A0A3Q0KTU8_SCHMA Loading...

MMS22L_C domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTU8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,169 aa.

						>A0A3Q0KTU8_SCHMA|A0A3Q0KTU8
MSDPAFWTPPDSPEFRGIGAIFSEDLDADLLTEIDFDVQQPTPFLGLCCDTVDPIKFLSRFETTTTVHWADPQEILCLLRNKLVLLKKSSFEFQNLRNDVSFLLLALCSSVTETEFEKRSVVPLVGCIRSVLGFLGPLTSLLEAKTNKNFIHAHLEIWLTVLKIFNFLCNRAEYVELVNETLGLKPQSSLNACGYFLDIVLENLILYSGLTNFQRCSCDTILWVVIMHFVEKTQKNWFKFFHGKMIKLSAQQRAEFSEFNTLECVRPNFKSYFQSSSLDISHQSSLTVWSLYWNVLAYTTPIYSLYADHTNQSKVGLGTLQKYSIVVWLIRQQFLGETTPNNSEVHFCLTSLLRLSETCGINLEVVRSLWLYFKSWLSTGFDTSNRSSGLFTPSMSFRCWYSKVKPECEVRQNFVMFCSLLRRLSPSDIEALCTTLKIPLLSLTKQSISHYFFIWANLVEEALDTLSVSIDNMDNNKICLLSLVDNIVEISSSLLESNNVAQKSLHNWDPNRGCILLQCLQYLLVMFEEYGCLHSELHIYLLRLLPVVEKINGVIFSLRRSLSLSNELLSTESEFALTRRPVAFNRLSTSNRISDFTSISIQFLVDLLVPNNSTHVSLPSGRTFLIIQCLGSSYFDSISWPFDIKWNECVLQLLEAVCSLAYSESNLEVFSFFWSSVYPAFKKAISRQSAKFAPIPVNLLSILSKIALYFLRLSNICFSYRSEHKLTLCLLDPADLFDLFTMNPSIDFSFHFSIMKAFYGTSSAIKELVTILNSSKKETSTVAWLFFVALLTYCLFVRTVNSFSTESHDDFVFPSFISEIRAYLPKQITISTISNLDPETIFINIAAYFDELSTFQARMSFKSVFVEYIGRLSEFICTCