64.2	-41.3	177.2	-77.8	-57.8	0	0	0	112.5	F238 L810 L811 I812 C816 V817 L818	F238-F814 HydrophobicContact CD2-CZ 4.46Å; F238-F814 HydrophobicContact CE2-CE1 4.46Å; F238-F814 HydrophobicContact CE2-CE2 4.28Å; F238-F814 AromaticContact CE2-CZ 3.7Å; F238-F814 HydrophobicContact CE2-CZ 3.7Å; F238-F814 HydrophobicContact CZ-CZ 4.32Å; L810-F814 HydrophobicContact CD2-CD2 3.64Å; L810-F814 HydrophobicContact CD2-CE2 3.34Å; L810-F814 HydrophobicContact CD2-CZ 4.5Å; L810-F814 HydrophobicContact CG-CD2 4.45Å; L810-F814 HydrophobicContact CG-CE2 4.11Å; L810-F814 WeakPolarHBondContact O-CD2 3.3Å; L810-F814 PolarHBondContact O-N 3.23Å; L811-F814 PolarHBondContact O-N 3.29Å; I812-F814 VanDerWaalsContact C-N 3.32Å; I812-F814 PolarHBondContact O-N 3.02Å; F814-C816 VanDerWaalsContact C-N 3.3Å; F814-C816 PolarHBondContact O-N 3.45Å; F814-V817 PolarHBondContact O-N 3.3Å; F814-L818 WeakPolarHBondContact O-CG 3.33Å; F814-L818 PolarHBondContact O-N 3.48Å
815	I	82.4	Confident	82.2	Confident	56 Å²	56	38.9 Å²	38.9	29%	0.287	22%	0.216	S	C	.	.	H	α-helix	trans	-63.6	-36.7	177.3	-68.1	179	0	0	0	111.2	F432 F435 L811 I812 P819	F432-I815 HydrophobicContact CD1-CD1 3.54Å; F432-I815 HydrophobicContact CE1-CD1 3.5Å; F432-I815 VanDerWaalsContact CE1-CD1 3.5Å; F432-I815 HydrophobicContact CG-CD1 4.23Å; F432-I815 HydrophobicContact CZ-CD1 4.1Å; F435-I815 HydrophobicContact CD1-CG2 3.89Å; F435-I815 HydrophobicContact CE1-CG2 3.89Å; L811-I815 HydrophobicContact CD2-CD1 3.27Å; L811-I815 HydrophobicContact CD2-CG1 3.91Å; L811-I815 PolarHBondContact O-N 2.82Å; L811-I815 VanDerWaalsContact O-N 3.14Å; I812-I815 PolarHBondContact O-N 3.48Å; I812-I815 VanDerWaalsContact O-N 3.15Å; I815-P819 WeakPolarHBondContact O-CD 3.34Å
816	C	82.1	Confident	81.6	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-73.3	-32.4	177.5	-60.5	0	0	0	0	113.5	F435 G735 W738 I812 M813 F814 L818 P819 V820	F435-C816 HydrophobicContact CZ-CB 4.27Å; F435-C816 WeakPolarHBondContact CZ-SG 3.25Å; G735-C816 VanDerWaalsContact C-SG 3.58Å; G735-C816 WeakPolarHBondContact CA-SG 3.23Å; G735-C816 PolarHBondContact O-SG 3.28Å; W738-C816 HydrophobicContact CB-CB 4.24Å; I812-C816 PolarHBondContact O-N 3.46Å; I812-C816 PolarHBondContact O-SG 2.81Å; M813-C816 PolarHBondContact O-N 2.84Å; F814-C816 VanDerWaalsContact C-N 3.3Å; F814-C816 PolarHBondContact O-N 3.45Å; C816-L818 VanDerWaalsContact C-N 3.31Å; C816-L818 PolarHBondContact O-N 3.43Å; C816-P819 WeakPolarHBondContact O-CD 3.46Å; C816-V820 WeakPolarHBondContact O-CG2 3.37Å
817	V	82.7	Confident	80.8	Confident	57 Å²	57	42.6 Å²	42.6	35%	0.345	24%	0.24	S	C	.	.	H	α-helix	trans	-69	-30.5	179.1	169.5	0	0	0	0	111.7	L234 M813 F814 V820 G821	L234-V817 HydrophobicContact CD2-CG2 4.49Å; M813-V817 VanDerWaalsContact O-CG2 3.25Å; M813-V817 WeakPolarHBondContact O-CG2 3.38Å; M813-V817 PolarHBondContact O-N 2.94Å; F814-V817 PolarHBondContact O-N 3.3Å; V817-V820 PolarHBondContact O-N 3.15Å; V817-G821 PolarHBondContact O-N 2.8Å
818	L	79.2	Confident	80.2	Confident	129 Å²	129	46.3 Å²	46.3	68%	0.675	25%	0.252	S	S	*	.	H	α-helix	trans	-61.3	-53.4	-178.9	-70.9	173.3	0	0	0	113	F814 C816 G821 Y822	F814-L818 WeakPolarHBondContact O-CG 3.33Å; F814-L818 PolarHBondContact O-N 3.48Å; C816-L818 VanDerWaalsContact C-N 3.31Å; C816-L818 PolarHBondContact O-N 3.43Å; L818-G821 PolarHBondContact O-N 2.81Å; L818-Y822 WeakPolarHBondContact O-CB 3.22Å; L818-Y822 PolarHBondContact O-N 2.73Å
819	P	74.1	Confident	79.7	Confident	21 Å²	21	46.4 Å²	46.4	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-46.4	174.1	-25.5	31.8	0	0	0	113.6	I439 F443 L739 I815 C816 G821 Y822 V823	I439-P819 HydrophobicContact CD1-CB 4.45Å; I439-P819 HydrophobicContact CD1-CG 3.63Å; I439-P819 HydrophobicContact CG1-CG 4.41Å; I439-P819 HydrophobicContact CG2-CB 4.02Å; I439-P819 HydrophobicContact CG2-CG 4.01Å; F443-P819 HydrophobicContact CE2-CB 4.18Å; L739-P819 HydrophobicContact CD1-CB 4.47Å; I815-P819 WeakPolarHBondContact O-CD 3.34Å; C816-P819 WeakPolarHBondContact O-CD 3.46Å; P819-G821 VanDerWaalsContact C-N 3.35Å; P819-G821 PolarHBondContact O-N 3.26Å; P819-Y822 WeakPolarHBondContact O-CB 3.33Å; P819-Y822 PolarHBondContact O-N 3.08Å; P819-Y822 VanDerWaalsContact O-N 3.14Å; P819-V823 WeakPolarHBondContact O-CG2 3.39Å; P819-V823 PolarHBondContact O-N 3.02Å
820	V	76.5	Confident	78.6	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-44.6	-178.4	176.3	0	0	0	0	110.3	F742 C816 V817 Y822 V823 I824	F742-V820 HydrophobicContact CB-CG1 3.87Å; F742-V820 HydrophobicContact CG-CG1 4.13Å; C816-V820 WeakPolarHBondContact O-CG2 3.37Å; V817-V820 PolarHBondContact O-N 3.15Å; V820-Y822 VanDerWaalsContact C-N 3.3Å; V820-Y822 PolarHBondContact O-N 2.75Å; V820-V823 PolarHBondContact O-N 3.13Å; V820-I824 HydrophobicContact CG1-CD1 3.83Å; V820-I824 VanDerWaalsContact O-CG1 3.27Å; V820-I824 WeakPolarHBondContact O-CG1 3.14Å; V820-I824 PolarHBondContact O-N 3.24Å
821	G	81	Confident	77.5	Confident	35 Å²	35	50.5 Å²	50.5	36%	0.361	29%	0.285	S	S	.	.	H	α-helix	trans	-61.7	-37.1	174.1	0	0	0	0	0	112.8	V817 L818 P819 I824 A825	V817-G821 PolarHBondContact O-N 2.8Å; L818-G821 PolarHBondContact O-N 2.81Å; P819-G821 VanDerWaalsContact C-N 3.35Å; P819-G821 PolarHBondContact O-N 3.26Å; G821-I824 PolarHBondContact O-N 3.25Å; G821-A825 VanDerWaalsContact O-CB 3.32Å; G821-A825 WeakPolarHBondContact O-CB 3.33Å; G821-A825 PolarHBondContact O-N 2.69Å; G821-A825 VanDerWaalsContact O-N 3.08Å
822	Y	78.3	Confident	76.4	Confident	79 Å²	79	50.4 Å²	50.4	31%	0.31	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-43.3	175.2	178.2	-100.1	0	0	0	112.5	F443 F529 L818 P819 V820 A825 S826	F443-Y822 AromaticContact CE1-CD1 3.95Å; F443-Y822 HydrophobicContact CE1-CD1 3.95Å; F443-Y822 HydrophobicContact CE1-CE1 4.18Å; F443-Y822 AromaticContact CZ-CD1 3.99Å; F443-Y822 HydrophobicContact CZ-CD1 3.99Å; F529-Y822 HydrophobicContact CE2-CE2 4.32Å; F529-Y822 HydrophobicContact CZ-CE2 4.43Å; L818-Y822 WeakPolarHBondContact O-CB 3.22Å; L818-Y822 PolarHBondContact O-N 2.73Å; P819-Y822 WeakPolarHBondContact O-CB 3.33Å; P819-Y822 PolarHBondContact O-N 3.08Å; P819-Y822 VanDerWaalsContact O-N 3.14Å; V820-Y822 VanDerWaalsContact C-N 3.3Å; V820-Y822 PolarHBondContact O-N 2.75Å; Y822-A825 PolarHBondContact O-N 3.48Å; Y822-S826 WeakPolarHBondContact CD2-OG 3.36Å; Y822-S826 WeakPolarHBondContact CE2-OG 3.44Å; Y822-S826 VanDerWaalsContact O-CB 3.28Å; Y822-S826 WeakPolarHBondContact O-CB 3.27Å; Y822-S826 PolarHBondContact O-N 2.72Å; Y822-S826 PolarHBondContact O-OG 2.9Å
823	V	74.2	Confident	75.6	Confident	11 Å²	11	50.4 Å²	50.4	7%	0.067	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-49.9	175	-177	0	0	0	0	110.5	F443 F743 P819 V820 A825 S826 K827 F842	F443-V823 HydrophobicContact CE1-CG2 3.53Å; F443-V823 HydrophobicContact CZ-CG2 3.38Å; F743-V823 HydrophobicContact CE1-CG1 4.1Å; F743-V823 HydrophobicContact CZ-CB 4.15Å; F743-V823 HydrophobicContact CZ-CG1 3.82Å; F743-V823 HydrophobicContact CZ-CG2 4.13Å; P819-V823 WeakPolarHBondContact O-CG2 3.39Å; P819-V823 PolarHBondContact O-N 3.02Å; V820-V823 PolarHBondContact O-N 3.13Å; V823-A825 PolarHBondContact O-N 3.15Å; V823-S826 PolarHBondContact O-N 3.22Å; V823-K827 HydrophobicContact CG1-CB 4.1Å; V823-K827 HydrophobicContact CG1-CG 4.47Å; V823-K827 PolarHBondContact O-N 3.32Å; V823-K827 VanDerWaalsContact O-N 3.08Å; V823-F842 HydrophobicContact CG1-CE2 4.05Å
824	I	78.5	Confident	75.1	Confident	30 Å²	30	50.1 Å²	50.1	15%	0.154	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-34.3	-177.7	-69.3	168.8	0	0	0	111.7	F227 F742 V820 G821 F842	F227-I824 HydrophobicContact CE2-CG2 3.94Å; F742-I824 HydrophobicContact CD1-CD1 4.42Å; F742-I824 HydrophobicContact CD1-CG1 4.35Å; F742-I824 HydrophobicContact CD2-CD1 4.01Å; F742-I824 HydrophobicContact CE1-CD1 4.23Å; F742-I824 HydrophobicContact CE1-CG1 3.83Å; F742-I824 HydrophobicContact CE2-CD1 3.78Å; F742-I824 HydrophobicContact CE2-CG1 4.14Å; F742-I824 HydrophobicContact CG-CD1 4.32Å; F742-I824 HydrophobicContact CZ-CD1 3.9Å; F742-I824 HydrophobicContact CZ-CG1 3.72Å; V820-I824 HydrophobicContact CG1-CD1 3.83Å; V820-I824 VanDerWaalsContact O-CG1 3.27Å; V820-I824 WeakPolarHBondContact O-CG1 3.14Å; V820-I824 PolarHBondContact O-N 3.24Å; G821-I824 PolarHBondContact O-N 3.25Å; I824-F842 HydrophobicContact CB-CB 4.41Å; I824-F842 HydrophobicContact CG2-CB 4Å
825	A	78.3	Confident	74.8	Confident	57 Å²	57	45.2 Å²	45.2	47%	0.471	27%	0.265	S	S	.	.	H	α-helix	trans	-90.1	-29.7	-176.1	0	0	0	0	0	114.7	G821 Y822 V823	G821-A825 VanDerWaalsContact O-CB 3.32Å; G821-A825 WeakPolarHBondContact O-CB 3.33Å; G821-A825 PolarHBondContact O-N 2.69Å; G821-A825 VanDerWaalsContact O-N 3.08Å; Y822-A825 PolarHBondContact O-N 3.48Å; V823-A825 PolarHBondContact O-N 3.15Å
826	S	70.1	Confident	74.9	Confident	57 Å²	57	42.5 Å²	42.5	40%	0.399	25%	0.252	S	S	.	.	H	α-helix	trans	-119	-12.3	-165.2	-39.5	0	0	0	0	114.6	Y822 V823	Y822-S826 WeakPolarHBondContact CD2-OG 3.36Å; Y822-S826 WeakPolarHBondContact CE2-OG 3.44Å; Y822-S826 VanDerWaalsContact O-CB 3.28Å; Y822-S826 WeakPolarHBondContact O-CB 3.27Å; Y822-S826 PolarHBondContact O-N 2.72Å; Y822-S826 PolarHBondContact O-OG 2.9Å; V823-S826 PolarHBondContact O-N 3.22Å
827	K	68.5	Low	74.5	Confident	49 Å²	49	43 Å²	43	21%	0.213	26%	0.256	C	S	.	.			trans	-118.6	137.7	-174.6	-64.2	-65.3	-175.5	176.9	0	110.9	E447 V823 F842	E447-K827 IonicContact OE1-NZ 3.97Å; E447-K827 PolarHBondContact OE1-NZ 3.36Å; V823-K827 HydrophobicContact CG1-CB 4.1Å; V823-K827 HydrophobicContact CG1-CG 4.47Å; V823-K827 PolarHBondContact O-N 3.32Å; V823-K827 VanDerWaalsContact O-N 3.08Å; K827-F842 WeakPolarHBondContact O-CD2 3.24Å; K827-F842 WeakPolarHBondContact O-CE2 3.35Å
828	E	71.4	Confident	74	Confident	152 Å²	152	43.4 Å²	43.4	71%	0.71	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-77.2	135.8	176.7	-49.5	-172.9	163	0	0	109.2	D840	E828-D840 WeakPolarHBondContact CA-O 3.5Å; E828-D840 WeakPolarHBondContact CB-O 3.46Å; E828-D840 VanDerWaalsContact CG-O 3.31Å; E828-D840 WeakPolarHBondContact CG-O 3.14Å
829	P	73	Confident	73.9	Confident	13 Å²	13	41.1 Å²	41.1	8%	0.084	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-67.8	156.7	173.8	30.9	-35	0	0	0	110.6	S831 F836 K839 F842	P829-S831 PolarHBondContact O-N 3.42Å; P829-F836 HydrophobicContact CB-CB 3.9Å; P829-F836 HydrophobicContact CG-CB 4.14Å; P829-F836 VanDerWaalsContact CG-O 3.27Å; P829-F836 WeakPolarHBondContact CG-O 3.48Å; P829-K839 WeakPolarHBondContact CD-O 3.15Å; P829-K839 HydrophobicContact CG-CB 4.45Å; P829-K839 WeakPolarHBondContact CG-O 3.5Å; P829-F842 HydrophobicContact CB-CD1 4.39Å; P829-F842 HydrophobicContact CB-CE1 3.86Å; P829-F842 HydrophobicContact CB-CE2 4.25Å; P829-F842 HydrophobicContact CB-CZ 3.77Å
830	S	66.3	Low	74.1	Confident	21 Å²	21	45.8 Å²	45.8	15%	0.147	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-55.3	130.5	172.8	40.5	0	0	0	0	111.7	T667 T832 C833 A837	T667-S830 PolarHBondContact OG1-OG 2.98Å; S830-T832 VanDerWaalsContact C-N 3.31Å; S830-T832 PolarHBondContact O-N 2.9Å; S830-C833 WeakPolarHBondContact CB-SG 3.46Å; S830-C833 PolarHBondContact OG-O 3.41Å; S830-C833 PolarHBondContact OG-SG 3.49Å; S830-A837 WeakPolarHBondContact O-CA 3.17Å
831	S	64.9	Low	74.3	Confident	97 Å²	97	46.8 Å²	46.8	68%	0.678	29%	0.285	S	S	*	.	S	Bend	trans	-64.6	-33.2	-178.1	52.9	0	0	0	0	113.3	P829	P829-S831 PolarHBondContact O-N 3.42Å
832	T	63.5	Low	74.3	Confident	68 Å²	68	45.4 Å²	45.4	42%	0.417	27%	0.269	S	S	.	.	S	Bend	trans	-95.3	-23.4	-170.9	53.3	0	0	0	0	114.6	H174 S830	H174-T832 PolarHBondContact CE1-O 3.13Å; S830-T832 VanDerWaalsContact C-N 3.31Å; S830-T832 PolarHBondContact O-N 2.9Å
833	C	68.7	Low	74.5	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.027	28%	0.275	C	S	.	.	S	Bend	trans	-139.6	148.6	-165.9	62.3	0	0	0	0	114.8	C665 S830	C665-C833 WeakPolarHBondContact CA-SG 3.22Å; C665-C833 HydrophobicContact CB-CB 3.49Å; C665-C833 VanDerWaalsContact CB-CB 3.49Å; C665-C833 WeakPolarHBondContact CB-SG 3.45Å; C665-C833 WeakPolarHBondContact SG-CB 3.28Å; C665-C833 CovalentContact SG-SG 2Å; C665-C833 PolarHBondContact SG-SG 3.07Å; S830-C833 WeakPolarHBondContact CB-SG 3.46Å; S830-C833 PolarHBondContact OG-O 3.41Å; S830-C833 PolarHBondContact OG-SG 3.49Å
834	G	76.5	Confident	74.9	Confident	3 Å²	3	47.1 Å²	47.1	3%	0.031	28%	0.277	C	S	.	.	S	Bend	trans	90.1	174.5	176.8	0	0	0	0	0	115	Y208 F836 A837	Y208-G834 CarbonylContact O-C 3.59Å; Y208-G834 WeakPolarHBondContact O-CA 3.41Å; G834-F836 PolarHBondContact O-N 3.29Å; G834-F836 VanDerWaalsContact O-N 3.15Å; G834-A837 WeakPolarHBondContact O-CB 3.24Å; G834-A837 PolarHBondContact O-N 2.8Å
835	P	81.3	Confident	75.1	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.013	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-25	-176.8	24.1	-36.6	0	0	0	113.1	Y205 N210 P223 Y226	Y205-P835 HydrophobicContact CD2-CG 4.21Å; Y205-P835 HydrophobicContact CE2-CG 3.45Å; Y205-P835 VanDerWaalsContact CE2-CG 3.45Å; Y205-P835 VanDerWaalsContact CZ-CD 3.4Å; N210-P835 WeakPolarHBondContact CB-O 3.49Å; P223-P835 HydrophobicContact CB-CB 4.23Å; P223-P835 VanDerWaalsContact CB-O 3.27Å; P223-P835 WeakPolarHBondContact CB-O 3.25Å; P223-P835 HydrophobicContact CG-CB 4.27Å; P223-P835 WeakPolarHBondContact CG-O 3.34Å; Y226-P835 HydrophobicContact CD1-CG 4.31Å; Y226-P835 HydrophobicContact CD2-CG 4.28Å; Y226-P835 HydrophobicContact CG-CG 4.15Å
836	F	83.3	Confident	75.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	12.8	-176.5	-51.5	-51.3	0	0	0	113.6	Y205 P223 Y226 F227 F742 P829 G834 G838 K839 F842 I845	Y205-F836 AromaticContact CE2-CD2 3.95Å; Y205-F836 HydrophobicContact CE2-CD2 3.95Å; Y205-F836 HydrophobicContact CE2-CE2 4.32Å; Y205-F836 AromaticContact CZ-CD2 3.95Å; Y205-F836 WeakPolarHBondContact OH-CB 3.46Å; Y205-F836 WeakPolarHBondContact OH-CD2 3.25Å; Y205-F836 PolarHBondContact OH-N 2.83Å; P223-F836 HydrophobicContact CB-CD1 4.01Å; P223-F836 HydrophobicContact CB-CE1 4.03Å; P223-F836 VanDerWaalsContact O-CE1 3.24Å; P223-F836 WeakPolarHBondContact O-CE1 3.46Å; Y226-F836 AromaticContact CD1-CE2 3.69Å; Y226-F836 HydrophobicContact CD1-CE2 3.69Å; Y226-F836 AromaticContact CD1-CZ 3.72Å; Y226-F836 HydrophobicContact CD1-CZ 3.72Å; Y226-F836 HydrophobicContact CE1-CE2 4.06Å; Y226-F836 HydrophobicContact CG-CZ 4.46Å; F227-F836 HydrophobicContact CB-CE1 4.37Å; F227-F836 HydrophobicContact CB-CZ 4.01Å; F227-F836 HydrophobicContact CD2-CZ 4.39Å; F742-F836 HydrophobicContact CE2-CE2 4.4Å; F742-F836 AromaticContact CZ-CE2 3.88Å; F742-F836 HydrophobicContact CZ-CE2 3.88Å; P829-F836 HydrophobicContact CB-CB 3.9Å; P829-F836 HydrophobicContact CG-CB 4.14Å; P829-F836 VanDerWaalsContact CG-O 3.27Å; P829-F836 WeakPolarHBondContact CG-O 3.48Å; G834-F836 PolarHBondContact O-N 3.29Å; G834-F836 VanDerWaalsContact O-N 3.15Å; F836-G838 PolarHBondContact O-N 2.7Å; F836-K839 PolarHBondContact O-N 2.75Å; F836-F842 HydrophobicContact CB-CD1 4.22Å; F836-F842 HydrophobicContact CB-CE1 4.41Å; F836-F842 AromaticContact CD2-CD1 3.29Å; F836-F842 HydrophobicContact CD2-CD1 3.29Å; F836-F842 AromaticContact CD2-CE1 3.62Å; F836-F842 HydrophobicContact CD2-CE1 3.62Å; F836-F842 AromaticContact CE2-CD1 3.81Å; F836-F842 HydrophobicContact CE2-CD1 3.81Å; F836-F842 HydrophobicContact CE2-CE1 4.35Å; F836-F842 AromaticContact CG-CD1 3.92Å; F836-F842 HydrophobicContact CG-CD1 3.92Å; F836-F842 HydrophobicContact CG-CE1 4.37Å; F836-I845 HydrophobicContact CB-CD1 4.38Å; F836-I845 HydrophobicContact CD1-CD1 3.01Å; F836-I845 HydrophobicContact CD1-CG1 4.5Å; F836-I845 HydrophobicContact CE1-CD1 3.42Å; F836-I845 VanDerWaalsContact CE1-CD1 3.42Å; F836-I845 HydrophobicContact CG-CD1 4.06Å
837	A	74.6	Confident	75.5	Confident	11 Å²	11	45 Å²	45	9%	0.091	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	131	178	0	0	0	0	0	112	N210 S830 G834	N210-A837 HydrophobicContact CB-CB 4.47Å; N210-A837 PolarHBondContact ND2-O 2.85Å; S830-A837 WeakPolarHBondContact O-CA 3.17Å; G834-A837 WeakPolarHBondContact O-CB 3.24Å; G834-A837 PolarHBondContact O-N 2.8Å
838	G	71.7	Confident	76.1	Confident	66 Å²	66	45.1 Å²	45.1	68%	0.68	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	13.9	179.9	0	0	0	0	0	115.9	F836	F836-G838 PolarHBondContact O-N 2.7Å
839	K	78	Confident	76.4	Confident	81 Å²	81	39.4 Å²	39.4	35%	0.352	23%	0.231	S	C	.	.			trans	-111.2	142	176	-68.2	-67.7	-174.7	175.9	0	111.3	P829 F836 N841 I845 D848	P829-K839 WeakPolarHBondContact CD-O 3.15Å; P829-K839 HydrophobicContact CG-CB 4.45Å; P829-K839 WeakPolarHBondContact CG-O 3.5Å; F836-K839 PolarHBondContact O-N 2.75Å; K839-N841 PolarHBondContact O-N 3Å; K839-I845 HydrophobicContact CD-CG1 4.29Å; K839-I845 HydrophobicContact CG-CD1 4.12Å; K839-I845 HydrophobicContact CG-CG1 4.05Å; K839-D848 IonicContact NZ-OD2 3.51Å; K839-D848 PolarHBondContact NZ-OD2 3.15Å
840	D	78.4	Confident	76.6	Confident	118 Å²	118	41.6 Å²	41.6	63%	0.631	24%	0.241	S	C	*	.	S	Bend	trans	-62.6	-40.9	-178.6	-51	-22.6	0	0	0	113.3	E828	E828-D840 WeakPolarHBondContact CA-O 3.5Å; E828-D840 WeakPolarHBondContact CB-O 3.46Å; E828-D840 VanDerWaalsContact CG-O 3.31Å; E828-D840 WeakPolarHBondContact CG-O 3.14Å
841	N	80	Confident	77.2	Confident	29 Å²	29	45.4 Å²	45.4	16%	0.155	26%	0.255	C	S	.	.	S	Bend	trans	-143.1	155.2	177.3	-64	-79.2	0	0	0	110.7	K839 Y843 T844	K839-N841 PolarHBondContact O-N 3Å; N841-Y843 VanDerWaalsContact C-N 3.27Å; N841-Y843 HydrophobicContact CB-CD1 3.68Å; N841-Y843 HydrophobicContact CB-CE1 3.42Å; N841-Y843 VanDerWaalsContact CB-CE1 3.42Å; N841-Y843 PolarHBondContact O-N 3.45Å; N841-T844 HydrophobicContact CB-CG2 4Å; N841-T844 WeakPolarHBondContact O-CG2 3.45Å; N841-T844 PolarHBondContact O-N 3.47Å; N841-T844 VanDerWaalsContact O-N 3.13Å; N841-T844 PolarHBondContact O-OG1 3.42Å
842	F	81.9	Confident	77.8	Confident	5 Å²	5	44.4 Å²	44.4	2%	0.022	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-37.1	178.9	-66	-86.2	0	0	0	113.8	F742 V823 I824 K827 P829 F836 T844	F742-F842 AromaticContact CE1-CD1 3.97Å; F742-F842 HydrophobicContact CE1-CD1 3.97Å; F742-F842 HydrophobicContact CE1-CE1 4.04Å; F742-F842 AromaticContact CZ-CD1 3.84Å; F742-F842 HydrophobicContact CZ-CD1 3.84Å; F742-F842 HydrophobicContact CZ-CE1 4.33Å; F742-F842 HydrophobicContact CZ-CG 4.37Å; V823-F842 HydrophobicContact CG1-CE2 4.05Å; I824-F842 HydrophobicContact CB-CB 4.41Å; I824-F842 HydrophobicContact CG2-CB 4Å; K827-F842 WeakPolarHBondContact O-CD2 3.24Å; K827-F842 WeakPolarHBondContact O-CE2 3.35Å; P829-F842 HydrophobicContact CB-CD1 4.39Å; P829-F842 HydrophobicContact CB-CE1 3.86Å; P829-F842 HydrophobicContact CB-CE2 4.25Å; P829-F842 HydrophobicContact CB-CZ 3.77Å; F836-F842 HydrophobicContact CB-CD1 4.22Å; F836-F842 HydrophobicContact CB-CE1 4.41Å; F836-F842 AromaticContact CD2-CD1 3.29Å; F836-F842 HydrophobicContact CD2-CD1 3.29Å; F836-F842 AromaticContact CD2-CE1 3.62Å; F836-F842 HydrophobicContact CD2-CE1 3.62Å; F836-F842 AromaticContact CE2-CD1 3.81Å; F836-F842 HydrophobicContact CE2-CD1 3.81Å; F836-F842 HydrophobicContact CE2-CE1 4.35Å; F836-F842 AromaticContact CG-CD1 3.92Å; F836-F842 HydrophobicContact CG-CD1 3.92Å; F836-F842 HydrophobicContact CG-CE1 4.37Å; F842-T844 VanDerWaalsContact C-N 3.34Å; F842-T844 PolarHBondContact O-N 3.33Å
843	Y	81.3	Confident	78.5	Confident	109 Å²	109	47.9 Å²	47.9	43%	0.427	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.4	-177.3	71.6	-94.7	0	0	0	114	N841 I845 M846 S847	N841-Y843 VanDerWaalsContact C-N 3.27Å; N841-Y843 HydrophobicContact CB-CD1 3.68Å; N841-Y843 HydrophobicContact CB-CE1 3.42Å; N841-Y843 VanDerWaalsContact CB-CE1 3.42Å; N841-Y843 PolarHBondContact O-N 3.45Å; Y843-I845 PolarHBondContact O-N 2.86Å; Y843-M846 WeakPolarHBondContact O-CB 3.34Å; Y843-M846 PolarHBondContact O-N 3.04Å; Y843-M846 VanDerWaalsContact O-N 3.11Å; Y843-S847 PolarHBondContact O-N 3.45Å
844	T	82.9	Confident	78.9	Confident	18 Å²	18	49.8 Å²	49.8	11%	0.11	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-32.5	-176.2	59.8	0	0	0	0	111.2	N841 F842 M846 S847 D848	N841-T844 HydrophobicContact CB-CG2 4Å; N841-T844 WeakPolarHBondContact O-CG2 3.45Å; N841-T844 PolarHBondContact O-N 3.47Å; N841-T844 VanDerWaalsContact O-N 3.13Å; N841-T844 PolarHBondContact O-OG1 3.42Å; F842-T844 VanDerWaalsContact C-N 3.34Å; F842-T844 PolarHBondContact O-N 3.33Å; T844-M846 VanDerWaalsContact C-N 3.35Å; T844-M846 PolarHBondContact O-N 3.14Å; T844-S847 WeakPolarHBondContact CA-OG 3.37Å; T844-S847 CarbonylContact O-C 3.51Å; T844-S847 WeakPolarHBondContact O-CA 3.31Å; T844-S847 WeakPolarHBondContact O-CB 3.45Å; T844-S847 PolarHBondContact O-N 3.38Å; T844-S847 PolarHBondContact O-OG 3.2Å; T844-D848 WeakPolarHBondContact O-CB 3.14Å; T844-D848 VanDerWaalsContact O-CG 3.25Å; T844-D848 PolarHBondContact O-N 3.06Å
845	I	83.2	Confident	79	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.062	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-41.7	178.1	-67.6	155.4	0	0	0	111.5	P223 L224 F836 K839 Y843 S847 D848 Q849	P223-I845 HydrophobicContact CB-CD1 4.01Å; L224-I845 HydrophobicContact CB-CG2 4.27Å; L224-I845 HydrophobicContact CD1-CG2 4.41Å; F836-I845 HydrophobicContact CB-CD1 4.38Å; F836-I845 HydrophobicContact CD1-CD1 3.01Å; F836-I845 HydrophobicContact CD1-CG1 4.5Å; F836-I845 HydrophobicContact CE1-CD1 3.42Å; F836-I845 VanDerWaalsContact CE1-CD1 3.42Å; F836-I845 HydrophobicContact CG-CD1 4.06Å; K839-I845 HydrophobicContact CD-CG1 4.29Å; K839-I845 HydrophobicContact CG-CD1 4.12Å; K839-I845 HydrophobicContact CG-CG1 4.05Å; Y843-I845 PolarHBondContact O-N 2.86Å; I845-S847 VanDerWaalsContact C-N 3.27Å; I845-S847 PolarHBondContact O-N 3.36Å; I845-D848 PolarHBondContact O-N 3.11Å; I845-Q849 HydrophobicContact CG2-CG 4.46Å; I845-Q849 WeakPolarHBondContact O-CB 3.35Å; I845-Q849 WeakPolarHBondContact O-CG 3.46Å; I845-Q849 PolarHBondContact O-N 2.99Å
846	M	79.8	Confident	78.7	Confident	55 Å²	55	57.3 Å²	57.3	27%	0.271	33%	0.333	S	S	.	.	H	α-helix	trans	-62.1	-42.5	173.1	-173.5	57.7	66.4	0	0	110.1	L224 F227 L228 Y843 T844 L850	L224-M846 HydrophobicContact CD1-CE 4.2Å; F227-M846 HydrophobicContact CD1-CE 3.5Å; F227-M846 HydrophobicContact CE1-CB 4.32Å; F227-M846 HydrophobicContact CE1-CE 3.72Å; L228-M846 HydrophobicContact CD2-CE 3.39Å; L228-M846 HydrophobicContact CG-CE 3.81Å; Y843-M846 WeakPolarHBondContact O-CB 3.34Å; Y843-M846 PolarHBondContact O-N 3.04Å; Y843-M846 VanDerWaalsContact O-N 3.11Å; T844-M846 VanDerWaalsContact C-N 3.35Å; T844-M846 PolarHBondContact O-N 3.14Å; M846-L850 WeakPolarHBondContact O-CB 3.15Å; M846-L850 PolarHBondContact O-N 3.4Å
847	S	76.8	Confident	78.3	Confident	31 Å²	31	64.1 Å²	64.1	22%	0.217	37%	0.365	C	S	.	.	H	α-helix	trans	-67.7	-37.4	-179.3	80.6	0	0	0	0	113.4	Y843 T844 I845 L850 K851	Y843-S847 PolarHBondContact O-N 3.45Å; T844-S847 WeakPolarHBondContact CA-OG 3.37Å; T844-S847 CarbonylContact O-C 3.51Å; T844-S847 WeakPolarHBondContact O-CA 3.31Å; T844-S847 WeakPolarHBondContact O-CB 3.45Å; T844-S847 PolarHBondContact O-N 3.38Å; T844-S847 PolarHBondContact O-OG 3.2Å; I845-S847 VanDerWaalsContact C-N 3.27Å; I845-S847 PolarHBondContact O-N 3.36Å; S847-L850 PolarHBondContact O-N 3.44Å; S847-K851 VanDerWaalsContact O-CG 3.24Å; S847-K851 WeakPolarHBondContact O-CG 3.42Å; S847-K851 PolarHBondContact O-N 3.08Å
848	D	79.8	Confident	78.4	Confident	52 Å²	52	66.3 Å²	66.3	28%	0.278	38%	0.377	S	S	.	.	H	α-helix	trans	-68.7	-42.3	178.4	-70.5	-13.7	0	0	0	110.5	K839 T844 I845 K851 A852	K839-D848 IonicContact NZ-OD2 3.51Å; K839-D848 PolarHBondContact NZ-OD2 3.15Å; T844-D848 WeakPolarHBondContact O-CB 3.14Å; T844-D848 VanDerWaalsContact O-CG 3.25Å; T844-D848 PolarHBondContact O-N 3.06Å; I845-D848 PolarHBondContact O-N 3.11Å; D848-K851 PolarHBondContact O-N 3.48Å; D848-A852 PolarHBondContact O-N 3.2Å
849	Q	78.1	Confident	78.5	Confident	32 Å²	32	66.3 Å²	66.3	15%	0.15	36%	0.357	C	S	.	.	H	α-helix	trans	-70.1	-37.7	176.7	-63.9	-62.5	-44.4	0	0	111.7	L224 I845 K851 A852 L853	L224-Q849 HydrophobicContact CD1-CB 4.23Å; L224-Q849 HydrophobicContact CD1-CG 3.95Å; L224-Q849 HydrophobicContact CD2-CG 4.1Å; L224-Q849 HydrophobicContact CG-CG 4.44Å; I845-Q849 HydrophobicContact CG2-CG 4.46Å; I845-Q849 WeakPolarHBondContact O-CB 3.35Å; I845-Q849 WeakPolarHBondContact O-CG 3.46Å; I845-Q849 PolarHBondContact O-N 2.99Å; Q849-K851 VanDerWaalsContact C-N 3.33Å; Q849-K851 PolarHBondContact O-N 2.79Å; Q849-A852 PolarHBondContact O-N 3.31Å; Q849-L853 WeakPolarHBondContact O-CB 3.4Å; Q849-L853 WeakPolarHBondContact O-CG 3.33Å; Q849-L853 PolarHBondContact O-N 3.3Å
850	L	78.3	Confident	78.5	Confident	59 Å²	59	66.5 Å²	66.5	31%	0.309	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-40.4	173.7	-166.5	74.3	0	0	0	111.1	M846 S847 A852 L854 M862	M846-L850 WeakPolarHBondContact O-CB 3.15Å; M846-L850 PolarHBondContact O-N 3.4Å; S847-L850 PolarHBondContact O-N 3.44Å; L850-A852 VanDerWaalsContact C-N 3.33Å; L850-A852 PolarHBondContact O-N 2.82Å; L850-L854 HydrophobicContact CB-CD1 4.42Å; L850-L854 HydrophobicContact CD1-CD1 3.12Å; L850-L854 HydrophobicContact CG-CD1 3.46Å; L850-L854 VanDerWaalsContact CG-CD1 3.46Å; L850-L854 WeakPolarHBondContact O-CB 3.14Å; L850-L854 VanDerWaalsContact O-CD1 3.25Å; L850-L854 WeakPolarHBondContact O-CD1 3.47Å; L850-L854 PolarHBondContact O-N 3.16Å; L850-L854 VanDerWaalsContact O-N 3.1Å; L850-M862 HydrophobicContact CD1-CE 4.41Å; L850-M862 HydrophobicContact CD2-CE 4.01Å
851	K	78.3	Confident	78.5	Confident	102 Å²	102	67.7 Å²	67.7	44%	0.443	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-35.1	173.1	-72.6	167.4	-172.3	169	0	112.6	S847 D848 Q849 Y859	S847-K851 VanDerWaalsContact O-CG 3.24Å; S847-K851 WeakPolarHBondContact O-CG 3.42Å; S847-K851 PolarHBondContact O-N 3.08Å; D848-K851 PolarHBondContact O-N 3.48Å; Q849-K851 VanDerWaalsContact C-N 3.33Å; Q849-K851 PolarHBondContact O-N 2.79Å; K851-Y859 HydrophobicContact CD-CE2 4.49Å; K851-Y859 WeakPolarHBondContact CE-OH 3.46Å; K851-Y859 HydrophobicContact CG-CD2 3.92Å; K851-Y859 HydrophobicContact CG-CE1 4.21Å; K851-Y859 HydrophobicContact CG-CE2 3.57Å; K851-Y859 HydrophobicContact CG-CG 4.38Å
852	A	77.2	Confident	78.2	Confident	76 Å²	76	70 Å²	70	63%	0.628	38%	0.375	S	S	*	.	H	α-helix	trans	-75.8	-33.3	179.7	0	0	0	0	0	113.3	D848 Q849 L850	D848-A852 PolarHBondContact O-N 3.2Å; Q849-A852 PolarHBondContact O-N 3.31Å; L850-A852 VanDerWaalsContact C-N 3.33Å; L850-A852 PolarHBondContact O-N 2.82Å
853	L	77.7	Confident	77.8	Confident	140 Å²	140	74.6 Å²	74.6	73%	0.733	40%	0.4	S	S	*	.	H	α-helix	trans	-87.6	-28.5	-176.9	-74.4	163.8	0	0	0	113.8	Q849	Q849-L853 WeakPolarHBondContact O-CB 3.4Å; Q849-L853 WeakPolarHBondContact O-CG 3.33Å; Q849-L853 PolarHBondContact O-N 3.3Å
854	L	78.1	Confident	77.6	Confident	44 Å²	44	73.5 Å²	73.5	23%	0.23	41%	0.405	C	S	.	.	S	Bend	trans	-98.3	138.5	-177.7	-76.9	118.8	0	0	0	112.2	L850 A856 V858 M862	L850-L854 HydrophobicContact CB-CD1 4.42Å; L850-L854 HydrophobicContact CD1-CD1 3.12Å; L850-L854 HydrophobicContact CG-CD1 3.46Å; L850-L854 VanDerWaalsContact CG-CD1 3.46Å; L850-L854 WeakPolarHBondContact O-CB 3.14Å; L850-L854 VanDerWaalsContact O-CD1 3.25Å; L850-L854 WeakPolarHBondContact O-CD1 3.47Å; L850-L854 PolarHBondContact O-N 3.16Å; L850-L854 VanDerWaalsContact O-N 3.1Å; L854-A856 PolarHBondContact O-N 2.79Å; L854-V858 HydrophobicContact CB-CB 4.4Å; L854-V858 HydrophobicContact CD2-CB 3.65Å; L854-V858 HydrophobicContact CD2-CG1 3.28Å; L854-M862 HydrophobicContact CD1-SD 4.29Å; L854-M862 HydrophobicContact CD2-SD 3.76Å
855	P	78	Confident	77.4	Confident	85 Å²	85	77.9 Å²	77.9	55%	0.552	43%	0.427	S	S	*	.			trans	-53.3	143.1	168	-18.1	27.2	0	0	0	109.9	E857 V858 Y859	P855-E857 PolarHBondContact O-N 3.08Å; P855-V858 HydrophobicContact CB-CG2 4.29Å; P855-V858 HydrophobicContact CG-CG2 4.07Å; P855-V858 PolarHBondContact O-N 3.33Å; P855-Y859 PolarHBondContact O-N 3.41Å; P855-Y859 VanDerWaalsContact O-N 3.15Å
856	A	75.6	Confident	76.8	Confident	78 Å²	78	81.4 Å²	81.4	65%	0.645	45%	0.453	S	S	*	.	H	α-helix	trans	-52.1	-31.4	-178.7	0	0	0	0	0	112.8	L854 T860	L854-A856 PolarHBondContact O-N 2.79Å; A856-T860 WeakPolarHBondContact O-CB 3.49Å; A856-T860 PolarHBondContact O-N 2.97Å; A856-T860 PolarHBondContact O-OG1 2.84Å
857	E	74.5	Confident	76.8	Confident	143 Å²	143	81.2 Å²	81.2	67%	0.668	46%	0.456	S	S	*	.	H	α-helix	trans	-62.5	-42.9	174.1	-66.1	-170.3	-178.8	0	0	113.6	P855 K861	P855-E857 PolarHBondContact O-N 3.08Å; E857-K861 WeakPolarHBondContact O-CG 3.38Å; E857-K861 PolarHBondContact O-N 3.12Å; E857-K861 VanDerWaalsContact O-N 3.08Å
858	V	76.9	Confident	76.9	Confident	58 Å²	58	83.9 Å²	83.9	35%	0.352	47%	0.473	S	S	.	.	H	α-helix	trans	-74.8	-39.4	-178.3	-169	0	0	0	0	110.1	L854 P855 T860 K861 M862	L854-V858 HydrophobicContact CB-CB 4.4Å; L854-V858 HydrophobicContact CD2-CB 3.65Å; L854-V858 HydrophobicContact CD2-CG1 3.28Å; P855-V858 HydrophobicContact CB-CG2 4.29Å; P855-V858 HydrophobicContact CG-CG2 4.07Å; P855-V858 PolarHBondContact O-N 3.33Å; V858-T860 VanDerWaalsContact C-N 3.32Å; V858-T860 PolarHBondContact O-N 3.16Å; V858-K861 PolarHBondContact O-N 3.16Å; V858-M862 HydrophobicContact CG1-CG 4.28Å; V858-M862 HydrophobicContact CG1-SD 4.2Å; V858-M862 WeakPolarHBondContact O-CB 3.12Å; V858-M862 WeakPolarHBondContact O-CG 3.48Å; V858-M862 PolarHBondContact O-N 3.26Å
859	Y	74.6	Confident	76.8	Confident	66 Å²	66	83.9 Å²	83.9	26%	0.259	49%	0.486	S	S	.	.	H	α-helix	trans	-59.7	-43.8	174.1	-179.8	-101	0	0	0	111.6	K851 P855 K861 M862 N863	K851-Y859 HydrophobicContact CD-CE2 4.49Å; K851-Y859 WeakPolarHBondContact CE-OH 3.46Å; K851-Y859 HydrophobicContact CG-CD2 3.92Å; K851-Y859 HydrophobicContact CG-CE1 4.21Å; K851-Y859 HydrophobicContact CG-CE2 3.57Å; K851-Y859 HydrophobicContact CG-CG 4.38Å; P855-Y859 PolarHBondContact O-N 3.41Å; P855-Y859 VanDerWaalsContact O-N 3.15Å; Y859-K861 PolarHBondContact O-N 3.49Å; Y859-M862 PolarHBondContact O-N 3.04Å; Y859-N863 WeakPolarHBondContact O-CB 3.46Å; Y859-N863 PolarHBondContact O-N 2.96Å
860	T	76.9	Confident	77.1	Confident	85 Å²	85	85.5 Å²	85.5	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-44.5	177	-53.6	0	0	0	0	111.1	A856 V858 N863 V864	A856-T860 WeakPolarHBondContact O-CB 3.49Å; A856-T860 PolarHBondContact O-N 2.97Å; A856-T860 PolarHBondContact O-OG1 2.84Å; V858-T860 VanDerWaalsContact C-N 3.32Å; V858-T860 PolarHBondContact O-N 3.16Å; T860-N863 PolarHBondContact O-N 3.3Å; T860-V864 WeakPolarHBondContact O-CG2 3.46Å; T860-V864 PolarHBondContact O-N 2.93Å; T860-V864 VanDerWaalsContact O-N 3.07Å
861	K	79.2	Confident	77.3	Confident	142 Å²	142	85.4 Å²	85.4	62%	0.617	50%	0.496	S	S	*	.	H	α-helix	trans	-63.9	-40.2	175.5	-72.6	173.5	-177.8	171.6	0	112.7	E857 V858 Y859 V864 L865	E857-K861 WeakPolarHBondContact O-CG 3.38Å; E857-K861 PolarHBondContact O-N 3.12Å; E857-K861 VanDerWaalsContact O-N 3.08Å; V858-K861 PolarHBondContact O-N 3.16Å; Y859-K861 PolarHBondContact O-N 3.49Å; K861-V864 PolarHBondContact O-N 3.34Å; K861-L865 WeakPolarHBondContact O-CB 3.41Å; K861-L865 PolarHBondContact O-N 3.33Å
862	M	72.2	Confident	77.6	Confident	77 Å²	77	85.1 Å²	85.1	38%	0.379	50%	0.499	S	S	.	.	H	α-helix	trans	-67.6	-38.7	176.6	-76.4	-179.7	67	0	0	112.4	L850 L854 V858 Y859 V864 L865 S866	L850-M862 HydrophobicContact CD1-CE 4.41Å; L850-M862 HydrophobicContact CD2-CE 4.01Å; L854-M862 HydrophobicContact CD1-SD 4.29Å; L854-M862 HydrophobicContact CD2-SD 3.76Å; V858-M862 HydrophobicContact CG1-CG 4.28Å; V858-M862 HydrophobicContact CG1-SD 4.2Å; V858-M862 WeakPolarHBondContact O-CB 3.12Å; V858-M862 WeakPolarHBondContact O-CG 3.48Å; V858-M862 PolarHBondContact O-N 3.26Å; Y859-M862 PolarHBondContact O-N 3.04Å; M862-V864 VanDerWaalsContact C-N 3.3Å; M862-V864 PolarHBondContact O-N 3.35Å; M862-L865 WeakPolarHBondContact O-CB 3.08Å; M862-L865 PolarHBondContact O-N 3.21Å; M862-L865 VanDerWaalsContact O-N 3.13Å; M862-S866 PolarHBondContact O-N 2.94Å
863	N	73.8	Confident	78.2	Confident	102 Å²	102	85 Å²	85	55%	0.545	49%	0.491	S	S	.	.	H	α-helix	trans	-66.6	-35.9	176.9	-160.9	21.3	0	0	0	111.1	Y859 T860 S867	Y859-N863 WeakPolarHBondContact O-CB 3.46Å; Y859-N863 PolarHBondContact O-N 2.96Å; T860-N863 PolarHBondContact O-N 3.3Å; N863-S867 PolarHBondContact O-N 3.09Å
864	V	77.6	Confident	78.6	Confident	87 Å²	87	81.1 Å²	81.1	53%	0.527	47%	0.473	S	S	.	.	H	α-helix	trans	-64	-44.6	168.4	174.3	0	0	0	0	110.8	T860 K861 M862 S866 S867 I870	T860-V864 WeakPolarHBondContact O-CG2 3.46Å; T860-V864 PolarHBondContact O-N 2.93Å; T860-V864 VanDerWaalsContact O-N 3.07Å; K861-V864 PolarHBondContact O-N 3.34Å; M862-V864 VanDerWaalsContact C-N 3.3Å; M862-V864 PolarHBondContact O-N 3.35Å; V864-S866 VanDerWaalsContact C-N 3.33Å; V864-S866 PolarHBondContact O-N 2.8Å; V864-S867 WeakPolarHBondContact O-CB 3.27Å; V864-S867 PolarHBondContact O-N 3.48Å; V864-I870 HydrophobicContact CG1-CD1 4.19Å; V864-I870 WeakPolarHBondContact O-CD1 3.13Å
865	L	77.8	Confident	78.9	Confident	110 Å²	110	83.7 Å²	83.7	58%	0.576	49%	0.487	S	S	*	.	H	α-helix	trans	-62.7	-36.6	179.4	-170.2	65.4	0	0	0	113.3	K861 M862 S867 I870	K861-L865 WeakPolarHBondContact O-CB 3.41Å; K861-L865 PolarHBondContact O-N 3.33Å; M862-L865 WeakPolarHBondContact O-CB 3.08Å; M862-L865 PolarHBondContact O-N 3.21Å; M862-L865 VanDerWaalsContact O-N 3.13Å; L865-S867 PolarHBondContact O-N 2.63Å; L865-I870 HydrophobicContact CD1-CG2 4.14Å
866	S	71	Confident	79.4	Confident	86 Å²	86	84 Å²	84	60%	0.601	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	0.3	176.5	-168.7	0	0	0	0	113.3	M862 V864	M862-S866 PolarHBondContact O-N 2.94Å; V864-S866 VanDerWaalsContact C-N 3.33Å; V864-S866 PolarHBondContact O-N 2.8Å
867	S	79.4	Confident	80.1	Confident	50 Å²	50	85.4 Å²	85.4	35%	0.35	48%	0.479	S	S	.	.	S	Bend	trans	-59.1	135.9	174	179.1	0	0	0	0	109.8	N863 V864 L865 G869 I870 V871	N863-S867 PolarHBondContact O-N 3.09Å; V864-S867 WeakPolarHBondContact O-CB 3.27Å; V864-S867 PolarHBondContact O-N 3.48Å; L865-S867 PolarHBondContact O-N 2.63Å; S867-G869 PolarHBondContact O-N 2.92Å; S867-G869 PolarHBondContact OG-N 3.33Å; S867-I870 PolarHBondContact O-N 3.27Å; S867-V871 PolarHBondContact O-N 2.69Å; S867-V871 VanDerWaalsContact O-N 3.12Å
868	P	79.5	Confident	80.7	Confident	87 Å²	87	84.5 Å²	84.5	57%	0.565	47%	0.473	S	S	*	.	H	α-helix	trans	-55.2	-26.4	177.2	22.4	-33.3	0	0	0	112.4	I870 I872	P868-I870 PolarHBondContact O-N 3.23Å; P868-I872 HydrophobicContact CB-CD1 4.2Å; P868-I872 WeakPolarHBondContact O-CB 3.31Å; P868-I872 WeakPolarHBondContact O-CD1 3.25Å; P868-I872 VanDerWaalsContact O-CG1 3.28Å; P868-I872 WeakPolarHBondContact O-CG1 3.33Å; P868-I872 PolarHBondContact O-N 2.75Å; P868-I872 VanDerWaalsContact O-N 3.07Å
869	G	79.1	Confident	81.3	Confident	53 Å²	53	87 Å²	87	55%	0.546	48%	0.483	S	S	.	.	H	α-helix	trans	-64.3	-21.5	175.7	0	0	0	0	0	115	S867 P873	S867-G869 PolarHBondContact O-N 2.92Å; S867-G869 PolarHBondContact OG-N 3.33Å; G869-P873 VanDerWaalsContact O-CD 3.22Å; G869-P873 WeakPolarHBondContact O-CD 3.5Å; G869-P873 VanDerWaalsContact O-CG 3.27Å; G869-P873 WeakPolarHBondContact O-CG 3.35Å
870	I	84.4	Confident	82.1	Confident	65 Å²	65	88.8 Å²	88.8	33%	0.333	50%	0.497	S	S	.	.	H	α-helix	trans	-102.4	-42.2	174.4	-59.9	179.8	0	0	0	110.5	V864 L865 S867 P868 I872 P873 V874	V864-I870 HydrophobicContact CG1-CD1 4.19Å; V864-I870 WeakPolarHBondContact O-CD1 3.13Å; L865-I870 HydrophobicContact CD1-CG2 4.14Å; S867-I870 PolarHBondContact O-N 3.27Å; P868-I870 PolarHBondContact O-N 3.23Å; I870-I872 VanDerWaalsContact C-N 3.34Å; I870-I872 PolarHBondContact O-N 3.5Å; I870-P873 WeakPolarHBondContact O-CD 3.32Å; I870-V874 HydrophobicContact CG2-CG2 4.04Å; I870-V874 WeakPolarHBondContact O-CB 3.39Å; I870-V874 WeakPolarHBondContact O-CG2 3.5Å; I870-V874 PolarHBondContact O-N 3.11Å
871	V	81.7	Confident	82.7	Confident	57 Å²	57	87.8 Å²	87.8	35%	0.345	49%	0.491	S	S	.	.	H	α-helix	trans	-61.1	-41.7	-177.2	176.7	0	0	0	0	111.8	S867 V874 L875	S867-V871 PolarHBondContact O-N 2.69Å; S867-V871 VanDerWaalsContact O-N 3.12Å; V871-V874 PolarHBondContact O-N 3.18Å; V871-L875 HydrophobicContact CG1-CD1 3.9Å; V871-L875 HydrophobicContact CG1-CG 4.4Å; V871-L875 WeakPolarHBondContact O-CB 3.26Å; V871-L875 WeakPolarHBondContact O-CG 3.09Å; V871-L875 PolarHBondContact O-N 3.23Å
872	I	85.3	Confident	83.1	Confident	97 Å²	97	85.7 Å²	85.7	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-52.1	-178.4	-64.6	167.1	0	0	0	111.4	P868 I870 V874 L875 I876	P868-I872 HydrophobicContact CB-CD1 4.2Å; P868-I872 WeakPolarHBondContact O-CB 3.31Å; P868-I872 WeakPolarHBondContact O-CD1 3.25Å; P868-I872 VanDerWaalsContact O-CG1 3.28Å; P868-I872 WeakPolarHBondContact O-CG1 3.33Å; P868-I872 PolarHBondContact O-N 2.75Å; P868-I872 VanDerWaalsContact O-N 3.07Å; I870-I872 VanDerWaalsContact C-N 3.34Å; I870-I872 PolarHBondContact O-N 3.5Å; I872-V874 VanDerWaalsContact C-N 3.3Å; I872-V874 PolarHBondContact O-N 2.96Å; I872-L875 PolarHBondContact O-N 2.86Å; I872-I876 HydrophobicContact CG2-CD1 3.89Å; I872-I876 WeakPolarHBondContact O-CG1 3.46Å; I872-I876 PolarHBondContact O-N 3.47Å
873	P	88.2	Confident	84	Confident	72 Å²	72	89.8 Å²	89.8	47%	0.468	50%	0.497	S	S	.	.	H	α-helix	trans	-57.6	-39	173.6	-28	35.7	0	0	0	113.9	G869 I870 I876 L877	G869-P873 VanDerWaalsContact O-CD 3.22Å; G869-P873 WeakPolarHBondContact O-CD 3.5Å; G869-P873 VanDerWaalsContact O-CG 3.27Å; G869-P873 WeakPolarHBondContact O-CG 3.35Å; I870-P873 WeakPolarHBondContact O-CD 3.32Å; P873-I876 PolarHBondContact O-N 3.14Å; P873-L877 WeakPolarHBondContact O-CB 3.22Å; P873-L877 PolarHBondContact O-N 3.22Å
874	V	85.9	Confident	84.8	Confident	60 Å²	60	91.1 Å²	91.1	36%	0.364	50%	0.499	S	S	.	.	H	α-helix	trans	-65.4	-41.5	176.9	169.9	0	0	0	0	111.3	I870 V871 I872 L877 F878	I870-V874 HydrophobicContact CG2-CG2 4.04Å; I870-V874 WeakPolarHBondContact O-CB 3.39Å; I870-V874 WeakPolarHBondContact O-CG2 3.5Å; I870-V874 PolarHBondContact O-N 3.11Å; V871-V874 PolarHBondContact O-N 3.18Å; I872-V874 VanDerWaalsContact C-N 3.3Å; I872-V874 PolarHBondContact O-N 2.96Å; V874-L877 PolarHBondContact O-N 2.77Å; V874-F878 HydrophobicContact CG1-CD2 3.64Å; V874-F878 HydrophobicContact CG1-CE2 3.47Å; V874-F878 VanDerWaalsContact CG1-CE2 3.47Å; V874-F878 WeakPolarHBondContact O-CD2 2.93Å; V874-F878 PolarHBondContact O-N 3.36Å
875	L	84.8	Confident	85.2	Confident	97 Å²	97	91.5 Å²	91.5	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-43.2	173.6	-82.8	169.8	0	0	0	111.9	V871 I872 L877 F878 I879	V871-L875 HydrophobicContact CG1-CD1 3.9Å; V871-L875 HydrophobicContact CG1-CG 4.4Å; V871-L875 WeakPolarHBondContact O-CB 3.26Å; V871-L875 WeakPolarHBondContact O-CG 3.09Å; V871-L875 PolarHBondContact O-N 3.23Å; I872-L875 PolarHBondContact O-N 2.86Å; L875-L877 VanDerWaalsContact C-N 3.34Å; L875-F878 PolarHBondContact O-N 2.79Å; L875-I879 VanDerWaalsContact O-CG1 3.27Å; L875-I879 WeakPolarHBondContact O-CG1 3.24Å; L875-I879 PolarHBondContact O-N 2.73Å
876	I	89.2	Confident	85.5	Confident	93 Å²	93	89.1 Å²	89.1	48%	0.477	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-44.6	175.5	-68	168.4	0	0	0	110.3	I872 P873 F878 I879 L880	I872-I876 HydrophobicContact CG2-CD1 3.89Å; I872-I876 WeakPolarHBondContact O-CG1 3.46Å; I872-I876 PolarHBondContact O-N 3.47Å; P873-I876 PolarHBondContact O-N 3.14Å; I876-F878 PolarHBondContact O-N 2.65Å; I876-I879 PolarHBondContact O-N 2.74Å; I876-L880 HydrophobicContact CG2-CD1 4.18Å; I876-L880 HydrophobicContact CG2-CG 4.5Å; I876-L880 WeakPolarHBondContact O-CG 3.12Å; I876-L880 PolarHBondContact O-N 2.66Å
877	L	90	Very high	86.4	Confident	106 Å²	106	87.2 Å²	87.2	56%	0.555	47%	0.473	S	S	*	.	H	α-helix	trans	-59.6	-45.7	175.2	-178.2	68.5	0	0	0	111.1	P873 V874 L875 I879 L880 V881	P873-L877 WeakPolarHBondContact O-CB 3.22Å; P873-L877 PolarHBondContact O-N 3.22Å; V874-L877 PolarHBondContact O-N 2.77Å; L875-L877 VanDerWaalsContact C-N 3.34Å; L877-I879 PolarHBondContact O-N 2.81Å; L877-L880 PolarHBondContact O-N 3.25Å; L877-V881 WeakPolarHBondContact O-CB 3.41Å; L877-V881 VanDerWaalsContact O-CG2 3.26Å; L877-V881 WeakPolarHBondContact O-CG2 3.25Å; L877-V881 PolarHBondContact O-N 3.39Å
878	F	87.9	Confident	87	Confident	124 Å²	124	88.4 Å²	88.4	54%	0.544	48%	0.476	S	S	.	.	H	α-helix	trans	-62.6	-40.5	175.6	-83.9	-57.9	0	0	0	112.4	V874 L875 I876 V881 I882	V874-F878 HydrophobicContact CG1-CD2 3.64Å; V874-F878 HydrophobicContact CG1-CE2 3.47Å; V874-F878 VanDerWaalsContact CG1-CE2 3.47Å; V874-F878 WeakPolarHBondContact O-CD2 2.93Å; V874-F878 PolarHBondContact O-N 3.36Å; L875-F878 PolarHBondContact O-N 2.79Å; I876-F878 PolarHBondContact O-N 2.65Å; F878-V881 PolarHBondContact O-N 3.44Å; F878-I882 WeakPolarHBondContact O-CB 3.47Å; F878-I882 WeakPolarHBondContact O-CD1 3.13Å; F878-I882 WeakPolarHBondContact O-CG1 3.37Å; F878-I882 PolarHBondContact O-N 3.01Å
879	I	89.5	Confident	87.1	Confident	110 Å²	110	88.7 Å²	88.7	56%	0.564	48%	0.475	S	S	*	.	H	α-helix	trans	-63.3	-43.1	175.3	-69.3	164.9	0	0	0	110.5	L875 I876 L877 I882 Y883	L875-I879 VanDerWaalsContact O-CG1 3.27Å; L875-I879 WeakPolarHBondContact O-CG1 3.24Å; L875-I879 PolarHBondContact O-N 2.73Å; I876-I879 PolarHBondContact O-N 2.74Å; L877-I879 PolarHBondContact O-N 2.81Å; I879-I882 PolarHBondContact O-N 3.08Å; I879-Y883 VanDerWaalsContact O-CB 3.25Å; I879-Y883 WeakPolarHBondContact O-CB 3.48Å; I879-Y883 PolarHBondContact O-N 3.48Å
880	L	90.7	Very high	87.5	Confident	104 Å²	104	94.2 Å²	94.2	55%	0.545	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-42.2	175.4	-73.6	174	0	0	0	111.9	I876 L877 Y883 F884	I876-L880 HydrophobicContact CG2-CD1 4.18Å; I876-L880 HydrophobicContact CG2-CG 4.5Å; I876-L880 WeakPolarHBondContact O-CG 3.12Å; I876-L880 PolarHBondContact O-N 2.66Å; L877-L880 PolarHBondContact O-N 3.25Å; L880-Y883 PolarHBondContact O-N 3.15Å; L880-F884 VanDerWaalsContact O-CB 3.31Å; L880-F884 WeakPolarHBondContact O-CB 3.07Å; L880-F884 PolarHBondContact O-N 3.37Å
881	V	90.4	Very high	87.7	Confident	65 Å²	65	93.1 Å²	93.1	39%	0.394	49%	0.485	S	S	.	.	H	α-helix	trans	-63.9	-44.9	175	169.6	0	0	0	0	110.8	L877 F878 F884 L885	L877-V881 WeakPolarHBondContact O-CB 3.41Å; L877-V881 VanDerWaalsContact O-CG2 3.26Å; L877-V881 WeakPolarHBondContact O-CG2 3.25Å; L877-V881 PolarHBondContact O-N 3.39Å; F878-V881 PolarHBondContact O-N 3.44Å; V881-F884 PolarHBondContact O-N 3.5Å; V881-L885 HydrophobicContact CG1-CD1 3.87Å; V881-L885 HydrophobicContact CG1-CG 4.27Å; V881-L885 WeakPolarHBondContact O-CB 2.95Å; V881-L885 VanDerWaalsContact O-CG 3.23Å; V881-L885 WeakPolarHBondContact O-CG 3.43Å; V881-L885 PolarHBondContact O-N 3.47Å
882	I	87.6	Confident	87.8	Confident	98 Å²	98	95.5 Å²	95.5	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-43.8	176	-69.9	164.6	0	0	0	110.2	F878 I879 F884 L885 V886	F878-I882 WeakPolarHBondContact O-CB 3.47Å; F878-I882 WeakPolarHBondContact O-CD1 3.13Å; F878-I882 WeakPolarHBondContact O-CG1 3.37Å; F878-I882 PolarHBondContact O-N 3.01Å; I879-I882 PolarHBondContact O-N 3.08Å; I882-F884 VanDerWaalsContact C-N 3.35Å; I882-F884 PolarHBondContact O-N 3.1Å; I882-L885 PolarHBondContact O-N 2.9Å; I882-V886 HydrophobicContact CG2-CG2 4.25Å; I882-V886 WeakPolarHBondContact O-CB 3.37Å; I882-V886 VanDerWaalsContact O-CG2 3.25Å; I882-V886 WeakPolarHBondContact O-CG2 3.42Å; I882-V886 PolarHBondContact O-N 2.93Å
883	Y	89.3	Confident	87.7	Confident	162 Å²	162	97.3 Å²	97.3	64%	0.635	50%	0.499	S	S	*	.	H	α-helix	trans	-60.4	-44.2	175.9	176.6	-97.6	0	0	0	111.6	I879 L880 V886 S887	I879-Y883 VanDerWaalsContact O-CB 3.25Å; I879-Y883 WeakPolarHBondContact O-CB 3.48Å; I879-Y883 PolarHBondContact O-N 3.48Å; L880-Y883 PolarHBondContact O-N 3.15Å; Y883-V886 PolarHBondContact O-N 2.95Å; Y883-S887 VanDerWaalsContact O-CB 3.32Å; Y883-S887 WeakPolarHBondContact O-CB 3.24Å; Y883-S887 PolarHBondContact O-N 3.49Å; Y883-S887 PolarHBondContact O-OG 3.31Å
884	F	92.3	Very high	87.7	Confident	131 Å²	131	99.9 Å²	99.9	58%	0.575	51%	0.505	S	S	*	.	H	α-helix	trans	-62.4	-47.7	174.8	179.3	-101.2	0	0	0	111.4	L880 V881 I882 V886 S887 L888	L880-F884 VanDerWaalsContact O-CB 3.31Å; L880-F884 WeakPolarHBondContact O-CB 3.07Å; L880-F884 PolarHBondContact O-N 3.37Å; V881-F884 PolarHBondContact O-N 3.5Å; I882-F884 VanDerWaalsContact C-N 3.35Å; I882-F884 PolarHBondContact O-N 3.1Å; F884-V886 PolarHBondContact O-N 3.18Å; F884-S887 PolarHBondContact O-N 3.03Å; F884-L888 HydrophobicContact CE1-CD1 3.82Å; F884-L888 HydrophobicContact CZ-CD1 4.11Å; F884-L888 VanDerWaalsContact O-CB 3.29Å; F884-L888 WeakPolarHBondContact O-CB 3.25Å; F884-L888 PolarHBondContact O-N 3.39Å
885	L	86.1	Confident	87.7	Confident	94 Å²	94	100 Å²	100	49%	0.492	51%	0.512	S	S	.	.	H	α-helix	trans	-62.3	-41.6	177.5	-72.8	173.2	0	0	0	112.2	V881 I882 L888 V889	V881-L885 HydrophobicContact CG1-CD1 3.87Å; V881-L885 HydrophobicContact CG1-CG 4.27Å; V881-L885 WeakPolarHBondContact O-CB 2.95Å; V881-L885 VanDerWaalsContact O-CG 3.23Å; V881-L885 WeakPolarHBondContact O-CG 3.43Å; V881-L885 PolarHBondContact O-N 3.47Å; I882-L885 PolarHBondContact O-N 2.9Å; L885-L888 PolarHBondContact O-N 3.06Å; L885-V889 WeakPolarHBondContact O-CB 3.25Å; L885-V889 VanDerWaalsContact O-CG2 3.22Å; L885-V889 WeakPolarHBondContact O-CG2 3.29Å; L885-V889 PolarHBondContact O-N 3.13Å
886	V	83.7	Confident	87.5	Confident	61 Å²	61	99.7 Å²	99.7	37%	0.37	51%	0.511	S	S	.	.	H	α-helix	trans	-65.9	-41.5	176	169.6	0	0	0	0	110.7	I882 Y883 F884 V889 R890	I882-V886 HydrophobicContact CG2-CG2 4.25Å; I882-V886 WeakPolarHBondContact O-CB 3.37Å; I882-V886 VanDerWaalsContact O-CG2 3.25Å; I882-V886 WeakPolarHBondContact O-CG2 3.42Å; I882-V886 PolarHBondContact O-N 2.93Å; Y883-V886 PolarHBondContact O-N 2.95Å; F884-V886 PolarHBondContact O-N 3.18Å; V886-V889 PolarHBondContact O-N 3.11Å; V886-R890 WeakPolarHBondContact O-CB 3.43Å; V886-R890 VanDerWaalsContact O-CG 3.3Å; V886-R890 WeakPolarHBondContact O-CG 3.32Å; V886-R890 PolarHBondContact O-N 3.3Å
887	S	89.2	Confident	87.1	Confident	45 Å²	45	98.9 Å²	98.9	32%	0.315	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-42.2	176.2	-59.7	0	0	0	0	111.6	Y883 F884 R890 G891	Y883-S887 VanDerWaalsContact O-CB 3.32Å; Y883-S887 WeakPolarHBondContact O-CB 3.24Å; Y883-S887 PolarHBondContact O-N 3.49Å; Y883-S887 PolarHBondContact O-OG 3.31Å; F884-S887 PolarHBondContact O-N 3.03Å; S887-R890 PolarHBondContact O-N 2.73Å; S887-G891 PolarHBondContact O-N 3.22Å
888	L	92.1	Very high	86.9	Confident	76 Å²	76	97.2 Å²	97.2	40%	0.398	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-45.6	175.4	-164	164.6	0	0	0	111	F884 L885 R890 G891 L892	F884-L888 HydrophobicContact CE1-CD1 3.82Å; F884-L888 HydrophobicContact CZ-CD1 4.11Å; F884-L888 VanDerWaalsContact O-CB 3.29Å; F884-L888 WeakPolarHBondContact O-CB 3.25Å; F884-L888 PolarHBondContact O-N 3.39Å; L885-L888 PolarHBondContact O-N 3.06Å; L888-R890 VanDerWaalsContact C-N 3.33Å; L888-R890 PolarHBondContact O-N 3.12Å; L888-G891 PolarHBondContact O-N 2.92Å; L888-L892 HydrophobicContact CD2-CD1 3.3Å; L888-L892 HydrophobicContact CD2-CG 3.78Å; L888-L892 WeakPolarHBondContact O-CB 3.48Å; L888-L892 WeakPolarHBondContact O-CG 3.29Å; L888-L892 PolarHBondContact O-N 3.44Å
889	V	82.7	Confident	86.9	Confident	92 Å²	92	95.7 Å²	95.7	56%	0.558	50%	0.496	S	S	*	.	H	α-helix	trans	-63.3	-38.3	176.1	169.1	0	0	0	0	111.7	L885 V886 K893	L885-V889 WeakPolarHBondContact O-CB 3.25Å; L885-V889 VanDerWaalsContact O-CG2 3.22Å; L885-V889 WeakPolarHBondContact O-CG2 3.29Å; L885-V889 PolarHBondContact O-N 3.13Å; V886-V889 PolarHBondContact O-N 3.11Å; V889-K893 WeakPolarHBondContact O-CB 3.42Å; V889-K893 PolarHBondContact O-N 3.43Å
890	R	86.4	Confident	86.4	Confident	169 Å²	169	94.5 Å²	94.5	64%	0.638	49%	0.491	S	S	*	.	H	α-helix	trans	-63.9	-50	174.4	-74.5	175.8	-175.3	180	2.8	111	V886 S887 L888 K893 E894	V886-R890 WeakPolarHBondContact O-CB 3.43Å; V886-R890 VanDerWaalsContact O-CG 3.3Å; V886-R890 WeakPolarHBondContact O-CG 3.32Å; V886-R890 PolarHBondContact O-N 3.3Å; S887-R890 PolarHBondContact O-N 2.73Å; L888-R890 VanDerWaalsContact C-N 3.33Å; L888-R890 PolarHBondContact O-N 3.12Å; R890-K893 WeakPolarHBondContact O-CB 3.43Å; R890-K893 PolarHBondContact O-N 3.39Å; R890-K893 VanDerWaalsContact O-N 3.16Å; R890-E894 PolarHBondContact O-N 3.41Å
891	G	87.9	Confident	85.8	Confident	42 Å²	42	95.3 Å²	95.3	43%	0.433	49%	0.49	S	S	.	.	H	α-helix	trans	-61.4	-44.4	177.9	0	0	0	0	0	113.6	S887 L888 K893 E894 A895	S887-G891 PolarHBondContact O-N 3.22Å; L888-G891 PolarHBondContact O-N 2.92Å; G891-K893 VanDerWaalsContact C-N 3.31Å; G891-K893 PolarHBondContact O-N 3.06Å; G891-E894 PolarHBondContact O-N 2.96Å; G891-A895 PolarHBondContact O-N 2.93Å
892	L	85.6	Confident	85.5	Confident	107 Å²	107	97.2 Å²	97.2	56%	0.56	50%	0.495	S	S	*	.	H	α-helix	trans	-62.5	-38	173.8	-78.1	179.7	0	0	0	112.1	L888 N896	L888-L892 HydrophobicContact CD2-CD1 3.3Å; L888-L892 HydrophobicContact CD2-CG 3.78Å; L888-L892 WeakPolarHBondContact O-CB 3.48Å; L888-L892 WeakPolarHBondContact O-CG 3.29Å; L888-L892 PolarHBondContact O-N 3.44Å; L892-N896 WeakPolarHBondContact O-CB 3.49Å; L892-N896 PolarHBondContact O-N 2.81Å
893	K	83	Confident	85.1	Confident	135 Å²	135	96.4 Å²	96.4	59%	0.587	49%	0.491	S	S	*	.	H	α-helix	trans	-68.3	-39.2	177.9	-175.1	-176.5	177.9	-168	0	111.5	V889 R890 G891 N897	V889-K893 WeakPolarHBondContact O-CB 3.42Å; V889-K893 PolarHBondContact O-N 3.43Å; R890-K893 WeakPolarHBondContact O-CB 3.43Å; R890-K893 PolarHBondContact O-N 3.39Å; R890-K893 VanDerWaalsContact O-N 3.16Å; G891-K893 VanDerWaalsContact C-N 3.31Å; G891-K893 PolarHBondContact O-N 3.06Å; K893-N897 WeakPolarHBondContact O-CB 3.47Å; K893-N897 PolarHBondContact O-N 2.77Å; K893-N897 PolarHBondContact O-ND2 3.16Å
894	E	87.2	Confident	84.4	Confident	127 Å²	127	95.1 Å²	95.1	59%	0.593	49%	0.489	S	S	*	.	H	α-helix	trans	-62.6	-52.1	175.2	-135.1	113.6	-130.8	0	0	110.5	R890 G891 N896 N897 D898	R890-E894 PolarHBondContact O-N 3.41Å; G891-E894 PolarHBondContact O-N 2.96Å; E894-N896 VanDerWaalsContact C-N 3.31Å; E894-N896 PolarHBondContact O-N 2.84Å; E894-N897 WeakPolarHBondContact O-CB 3.45Å; E894-N897 PolarHBondContact O-N 3.18Å; E894-N897 VanDerWaalsContact O-N 3.09Å; E894-D898 PolarHBondContact O-N 3.49Å
895	A	86.9	Confident	83.7	Confident	62 Å²	62	94.5 Å²	94.5	51%	0.512	49%	0.488	S	S	.	.	H	α-helix	trans	-58.6	-40.7	177.6	0	0	0	0	0	112.4	G891 D898 L899	G891-A895 PolarHBondContact O-N 2.93Å; A895-D898 PolarHBondContact O-N 3.4Å; A895-L899 VanDerWaalsContact O-CB 3.31Å; A895-L899 WeakPolarHBondContact O-CB 3.31Å; A895-L899 PolarHBondContact O-N 3.42Å
896	N	80.6	Confident	83.5	Confident	91 Å²	91	95.2 Å²	95.2	49%	0.487	49%	0.489	S	S	.	.	H	α-helix	trans	-71.9	-34.1	177.8	-156	-14	0	0	0	111.9	L892 E894 N900	L892-N896 WeakPolarHBondContact O-CB 3.49Å; L892-N896 PolarHBondContact O-N 2.81Å; E894-N896 VanDerWaalsContact C-N 3.31Å; E894-N896 PolarHBondContact O-N 2.84Å; N896-N900 WeakPolarHBondContact O-CB 3.46Å; N896-N900 PolarHBondContact O-N 2.86Å; N896-N900 PolarHBondContact O-ND2 3.08Å; N896-N900 PolarHBondContact OD1-ND2 3.21Å
897	N	80.2	Confident	83	Confident	76 Å²	76	98.1 Å²	98.1	41%	0.406	49%	0.493	S	S	.	.	H	α-helix	trans	-66.8	-42.1	172.9	-76.9	-17.6	0	0	0	111.5	K893 E894 N900 K901	K893-N897 WeakPolarHBondContact O-CB 3.47Å; K893-N897 PolarHBondContact O-N 2.77Å; K893-N897 PolarHBondContact O-ND2 3.16Å; E894-N897 WeakPolarHBondContact O-CB 3.45Å; E894-N897 PolarHBondContact O-N 3.18Å; E894-N897 VanDerWaalsContact O-N 3.09Å; N897-N900 PolarHBondContact O-N 3.3Å; N897-K901 WeakPolarHBondContact O-CG 3.47Å; N897-K901 PolarHBondContact O-N 2.98Å
898	D	86.8	Confident	82.3	Confident	71 Å²	71	98.4 Å²	98.4	38%	0.38	49%	0.493	S	S	.	.	H	α-helix	trans	-69.6	-39.3	178.2	-74.2	-14	0	0	0	111.6	E894 A895 N900 K901 Q902	E894-D898 PolarHBondContact O-N 3.49Å; A895-D898 PolarHBondContact O-N 3.4Å; D898-N900 VanDerWaalsContact C-N 3.34Å; D898-N900 PolarHBondContact O-N 2.97Å; D898-K901 WeakPolarHBondContact O-CB 3.37Å; D898-K901 PolarHBondContact O-N 3.46Å; D898-K901 IonicContact OD1-NZ 3.88Å; D898-K901 PolarHBondContact OD1-NZ 2.86Å; D898-Q902 WeakPolarHBondContact O-CG 3.2Å; D898-Q902 PolarHBondContact O-N 2.84Å
899	L	86.8	Confident	81.6	Confident	91 Å²	91	99.6 Å²	99.6	48%	0.476	50%	0.497	S	S	.	.	H	α-helix	trans	-61.1	-42	170.7	-171.9	67.4	0	0	0	111.8	A895 K901 Q902 L903	A895-L899 VanDerWaalsContact O-CB 3.31Å; A895-L899 WeakPolarHBondContact O-CB 3.31Å; A895-L899 PolarHBondContact O-N 3.42Å; L899-K901 VanDerWaalsContact C-N 3.35Å; L899-K901 PolarHBondContact O-N 3.46Å; L899-Q902 PolarHBondContact O-N 2.98Å; L899-L903 HydrophobicContact CG-CD1 4.3Å; L899-L903 WeakPolarHBondContact O-CB 3.4Å; L899-L903 WeakPolarHBondContact O-CG 3.33Å; L899-L903 PolarHBondContact O-N 3.39Å
900	N	79.1	Confident	81.2	Confident	85 Å²	85	101 Å²	101	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-65.1	-37	175	-82.2	-57.9	0	0	0	112.3	N896 N897 D898 F904	N896-N900 WeakPolarHBondContact O-CB 3.46Å; N896-N900 PolarHBondContact O-N 2.86Å; N896-N900 PolarHBondContact O-ND2 3.08Å; N896-N900 PolarHBondContact OD1-ND2 3.21Å; N897-N900 PolarHBondContact O-N 3.3Å; D898-N900 VanDerWaalsContact C-N 3.34Å; D898-N900 PolarHBondContact O-N 2.97Å; N900-F904 WeakPolarHBondContact O-CB 3.33Å; N900-F904 PolarHBondContact O-N 3.49Å
901	K	78.6	Confident	80.4	Confident	122 Å²	122	99.7 Å²	99.7	53%	0.53	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-44.3	173.7	-72.8	173.5	-161.7	155.1	0	111	N897 D898 L899 F904 Q905	N897-K901 WeakPolarHBondContact O-CG 3.47Å; N897-K901 PolarHBondContact O-N 2.98Å; D898-K901 WeakPolarHBondContact O-CB 3.37Å; D898-K901 PolarHBondContact O-N 3.46Å; D898-K901 IonicContact OD1-NZ 3.88Å; D898-K901 PolarHBondContact OD1-NZ 2.86Å; L899-K901 VanDerWaalsContact C-N 3.35Å; L899-K901 PolarHBondContact O-N 3.46Å; K901-F904 PolarHBondContact O-N 3.28Å; K901-Q905 WeakPolarHBondContact O-CB 3.35Å; K901-Q905 WeakPolarHBondContact O-CG 3.4Å; K901-Q905 PolarHBondContact O-N 3.25Å
902	Q	82.9	Confident	79.7	Confident	105 Å²	105	106.3 Å²	106.3	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-50.6	176.3	-72	175.4	17.1	0	0	110.9	D898 L899 F904 Q905 E906	D898-Q902 WeakPolarHBondContact O-CG 3.2Å; D898-Q902 PolarHBondContact O-N 2.84Å; L899-Q902 PolarHBondContact O-N 2.98Å; Q902-F904 PolarHBondContact O-N 2.74Å; Q902-Q905 WeakPolarHBondContact O-CB 3.4Å; Q902-Q905 PolarHBondContact O-N 2.62Å; Q902-Q905 VanDerWaalsContact O-N 3.1Å; Q902-E906 WeakPolarHBondContact O-CG 3.19Å; Q902-E906 PolarHBondContact O-N 3.29Å
903	L	79.4	Confident	79.3	Confident	81 Å²	81	106.8 Å²	106.8	42%	0.424	51%	0.505	S	S	.	.	H	α-helix	trans	-58.8	-35	175.7	-75.1	170.5	0	0	0	112.8	L899 R907	L899-L903 HydrophobicContact CG-CD1 4.3Å; L899-L903 WeakPolarHBondContact O-CB 3.4Å; L899-L903 WeakPolarHBondContact O-CG 3.33Å; L899-L903 PolarHBondContact O-N 3.39Å; L903-R907 VanDerWaalsContact O-CB 3.29Å; L903-R907 WeakPolarHBondContact O-CB 2.8Å; L903-R907 PolarHBondContact O-N 3.49Å
904	F	75.6	Confident	78.8	Confident	135 Å²	135	105.5 Å²	105.5	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-72.2	-41.9	176.8	-154.1	-83	0	0	0	111.3	N900 K901 Q902 R907 T908	N900-F904 WeakPolarHBondContact O-CB 3.33Å; N900-F904 PolarHBondContact O-N 3.49Å; K901-F904 PolarHBondContact O-N 3.28Å; Q902-F904 PolarHBondContact O-N 2.74Å; F904-R907 PolarHBondContact O-N 3.32Å; F904-T908 HydrophobicContact CD1-CG2 3.82Å; F904-T908 HydrophobicContact CE1-CG2 3.78Å; F904-T908 VanDerWaalsContact O-CG2 3.31Å; F904-T908 WeakPolarHBondContact O-CG2 3.16Å; F904-T908 PolarHBondContact O-N 3.47Å; F904-T908 PolarHBondContact O-OG1 3.1Å; F904-T908 VanDerWaalsContact O-OG1 3.14Å
905	Q	76.7	Confident	78	Confident	117 Å²	117	107.3 Å²	107.3	55%	0.547	51%	0.51	S	S	.	.	H	α-helix	trans	-60.1	-50.8	174.3	-77.3	175.2	-28.5	0	0	110.6	K901 Q902 R907 T908 E909	K901-Q905 WeakPolarHBondContact O-CB 3.35Å; K901-Q905 WeakPolarHBondContact O-CG 3.4Å; K901-Q905 PolarHBondContact O-N 3.25Å; Q902-Q905 WeakPolarHBondContact O-CB 3.4Å; Q902-Q905 PolarHBondContact O-N 2.62Å; Q902-Q905 VanDerWaalsContact O-N 3.1Å; Q905-R907 PolarHBondContact O-N 2.86Å; Q905-T908 WeakPolarHBondContact CA-OG1 3.49Å; Q905-T908 CarbonylContact O-C 3.58Å; Q905-T908 PolarHBondContact O-N 3.29Å; Q905-T908 PolarHBondContact O-OG1 2.86Å; Q905-E909 WeakPolarHBondContact O-CG 3.24Å; Q905-E909 PolarHBondContact O-N 3Å
906	E	81.2	Confident	77.4	Confident	109 Å²	109	111.8 Å²	111.8	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-55.4	-49.7	175.8	-73.3	178.9	167	0	0	111.7	Q902 T908 E909 E910	Q902-E906 WeakPolarHBondContact O-CG 3.19Å; Q902-E906 PolarHBondContact O-N 3.29Å; E906-T908 VanDerWaalsContact C-N 3.29Å; E906-T908 PolarHBondContact O-N 2.78Å; E906-E909 PolarHBondContact O-N 3.3Å; E906-E910 WeakPolarHBondContact O-CG 3.2Å; E906-E910 PolarHBondContact O-N 2.86Å
907	R	74.6	Confident	76.9	Confident	123 Å²	123	113.3 Å²	113.3	46%	0.464	52%	0.524	S	S	.	.	H	α-helix	trans	-62.5	-35.1	177.7	-166.7	-174.9	-67.9	165.3	0.2	112.2	L903 F904 Q905 K911	L903-R907 VanDerWaalsContact O-CB 3.29Å; L903-R907 WeakPolarHBondContact O-CB 2.8Å; L903-R907 PolarHBondContact O-N 3.49Å; F904-R907 PolarHBondContact O-N 3.32Å; Q905-R907 PolarHBondContact O-N 2.86Å; R907-K911 WeakPolarHBondContact O-CB 3.19Å; R907-K911 VanDerWaalsContact O-CG 3.28Å; R907-K911 WeakPolarHBondContact O-CG 3.32Å; R907-K911 PolarHBondContact O-N 3.06Å; R907-K911 VanDerWaalsContact O-N 3.09Å
908	T	73.3	Confident	76.1	Confident	51 Å²	51	112 Å²	112	31%	0.313	52%	0.524	S	S	.	.	H	α-helix	trans	-74	-34.4	175.9	56.3	0	0	0	0	112.8	F904 Q905 E906 K911 R912	F904-T908 HydrophobicContact CD1-CG2 3.82Å; F904-T908 HydrophobicContact CE1-CG2 3.78Å; F904-T908 VanDerWaalsContact O-CG2 3.31Å; F904-T908 WeakPolarHBondContact O-CG2 3.16Å; F904-T908 PolarHBondContact O-N 3.47Å; F904-T908 PolarHBondContact O-OG1 3.1Å; F904-T908 VanDerWaalsContact O-OG1 3.14Å; Q905-T908 WeakPolarHBondContact CA-OG1 3.49Å; Q905-T908 CarbonylContact O-C 3.58Å; Q905-T908 PolarHBondContact O-N 3.29Å; Q905-T908 PolarHBondContact O-OG1 2.86Å; E906-T908 VanDerWaalsContact C-N 3.29Å; E906-T908 PolarHBondContact O-N 2.78Å; T908-K911 PolarHBondContact O-N 3.02Å; T908-R912 WeakPolarHBondContact O-CB 3.11Å; T908-R912 WeakPolarHBondContact O-CG 3.09Å; T908-R912 PolarHBondContact O-N 2.8Å
909	E	77.7	Confident	74.6	Confident	101 Å²	101	110.8 Å²	110.8	47%	0.472	53%	0.528	S	S	.	.	H	α-helix	trans	-69.3	-44.2	174.7	-74.9	-175	-172.7	0	0	111.6	Q905 E906 K911 R912 K913	Q905-E909 WeakPolarHBondContact O-CG 3.24Å; Q905-E909 PolarHBondContact O-N 3Å; E906-E909 PolarHBondContact O-N 3.3Å; E909-K911 VanDerWaalsContact C-N 3.33Å; E909-K911 PolarHBondContact O-N 2.99Å; E909-R912 CarbonylContact O-C 3.57Å; E909-R912 PolarHBondContact O-N 3.22Å; E909-R912 VanDerWaalsContact O-N 3.15Å; E909-K913 WeakPolarHBondContact O-CB 3.36Å; E909-K913 VanDerWaalsContact O-CG 3.31Å; E909-K913 WeakPolarHBondContact O-CG 2.99Å; E909-K913 PolarHBondContact O-N 3.44Å
910	E	73.9	Confident	73.1	Confident	122 Å²	122	111.6 Å²	111.6	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-57	-46.8	171.3	-74.7	-173.3	160.5	0	0	110.9	E906 R912 K913 I914	E906-E910 WeakPolarHBondContact O-CG 3.2Å; E906-E910 PolarHBondContact O-N 2.86Å; E910-R912 VanDerWaalsContact C-N 3.33Å; E910-R912 PolarHBondContact O-N 3.38Å; E910-K913 PolarHBondContact O-N 3.2Å; E910-I914 VanDerWaalsContact O-CG1 3.24Å; E910-I914 WeakPolarHBondContact O-CG1 3.4Å; E910-I914 PolarHBondContact O-N 3.5Å
911	K	71.3	Confident	71.9	Confident	141 Å²	141	113.5 Å²	113.5	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-60.6	-39.8	174.7	-77.6	-177.2	176.8	-166.6	0	112.8	R907 T908 E909 F915	R907-K911 WeakPolarHBondContact O-CB 3.19Å; R907-K911 VanDerWaalsContact O-CG 3.28Å; R907-K911 WeakPolarHBondContact O-CG 3.32Å; R907-K911 PolarHBondContact O-N 3.06Å; R907-K911 VanDerWaalsContact O-N 3.09Å; T908-K911 PolarHBondContact O-N 3.02Å; E909-K911 VanDerWaalsContact C-N 3.33Å; E909-K911 PolarHBondContact O-N 2.99Å; K911-F915 WeakPolarHBondContact O-CB 3.11Å; K911-F915 PolarHBondContact O-N 2.67Å
912	R	71.7	Confident	70.3	Confident	181 Å²	181	115 Å²	115	68%	0.683	56%	0.563	S	S	*	*	H	α-helix	trans	-66.3	-39.4	174.9	-78.2	179.7	-173.8	-174.8	2.7	111.8	T908 E909 E910 F915 K916	T908-R912 WeakPolarHBondContact O-CB 3.11Å; T908-R912 WeakPolarHBondContact O-CG 3.09Å; T908-R912 PolarHBondContact O-N 2.8Å; E909-R912 CarbonylContact O-C 3.57Å; E909-R912 PolarHBondContact O-N 3.22Å; E909-R912 VanDerWaalsContact O-N 3.15Å; E910-R912 VanDerWaalsContact C-N 3.33Å; E910-R912 PolarHBondContact O-N 3.38Å; R912-F915 PolarHBondContact O-N 3.27Å; R912-K916 WeakPolarHBondContact O-CB 3.49Å; R912-K916 WeakPolarHBondContact O-CG 3.37Å; R912-K916 PolarHBondContact O-N 2.95Å
913	K	78	Confident	68.2	Low	117 Å²	117	112.7 Å²	112.7	51%	0.509	57%	0.568	S	S	.	*	H	α-helix	trans	-64.8	-46.2	175.9	-72.2	170.5	-175.5	172.7	0	110.7	E909 E910 F915 K916 M917	E909-K913 WeakPolarHBondContact O-CB 3.36Å; E909-K913 VanDerWaalsContact O-CG 3.31Å; E909-K913 WeakPolarHBondContact O-CG 2.99Å; E909-K913 PolarHBondContact O-N 3.44Å; E910-K913 PolarHBondContact O-N 3.2Å; K913-F915 VanDerWaalsContact C-N 3.33Å; K913-F915 PolarHBondContact O-N 3.32Å; K913-K916 PolarHBondContact O-N 2.74Å; K913-M917 HydrophobicContact CB-CE 4.48Å; K913-M917 WeakPolarHBondContact O-CG 3.37Å; K913-M917 PolarHBondContact O-N 3.13Å
914	I	73.1	Confident	66	Low	108 Å²	108	117.7 Å²	117.7	55%	0.554	59%	0.59	S	S	*	*	H	α-helix	trans	-60.9	-41.8	174.9	-64.6	162.8	0	0	0	110.8	E910 M917 A918	E910-I914 VanDerWaalsContact O-CG1 3.24Å; E910-I914 WeakPolarHBondContact O-CG1 3.4Å; E910-I914 PolarHBondContact O-N 3.5Å; I914-M917 PolarHBondContact O-N 3.15Å; I914-A918 VanDerWaalsContact O-CB 3.29Å; I914-A918 WeakPolarHBondContact O-CB 3.08Å; I914-A918 PolarHBondContact O-N 3.34Å
915	F	70.3	Confident	64	Low	164 Å²	164	117.1 Å²	117.1	72%	0.719	60%	0.599	S	S	*	*	H	α-helix	trans	-66.9	-37.6	177	-166.3	-93.1	0	0	0	112.5	K911 R912 K913 G919	K911-F915 WeakPolarHBondContact O-CB 3.11Å; K911-F915 PolarHBondContact O-N 2.67Å; R912-F915 PolarHBondContact O-N 3.27Å; K913-F915 VanDerWaalsContact C-N 3.33Å; K913-F915 PolarHBondContact O-N 3.32Å; F915-G919 PolarHBondContact O-N 2.92Å
916	K	74.3	Confident	61.7	Low	156 Å²	156	116.1 Å²	116.1	68%	0.678	61%	0.611	S	S	*	*	H	α-helix	trans	-65.4	-44.3	173.1	-75.8	-179.3	178.8	-171.8	0	111.7	R912 K913 G919 T920	R912-K916 WeakPolarHBondContact O-CB 3.49Å; R912-K916 WeakPolarHBondContact O-CG 3.37Å; R912-K916 PolarHBondContact O-N 2.95Å; K913-K916 PolarHBondContact O-N 2.74Å; K916-G919 PolarHBondContact O-N 3.13Å; K916-T920 PolarHBondContact O-N 3.27Å; K916-T920 PolarHBondContact O-OG1 3.21Å
917	M	70.2	Confident	59.5	Low	124 Å²	124	117 Å²	117	61%	0.611	62%	0.624	S	S	*	*	H	α-helix	trans	-64.3	-44.7	176.9	-69.2	176.9	-163.8	0	0	111.9	K913 I914 G919 T920 V921	K913-M917 HydrophobicContact CB-CE 4.48Å; K913-M917 WeakPolarHBondContact O-CG 3.37Å; K913-M917 PolarHBondContact O-N 3.13Å; I914-M917 PolarHBondContact O-N 3.15Å; M917-G919 VanDerWaalsContact C-N 3.31Å; M917-G919 PolarHBondContact O-N 2.79Å; M917-T920 WeakPolarHBondContact CA-OG1 3.37Å; M917-T920 PolarHBondContact O-N 3.33Å; M917-T920 PolarHBondContact O-OG1 3.06Å; M917-V921 VanDerWaalsContact O-CG2 3.28Å; M917-V921 WeakPolarHBondContact O-CG2 3.5Å; M917-V921 PolarHBondContact O-N 3.46Å
918	A	62.5	Low	57.2	Low	49 Å²	49	117.8 Å²	117.8	41%	0.405	64%	0.642	S	S	.	*	H	α-helix	trans	-64	-36.5	175.4	0	0	0	0	0	112.1	I914 L922	I914-A918 VanDerWaalsContact O-CB 3.29Å; I914-A918 WeakPolarHBondContact O-CB 3.08Å; I914-A918 PolarHBondContact O-N 3.34Å; A918-L922 PolarHBondContact O-N 3.05Å
919	G	56	Low	55.4	Low	45 Å²	45	121.4 Å²	121.4	46%	0.464	66%	0.664	S	S	.	*	H	α-helix	trans	-69.3	-33.2	174.5	0	0	0	0	0	113.9	F915 K916 M917 G923	F915-G919 PolarHBondContact O-N 2.92Å; K916-G919 PolarHBondContact O-N 3.13Å; M917-G919 VanDerWaalsContact C-N 3.31Å; M917-G919 PolarHBondContact O-N 2.79Å; G919-G923 PolarHBondContact O-N 2.86Å
920	T	54.2	Low	53.3	Low	108 Å²	108	124.4 Å²	124.4	66%	0.663	68%	0.682	S	S	*	*	H	α-helix	trans	-78.5	-26.1	175.1	44.9	0	0	0	0	113.3	K916 M917 L922	K916-T920 PolarHBondContact O-N 3.27Å; K916-T920 PolarHBondContact O-OG1 3.21Å; M917-T920 WeakPolarHBondContact CA-OG1 3.37Å; M917-T920 PolarHBondContact O-N 3.33Å; M917-T920 PolarHBondContact O-OG1 3.06Å; T920-L922 VanDerWaalsContact C-N 3.34Å
921	V	53.8	Low	51.6	Low	124 Å²	124	124.4 Å²	124.4	75%	0.752	69%	0.69	S	S	*	*	H	α-helix	trans	-79.5	-19	174.2	175.5	0	0	0	0	111.9	M917	M917-V921 VanDerWaalsContact O-CG2 3.28Å; M917-V921 WeakPolarHBondContact O-CG2 3.5Å; M917-V921 PolarHBondContact O-N 3.46Å
922	L	45.8	Very low	49.9	Very low	153 Å²	153	123.4 Å²	123.4	80%	0.801	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	17.1	172.4	-70.6	167.8	0	0	0	112.9	A918 T920	A918-L922 PolarHBondContact O-N 3.05Å; T920-L922 VanDerWaalsContact C-N 3.34Å
923	G	37.7	Very low	48	Very low	57 Å²	57	124.1 Å²	124.1	59%	0.588	71%	0.709	S	S	*	*			trans	-112.8	52	-174.8	0	0	0	0	0	113.6	G919	G919-G923 PolarHBondContact O-N 2.86Å
924	E	35	Very low	45.9	Very low	187 Å²	187	128.3 Å²	128.3	87%	0.874	73%	0.728	S	S	*	*			trans	-104.6	139.4	155.5	-99.4	-179.9	139.5	0	0	109.3
925	P	31.8	Very low	43.8	Very low	123 Å²	123	130.9 Å²	130.9	80%	0.799	74%	0.741	S	S	*	*			trans	-85.7	160.6	-155.1	34.9	-34.4	0	0	0	112.9
926	A	29.9	Very low	42	Very low	95 Å²	95	130.4 Å²	130.4	79%	0.785	74%	0.741	S	S	*	*			trans	92.4	78.4	165.4	0	0	0	0	0	118.2
927	V	34.5	Very low	40.2	Very low	129 Å²	129	129.1 Å²	129.1	78%	0.782	74%	0.74	S	S	*	*			trans	-143.3	112.6	133.5	-178	0	0	0	0	109.2	V929	V927-V929 PolarHBondContact O-N 3.39Å
928	T	27.4	Very low	38.3	Very low	139 Å²	139	130.3 Å²	130.3	85%	0.853	75%	0.749	S	S	*	*			trans	-54.7	108.3	166.4	25.6	0	0	0	0	111.1
929	V	34.6	Very low	36.9	Very low	126 Å²	126	133 Å²	133	76%	0.764	76%	0.764	S	S	*	*			trans	-104.3	115.2	166.7	177.9	0	0	0	0	108.4	V927 V931	V927-V929 PolarHBondContact O-N 3.39Å; V929-V931 PolarHBondContact O-N 3.3Å
930	L	34.3	Very low	35.8	Very low	164 Å²	164	140 Å²	140	86%	0.859	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-50	120.6	177.4	-92.6	91.5	0	0	0	111.7
931	V	38	Very low	35	Very low	123 Å²	123	139.1 Å²	139.1	75%	0.745	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75.7	137.4	159.1	177.5	0	0	0	0	107.6	V929 Q933	V929-V931 PolarHBondContact O-N 3.3Å; V931-Q933 PolarHBondContact O-N 2.93Å; V931-Q933 VanDerWaalsContact O-N 3.12Å
932	P	34.4	Very low	34.2	Very low	119 Å²	119	139.3 Å²	139.3	77%	0.773	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.9	117.3	-179.6	27.1	-31.9	0	0	0	109.8	K934	P932-K934 PolarHBondContact O-N 2.85Å
933	Q	31.6	Very low	33.7	Very low	196 Å²	196	141.2 Å²	141.2	92%	0.916	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-58.1	117.3	174.9	-99.6	175.7	-19.6	0	0	110.4	V931	V931-Q933 PolarHBondContact O-N 2.93Å; V931-Q933 VanDerWaalsContact O-N 3.12Å
934	K	34.8	Very low	33.5	Very low	206 Å²	206	146.3 Å²	146.3	90%	0.896	79%	0.785	S	S	*	*			trans	-86.1	111.5	156.8	-101.1	-176.5	176	-176.9	0	108.6	P932 H936	P932-K934 PolarHBondContact O-N 2.85Å; K934-H936 PolarHBondContact O-N 3.44Å
935	L	29.1	Very low	33.6	Very low	161 Å²	161	147.8 Å²	147.8	84%	0.843	78%	0.782	S	S	*	*			trans	-48.5	120.7	165.1	-150.5	81.3	0	0	0	110.7
936	H	33.1	Very low	33.6	Very low	155 Å²	155	148.6 Å²	148.6	72%	0.718	78%	0.78	S	S	*	*			trans	-179.5	111.2	133.7	-113.1	-105.8	0	0	0	112.4	K934	K934-H936 PolarHBondContact O-N 3.44Å
937	I	36.2	Very low	33.9	Very low	128 Å²	128	153.1 Å²	153.1	66%	0.656	78%	0.782	S	S	*	*			trans	58.9	99.3	132.7	-52.6	-174.6	0	0	0	118.6
938	N	30.7	Very low	33.8	Very low	149 Å²	149	152.8 Å²	152.8	80%	0.797	78%	0.776	S	S	*	*				51.2	134	127.4	-72.7	1.1	0	0	0	123.3
939	C	31.6	Very low	34.2	Very low	105 Å²	105	152.5 Å²	152.5	71%	0.709	77%	0.769	S	S	*	*			trans	99.2	103	140.3	-72.3	0	0	0	0	119.3
940	F	33.3	Very low	34.3	Very low	194 Å²	194	152.5 Å²	152.5	85%	0.851	76%	0.761	S	S	*	*				106.9	110.4	115.3	-105.7	-101.4	0	0	0	119
941	A	38.1	Very low	34.1	Very low	89 Å²	89	154 Å²	154	74%	0.736	76%	0.755	S	S	*	*			trans	69.1	148.1	135.1	0	0	0	0	0	119.7
942	D	35.5	Very low	33.8	Very low	128 Å²	128	154.8 Å²	154.8	68%	0.684	76%	0.755	S	S	*	*			cis	-172.3	158.7	-25.7	-163.8	8.2	0	0	0	105.4
943	R	35.6	Very low	33.9	Very low	193 Å²	193	157.3 Å²	157.3	73%	0.728	76%	0.757	S	S	*	*			trans	76.6	115.3	152.9	-81.6	167.4	-158.6	-151.1	-2.7	125.1
944	K	34.7	Very low	33.8	Very low	164 Å²	164	153.7 Å²	153.7	71%	0.713	75%	0.748	S	S	*	*				59.5	142	116.9	-68.5	-176.2	-179.7	179.5	0	117.8
945	R	35.7	Very low	33.8	Very low	217 Å²	217	151.9 Å²	151.9	82%	0.819	74%	0.74	S	S	*	*			cis	-172.4	156.9	32.7	-145.9	176.8	-76	-151.7	0.2	111.1
946	N	32.5	Very low	34.1	Very low	140 Å²	140	153.2 Å²	153.2	75%	0.749	74%	0.739	S	S	*	*			trans	-39.1	155.2	169.5	-85.1	-5.3	0	0	0	119.3
947	K	35.7	Very low	34	Very low	190 Å²	190	149.3 Å²	149.3	83%	0.826	74%	0.741	S	S	*	*				-178.3	114.9	112.1	-100.1	180	173.7	-177.8	0	113.7
948	D	33.7	Very low	33.9	Very low	123 Å²	123	151.4 Å²	151.4	66%	0.658	75%	0.752	S	S	*	*				47.4	134.1	124.5	-46	-25.6	0	0	0	123.8
949	D	36.2	Very low	34.2	Very low	133 Å²	133	149 Å²	149	71%	0.711	75%	0.745	S	S	*	*			trans	95.8	114.7	131.7	-85.7	8	0	0	0	124.5
950	Q	35.6	Very low	34	Very low	126 Å²	126	151 Å²	151	59%	0.589	74%	0.744	S	S	*	*				91.4	122	124.6	-74.8	-176.6	42.2	0	0	124
951	R	30.5	Very low	33.9	Very low	194 Å²	194	151.9 Å²	151.9	73%	0.732	75%	0.747	S	S	*	*				74.2	117.4	128.8	-87.8	-174.3	-101.3	-134.3	-4.8	123
952	D	30.7	Very low	33.3	Very low	140 Å²	140	156.5 Å²	156.5	75%	0.749	75%	0.746	S	S	*	*				41.9	125.5	121.2	-66.9	-25.4	0	0	0	121.5
953	Q	36.4	Very low	33.1	Very low	173 Å²	173	157.3 Å²	157.3	81%	0.808	75%	0.75	S	S	*	*				172.2	113.5	111.4	-89.4	176	37.3	0	0	110.5
954	T	31.1	Very low	33	Very low	119 Å²	119	152.8 Å²	152.8	73%	0.73	75%	0.748	S	S	*	*				64.8	141	96	-8	0	0	0	0	118.5
955	K	34.4	Very low	32.8	Very low	168 Å²	168	156.1 Å²	156.1	73%	0.73	76%	0.756	S	S	*	*			trans	101.2	137.5	157.2	-66.9	167.9	176.7	169.7	0	115.9
956	K	34.2	Very low	32.5	Very low	190 Å²	190	150.8 Å²	150.8	83%	0.826	75%	0.752	S	S	*	*			cis	-174.3	153.5	16.3	-113.2	163.7	-176.1	-174.4	0	111.7
957	G	32.9	Very low	32.3	Very low	73 Å²	73	152.9 Å²	152.9	75%	0.753	76%	0.757	S	S	*	*			trans	108.5	92.1	149	0	0	0	0	0	118
958	L	34.1	Very low	32.1	Very low	172 Å²	172	148.8 Å²	148.8	90%	0.901	75%	0.752	S	S	*	*				62	154.8	73.4	-110.6	89.4	0	0	0	116.8
959	P	35.6	Very low	31.9	Very low	98 Å²	98	152.4 Å²	152.4	64%	0.636	76%	0.762	S	S	*	*			cis	-135.7	151.4	-33.5	33.1	-13.2	0	0	0	114.7
960	Q	28.7	Very low	31.5	Very low	147 Å²	147	155.6 Å²	155.6	69%	0.687	77%	0.77	S	S	*	*				67.3	118.8	103.3	-152.6	177.5	-7.1	0	0	119.5
961	K	29.8	Very low	31.1	Very low	213 Å²	213	159 Å²	159	93%	0.926	78%	0.783	S	S	*	*			trans	-142.9	129.7	137.3	-159.6	171.8	-175.3	177.5	0	109.9
962	R	25.8	Very low	31.1	Very low	186 Å²	186	160 Å²	160	70%	0.702	79%	0.793	S	S	*	*			trans	-119.6	172.9	-171	-159	-171.9	-83.2	-179.1	-4.8	107.7
963	D	31.8	Very low	31	Very low	144 Å²	144	161.7 Å²	161.7	77%	0.77	80%	0.801	S	S	*	*			trans	100.8	135.9	163.5	-47.2	-21.3	0	0	0	113.9
964	S	34	Very low	30.6	Very low	98 Å²	98	157.8 Å²	157.8	69%	0.685	79%	0.793	S	S	*	*			cis	-167.1	153.6	6.1	-148.5	0	0	0	0	109.9
965	R	28.8	Very low	30.6	Very low	234 Å²	234	159.5 Å²	159.5	88%	0.883	80%	0.796	S	S	*	*			trans	51.5	118.1	143.6	-84	175.9	169.5	172.5	-2.5	120.5
966	S	30.5	Very low	30.5	Very low	105 Å²	105	158 Å²	158	73%	0.734	80%	0.801	S	S	*	*				157.3	122.8	79	-156.9	0	0	0	0	112.1
967	H	27.4	Very low	30.2	Very low	185 Å²	185	159.9 Å²	159.9	86%	0.856	80%	0.803	S	S	*	*			trans	27.7	139.8	144.8	-81	-99.4	0	0	0	123
968	S	33	Very low	30	Very low	104 Å²	104	163.3 Å²	163.3	73%	0.727	80%	0.804	S	S	*	*			trans	112.2	120.4	151.3	-158.4	0	0	0	0	113.4
969	F	29.6	Very low	29.9	Very low	198 Å²	198	161.2 Å²	161.2	87%	0.868	80%	0.804	S	S	*	*			cis	-161.9	144	8.2	-138.9	-116.7	0	0	0	108.2
970	K	27.3	Very low	29.5	Very low	200 Å²	200	165.5 Å²	165.5	87%	0.87	82%	0.815	S	S	*	*			trans	-63.9	158.3	179.6	-74.6	166.7	169.9	176.1	0	112.8
971	K	27.5	Very low	29.7	Very low	198 Å²	198	167.3 Å²	167.3	86%	0.861	82%	0.824	S	S	*	*				139.3	90.1	128.8	-161.7	175.7	-162.9	-178.9	0	113.7
972	F	30	Very low	29.6	Very low	216 Å²	216	164.6 Å²	164.6	95%	0.947	82%	0.819	S	S	*	*			trans	-166.1	66.8	144.4	-130.7	-91.5	0	0	0	110.9
973	L	28.4	Very low	29.9	Very low	175 Å²	175	158.8 Å²	158.8	92%	0.916	82%	0.817	S	S	*	*			trans	-145.9	98.8	168.5	-124.8	168	0	0	0	106
974	S	28.3	Very low	29.8	Very low	91 Å²	91	157.8 Å²	157.8	64%	0.636	82%	0.816	S	S	*	*			trans	-172.5	132.5	167.7	57.5	0	0	0	0	109.7
975	I	30.5	Very low	29.7	Very low	154 Å²	154	159.1 Å²	159.1	79%	0.79	82%	0.816	S	S	*	*			trans	82.8	115.9	152.9	-55.8	151.9	0	0	0	113.5
976	T	32.5	Very low	29.7	Very low	138 Å²	138	156.5 Å²	156.5	85%	0.847	81%	0.811	S	S	*	*			cis	-151.4	128.1	24.8	20.7	0	0	0	0	111
977	R	27.9	Very low	29.6	Very low	228 Å²	228	155.6 Å²	155.6	86%	0.86	81%	0.809	S	S	*	*			trans	-105.2	158.5	148.4	-164.4	175	-178.4	137.1	-2.4	104.8
978	D	29.3	Very low	29.6	Very low	145 Å²	145	152.6 Å²	152.6	78%	0.775	80%	0.804	S	S	*	*			trans	123.6	105	162.6	-56.2	-15.9	0	0	0	113.4
979	S	32.1	Very low	29.4	Very low	129 Å²	129	156.2 Å²	156.2	90%	0.902	81%	0.807	S	S	*	*			trans	-174.4	88.2	132.7	-73	0	0	0	0	107.4
980	E	26.9	Very low	29.2	Very low	188 Å²	188	155.3 Å²	155.3	88%	0.879	81%	0.805	S	S	*	*			trans	-88.8	141.6	156.2	-108.9	166.2	131.5	0	0	107.5
981	E	32.6	Very low	29.1	Very low	184 Å²	184	157.2 Å²	157.2	86%	0.86	81%	0.807	S	S	*	*			trans	164.5	142.2	156	-96.9	176.2	-160.2	0	0	106.1
982	D	28	Very low	29.1	Very low	156 Å²	156	153.3 Å²	153.3	83%	0.834	80%	0.802	S	S	*	*			cis	-176.4	157.3	-23.1	-108.1	-20.9	0	0	0	104.7
983	G	31.9	Very low	28.8	Very low	64 Å²	64	150.4 Å²	150.4	66%	0.66	79%	0.793	S	S	*	*			trans	106.7	92.5	165.8	0	0	0	0	0	115.1
984	V	29.2	Very low	29	Very low	124 Å²	124	149.5 Å²	149.5	75%	0.752	79%	0.786	S	S	*	*				63.2	97.6	75.9	-177	0	0	0	0	112.4
985	D	31.6	Very low	28.9	Very low	125 Å²	125	153.4 Å²	153.4	67%	0.668	79%	0.794	S	S	*	*				175.3	128.3	105.4	-102	-36.7	0	0	0	114.6
986	K	29.9	Very low	28.8	Very low	180 Å²	180	154.8 Å²	154.8	78%	0.783	80%	0.798	S	S	*	*			trans	43.9	113.4	138.5	-74.3	166.7	-176.3	155.9	0	121.4
987	A	27.6	Very low	28.4	Very low	85 Å²	85	155.5 Å²	155.5	70%	0.702	80%	0.796	S	S	*	*				70	123	116.5	0	0	0	0	0	118.5
988	T	27.6	Very low	28.4	Very low	123 Å²	123	150.1 Å²	150.1	76%	0.755	79%	0.789	S	S	*	*				151.1	137.5	102.4	-55.1	0	0	0	0	111.1
989	K	28.1	Very low	28.4	Very low	180 Å²	180	154.9 Å²	154.9	78%	0.783	80%	0.796	S	S	*	*			trans	77.4	98.2	153.7	-97.7	167.3	173.8	170.8	0	120.3
990	E	25.3	Very low	28.1	Very low	178 Å²	178	155.8 Å²	155.8	83%	0.832	79%	0.79	S	S	*	*				22.8	117.8	116.3	-60.4	-175.3	159.2	0	0	118.4
991	R	25.6	Very low	28.2	Very low	240 Å²	240	153.8 Å²	153.8	91%	0.906	79%	0.785	S	S	*	*				-167.1	145.9	113.7	-107.3	-173.1	-83.3	-160.3	-1.8	112.7
992	P	28.6	Very low	28.2	Very low	116 Å²	116	150.5 Å²	150.5	75%	0.753	78%	0.78	S	S	*	*			trans	-93.5	179.9	179.6	38.8	-32.7	0	0	0	112.4
993	M	23.6	Very low	28.1	Very low	156 Å²	156	150.4 Å²	150.4	77%	0.768	78%	0.779	S	S	*	*			trans	106.9	133.9	179.4	-77.2	178.8	63.4	0	0	113.2
994	M	31.1	Very low	28	Very low	155 Å²	155	154.8 Å²	154.8	76%	0.764	78%	0.781	S	S	*	*			cis	-143.9	122.2	21.4	-74.4	-168.6	-172.1	0	0	112.3
995	Q	26.5	Very low	28	Very low	173 Å²	173	155.4 Å²	155.4	81%	0.808	79%	0.785	S	S	*	*				35.2	111.7	112.6	-154.5	156.9	-2.2	0	0	119.8
996	Q	28.5	Very low	27.9	Very low	184 Å²	184	159 Å²	159	86%	0.86	79%	0.789	S	S	*	*				-156.4	73.8	128	-119.8	170.1	7.4	0	0	111.3
997	D	24.4	Very low	27.7	Very low	152 Å²	152	157.4 Å²	157.4	81%	0.813	79%	0.79	S	S	*	*			trans	-79.2	109.5	156	-82	-38.3	0	0	0	108.4
998	T	28.4	Very low	27.7	Very low	115 Å²	115	165.3 Å²	165.3	71%	0.706	80%	0.801	S	S	*	*			trans	-144.3	60.9	161.7	-6.6	0	0	0	0	111.1	L1000	T998-L1000 VanDerWaalsContact C-N 3.35Å; T998-L1000 PolarHBondContact O-N 2.9Å
999	W	28.8	Very low	27.6	Very low	245 Å²	245	168.4 Å²	168.4	93%	0.928	81%	0.807	S	S	*	*			trans	-83.2	79.3	154.3	-77.5	91.6	0	0	0	108.5
1000	L	26.9	Very low	27.7	Very low	149 Å²	149	165.5 Å²	165.5	78%	0.78	81%	0.809	S	S	*	*			trans	178.9	99	164.5	-97.6	145.6	0	0	0	110.8	T998	T998-L1000 VanDerWaalsContact C-N 3.35Å; T998-L1000 PolarHBondContact O-N 2.9Å
1001	N	28.7	Very low	27.7	Very low	146 Å²	146	161.8 Å²	161.8	78%	0.781	81%	0.809	S	S	*	*			trans	155.6	121.6	134.8	-92.7	-13.7	0	0	0	111
1002	P	31.3	Very low	27.7	Very low	115 Å²	115	159 Å²	159	75%	0.747	81%	0.807	S	S	*	*			trans	-88	114.9	157.9	32.2	-21	0	0	0	107.3
1003	L	26.9	Very low	27.5	Very low	154 Å²	154	158.7 Å²	158.7	81%	0.806	81%	0.807	S	S	*	*			trans	178.3	128.5	155.9	-95.1	151.3	0	0	0	110.5
1004	H	28.4	Very low	27.6	Very low	155 Å²	155	160 Å²	160	72%	0.718	81%	0.809	S	S	*	*			trans	67.1	125.6	157.4	-85.5	-76.4	0	0	0	121.4
1005	V	31.2	Very low	27.4	Very low	137 Å²	137	162 Å²	162	83%	0.83	81%	0.809	S	S	*	*			trans	154.4	92.2	133.4	168.5	0	0	0	0	106.1
1006	R	28.8	Very low	27.5	Very low	200 Å²	200	159.3 Å²	159.3	76%	0.755	80%	0.804	S	S	*	*				58	107.7	80	-163.4	-179.9	-74.9	-177	-0.7	114
1007	N	25.7	Very low	27.3	Very low	148 Å²	148	154.7 Å²	154.7	79%	0.791	79%	0.79	S	S	*	*			trans	54.4	108.9	150.1	-60.5	1	0	0	0	119.2
1008	R	28.4	Very low	27.4	Very low	250 Å²	250	151.7 Å²	151.7	94%	0.943	78%	0.781	S	S	*	*				-153.4	123.4	118.3	-129.2	176.6	-176.2	-176.8	0.7	111.9
1009	E	24.7	Very low	27.4	Very low	189 Å²	189	152.9 Å²	152.9	88%	0.883	78%	0.782	S	S	*	*			trans	-64.3	127.2	171.1	-62.2	157.9	142.6	0	0	109.9
1010	S	29.1	Very low	27.3	Very low	118 Å²	118	148 Å²	148	83%	0.825	77%	0.768	S	S	*	*			trans	-162.6	93.9	140.4	49	0	0	0	0	108.1	Q1012	S1010-Q1012 PolarHBondContact O-N 2.7Å
1011	A	25.8	Very low	27.2	Very low	100 Å²	100	145.4 Å²	145.4	83%	0.826	76%	0.762	S	S	*	*			trans	-58.5	122.9	166.2	0	0	0	0	0	109.5
1012	Q	25.4	Very low	27.1	Very low	183 Å²	183	144.4 Å²	144.4	86%	0.855	76%	0.756	S	S	*	*			trans	-160.2	105.4	142.6	-107.5	166.8	19.3	0	0	108.1	S1010 F1014	S1010-Q1012 PolarHBondContact O-N 2.7Å; Q1012-F1014 PolarHBondContact O-N 2.96Å
1013	S	25.7	Very low	26.8	Very low	108 Å²	108	144.5 Å²	144.5	76%	0.755	76%	0.756	S	S	*	*			trans	-57.4	103	167.6	52.8	0	0	0	0	108.8	Y1015	S1013-Y1015 PolarHBondContact O-N 3.24Å
1014	F	24.1	Very low	26.9	Very low	184 Å²	184	143.3 Å²	143.3	81%	0.807	75%	0.747	S	S	*	*			trans	-73.7	85.2	163.1	-137.8	-92.8	0	0	0	107.1	Q1012 V1016	Q1012-F1014 PolarHBondContact O-N 2.96Å; F1014-V1016 VanDerWaalsContact C-N 3.34Å; F1014-V1016 PolarHBondContact O-N 2.97Å
1015	Y	27.7	Very low	26.9	Very low	198 Å²	198	142.1 Å²	142.1	78%	0.776	74%	0.741	S	S	*	*			trans	-52.4	107.8	152.7	-112.6	-94.8	0	0	0	105.2	S1013 P1017	S1013-Y1015 PolarHBondContact O-N 3.24Å; Y1015-P1017 WeakPolarHBondContact O-CD 3.12Å
1016	V	27.6	Very low	26.8	Very low	115 Å²	115	137.3 Å²	137.3	70%	0.697	71%	0.714	S	S	*	*			trans	-62.9	109.8	160.3	177.8	0	0	0	0	104.2	F1014 S1018	F1014-V1016 VanDerWaalsContact C-N 3.34Å; F1014-V1016 PolarHBondContact O-N 2.97Å; V1016-S1018 PolarHBondContact O-N 2.9Å
1017	P	25.3	Very low	26.7	Very low	88 Å²	88	129.7 Å²	129.7	57%	0.571	69%	0.687	S	S	*	*			trans	-60.6	133.1	173.1	-11.3	28.3	0	0	0	104.9	Y1015 L1019	Y1015-P1017 WeakPolarHBondContact O-CD 3.12Å; P1017-L1019 VanDerWaalsContact C-N 3.3Å; P1017-L1019 PolarHBondContact O-N 2.98Å
1018	S	27.5	Very low	26.7	Very low	88 Å²	88	126.7 Å²	126.7	62%	0.615	67%	0.668	S	S	*	*			trans	-46.4	105.3	160.7	178.5	0	0	0	0	106.1	V1016 K1020	V1016-S1018 PolarHBondContact O-N 2.9Å; S1018-K1020 PolarHBondContact O-N 3.4Å; S1018-K1020 WeakPolarHBondContact OG-CG 3.48Å
1019	L	27.2	Very low	26.7	Very low	140 Å²	140	121.5 Å²	121.5	73%	0.733	66%	0.655	S	S	*	*			trans	-66.5	74.9	170.7	-100.5	153.5	0	0	0	106.2	P1017 S1021	P1017-L1019 VanDerWaalsContact C-N 3.3Å; P1017-L1019 PolarHBondContact O-N 2.98Å; L1019-S1021 VanDerWaalsContact C-N 3.3Å
1020	K	26.8	Very low	26.7	Very low	144 Å²	144	118.4 Å²	118.4	63%	0.626	64%	0.644	S	S	*	*			trans	-97.7	16.4	177.5	-113.4	180	-179.5	-175.6	0	110.4	N104 S1018	N104-K1020 PolarHBondContact OD1-NZ 2.98Å; S1018-K1020 PolarHBondContact O-N 3.4Å; S1018-K1020 WeakPolarHBondContact OG-CG 3.48Å
1021	S	25.7	Very low	26.6	Very low	94 Å²	94	118.8 Å²	118.8	66%	0.657	65%	0.647	S	S	*	*			trans	-122.2	54.7	-178.6	62.7	0	0	0	0	110.7	L1019	L1019-S1021 VanDerWaalsContact C-N 3.3Å
1022	L	26.4	Very low	26.8	Very low	125 Å²	125	118.5 Å²	118.5	65%	0.654	64%	0.644	S	S	*	*	S	Bend	trans	-134.9	130.1	161.3	-81.5	168.9	0	0	0	107.7	E1024	L1022-E1024 PolarHBondContact O-N 3.5Å; L1022-E1024 VanDerWaalsContact O-N 3.12Å
1023	P	25.4	Very low	26.8	Very low	116 Å²	116	115.5 Å²	115.5	75%	0.753	64%	0.644	S	S	*	*			trans	-75.9	101.7	-177.8	31.1	-29.9	0	0	0	108.5
1024	E	29.1	Very low	26.9	Very low	130 Å²	130	115 Å²	115	61%	0.607	65%	0.646	S	S	*	*			trans	-93.9	91.5	165	-99.9	-176.3	161.2	0	0	108.9	L1022	L1022-E1024 PolarHBondContact O-N 3.5Å; L1022-E1024 VanDerWaalsContact O-N 3.12Å
1025	E	28.2	Very low	27	Very low	129 Å²	129	113.4 Å²	113.4	60%	0.603	64%	0.644	S	S	*	*			trans	-75.6	137.2	164.2	-116.4	173.5	153.6	0	0	110.5
1026	S	27.7	Very low	27.1	Very low	37 Å²	37	111.2 Å²	111.2	26%	0.259	65%	0.645	S	S	.	*			trans	47.4	141.8	156.3	10.4	0	0	0	0	120.6	K93	K93-S1026 WeakPolarHBondContact CE-OG 3.4Å; K93-S1026 PolarHBondContact NZ-OG 3.31Å
1027	E	27.6	Very low	27.1	Very low	40 Å²	40	112.9 Å²	112.9	19%	0.187	65%	0.649	C	S	.	*			cis	176.2	132.4	23.1	-114.2	152	-138.8	0	0	104.7	K47 E89 K93	K47-E1027 HydrophobicContact CD-CB 4.32Å; K47-E1027 VanDerWaalsContact CD-O 3.3Å; K47-E1027 WeakPolarHBondContact CD-O 3.4Å; K47-E1027 VanDerWaalsContact CE-CB 3.5Å; K47-E1027 WeakPolarHBondContact CE-O 3.39Å; K47-E1027 IonicContact NZ-OE2 3.12Å; K47-E1027 PolarHBondContact NZ-OE2 3.01Å; E89-E1027 WeakPolarHBondContact CB-OE1 3.45Å; E89-E1027 HydrophobicContact CG-CG 4.42Å; E89-E1027 VanDerWaalsContact OE1-OE1 3.13Å; E89-E1027 VanDerWaalsContact OE1-OE2 3.09Å; K93-E1027 WeakPolarHBondContact CE-OE1 3.43Å; K93-E1027 IonicContact NZ-OE1 3.55Å; K93-E1027 PolarHBondContact NZ-OE1 3.31Å
1028	Q	24.6	Very low	27.1	Very low	84 Å²	84	112.1 Å²	112.1	39%	0.393	66%	0.657	S	S	.	*				99	100.2	98.5	-167	155.7	-16.7	0	0	114.6	E89	E89-Q1028 PolarHBondContact OE1-OE1 3.2Å
1029	E	29.1	Very low	27	Very low	142 Å²	142	119.9 Å²	119.9	66%	0.664	67%	0.673	S	S	*	*			trans	-134.4	104.5	143.8	-81.2	-159.3	154	0	0	109
1030	D	24.2	Very low	27	Very low	123 Å²	123	118.2 Å²	118.2	66%	0.658	67%	0.673	S	S	*	*			trans	-88.2	130.2	153.5	-74.3	-39.5	0	0	0	106.8
1031	S	28.2	Very low	27	Very low	126 Å²	126	120.3 Å²	120.3	88%	0.881	68%	0.682	S	S	*	*			trans	-166.6	128.7	149.4	-82.9	0	0	0	0	112.5
1032	A	30.3	Very low	27.1	Very low	94 Å²	94	120.1 Å²	120.1	78%	0.777	68%	0.681	S	S	*	*			trans	79.9	71.5	157.5	0	0	0	0	0	119
1033	S	24	Very low	27.1	Very low	121 Å²	121	120.7 Å²	120.7	85%	0.846	69%	0.685	S	S	*	*			trans	-49.4	123.3	131.2	42.4	0	0	0	0	111.6
1034	A	28.9	Very low	27.2	Very low	97 Å²	97	119.9 Å²	119.9	80%	0.802	68%	0.682	S	S	*	*			trans	-139.5	98	159.7	0	0	0	0	0	109.6
1035	I	25.9	Very low	27.1	Very low	151 Å²	151	121.9 Å²	121.9	77%	0.774	69%	0.691	S	S	*	*			trans	-58	138.2	154.9	-67.3	161.7	0	0	0	108.1
1036	L	29	Very low	27.2	Very low	151 Å²	151	123.4 Å²	123.4	79%	0.791	70%	0.702	S	S	*	*			trans	166.4	103.4	150.5	-89.8	154.9	0	0	0	106.9
1037	I	27.3	Very low	27.2	Very low	150 Å²	150	131 Å²	131	77%	0.769	73%	0.731	S	S	*	*				50.8	116.4	91.1	-55.3	175.7	0	0	0	111.2
1038	G	25.5	Very low	27.3	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	76%	0.763	S	S	*	*			trans	-70.3	162	-162.9	0	0	0	0	0	116.4
1039	R	26.5	Very low	27.6	Very low	251 Å²	251	140 Å²	140	95%	0.947	78%	0.777	S	S	*	*			trans	-164	140.4	141.1	-132.9	173	176.6	129	-4.4	111
1040	S	26.2	Very low	27.6	Very low	106 Å²	106	138 Å²	138	74%	0.741	78%	0.776	S	S	*	*			trans	-60.9	137.5	167.6	165.4	0	0	0	0	112.8
1041	K	27.4	Very low	27.8	Very low	187 Å²	187	142 Å²	142	81%	0.813	79%	0.787	S	S	*	*			trans	152.9	116.3	143.4	-90.3	179	175	-175.7	0	108.9
1042	S	27.7	Very low	27.9	Very low	91 Å²	91	145 Å²	145	64%	0.636	79%	0.785	S	S	*	*				71.7	130.8	95.7	101.3	0	0	0	0	113.8
1043	D	26.8	Very low	27.8	Very low	137 Å²	137	146.3 Å²	146.3	73%	0.733	79%	0.787	S	S	*	*			trans	81.9	102	157.8	-50.8	-41.7	0	0	0	120.5
1044	S	27.5	Very low	28	Very low	99 Å²	99	147.2 Å²	147.2	69%	0.692	79%	0.788	S	S	*	*				90.6	134.4	116.8	83.9	0	0	0	0	119.2
1045	H	27.2	Very low	28.2	Very low	172 Å²	172	150.3 Å²	150.3	80%	0.796	79%	0.789	S	S	*	*			trans	53.7	103.6	158.9	-63.7	-77.5	0	0	0	119.3
1046	L	29.5	Very low	28.6	Very low	161 Å²	161	147.4 Å²	147.4	84%	0.843	78%	0.782	S	S	*	*				-175.2	118.9	111.5	-116.7	93.5	0	0	0	111	K1048	L1046-K1048 PolarHBondContact O-N 3.5Å
1047	K	27.6	Very low	28.6	Very low	197 Å²	197	147.9 Å²	147.9	86%	0.857	79%	0.786	S	S	*	*			trans	-65	109	165.6	-86.9	173.1	173	172.3	0	109.2
1048	K	29.5	Very low	28.8	Very low	199 Å²	199	146.2 Å²	146.2	87%	0.865	78%	0.783	S	S	*	*			trans	-101	103	153.2	-88.9	-176.8	176.5	179.6	0	108.5	L1046	L1046-K1048 PolarHBondContact O-N 3.5Å
1049	V	30.3	Very low	29.1	Very low	113 Å²	113	150.5 Å²	150.5	69%	0.685	79%	0.788	S	S	*	*			trans	-82.1	127.3	169.5	177.5	0	0	0	0	107.4	K1051	V1049-K1051 PolarHBondContact O-N 3.47Å
1050	P	30.6	Very low	29.3	Very low	99 Å²	99	149.2 Å²	149.2	64%	0.643	80%	0.799	S	S	*	*			trans	-69.6	114	163.1	27.7	-28.5	0	0	0	107.7	F1052	P1050-F1052 PolarHBondContact O-N 2.99Å
1051	K	27.7	Very low	29.5	Very low	207 Å²	207	151.4 Å²	151.4	90%	0.9	80%	0.802	S	S	*	*			trans	-61.4	103.7	168.9	-76.3	179.8	177.2	177.1	0	107.7	V1049	V1049-K1051 PolarHBondContact O-N 3.47Å
1052	F	30.7	Very low	29.6	Very low	189 Å²	189	149.5 Å²	149.5	83%	0.829	80%	0.802	S	S	*	*			trans	-82.3	128.9	163.3	-99	-89.5	0	0	0	108.3	P1050 T1054	P1050-F1052 PolarHBondContact O-N 2.99Å; F1052-T1054 PolarHBondContact O-N 2.93Å
1053	C	28.6	Very low	29.7	Very low	123 Å²	123	152.8 Å²	152.8	83%	0.831	81%	0.811	S	S	*	*			trans	-48.6	117.9	178.5	-69.4	0	0	0	0	112.3	I1055	C1053-I1055 PolarHBondContact O-N 2.76Å
1054	T	26.9	Very low	29.9	Very low	139 Å²	139	153.7 Å²	153.7	85%	0.853	82%	0.816	S	S	*	*			trans	-65.8	108.9	155.5	31.3	0	0	0	0	108.6	F1052 S1056	F1052-T1054 PolarHBondContact O-N 2.93Å; T1054-S1056 PolarHBondContact O-N 3.08Å
1055	I	33.6	Very low	30	Very low	162 Å²	162	157.1 Å²	157.1	83%	0.831	82%	0.823	S	S	*	*			trans	-74.9	101.6	163.6	-64.3	173.3	0	0	0	106	C1053	C1053-I1055 PolarHBondContact O-N 2.76Å
1056	S	33.7	Very low	30.2	Very low	90 Å²	90	156.1 Å²	156.1	63%	0.629	83%	0.825	S	S	*	*			trans	-68.5	131.4	166.2	-176.9	0	0	0	0	108.6	T1054 T1058	T1054-S1056 PolarHBondContact O-N 3.08Å; S1056-T1058 PolarHBondContact O-N 3.31Å
1057	N	29	Very low	30.2	Very low	161 Å²	161	155.8 Å²	155.8	86%	0.861	82%	0.824	S	S	*	*			trans	-55.3	116.9	166.9	-81.9	-26.1	0	0	0	109.6
1058	T	33.2	Very low	30.4	Very low	115 Å²	115	152.6 Å²	152.6	71%	0.706	82%	0.821	S	S	*	*			trans	-144.7	104.2	161.1	46	0	0	0	0	107.9	S1056	S1056-T1058 PolarHBondContact O-N 3.31Å
1059	N	29.9	Very low	30.5	Very low	162 Å²	162	148.8 Å²	148.8	87%	0.866	82%	0.818	S	S	*	*			trans	35.7	94.2	148.6	-57.6	-18.1	0	0	0	117.4
1060	L	31.9	Very low	30.5	Very low	225 Å²	225	152 Å²	152	100%	1.178	83%	0.83	S	S	*	*			trans	-156.4	0	146.2	-124.8	138.1	0	0	0	111.3

Retrieved 1,060 of 1,060 residues in 908.4 ms (Link to these results)

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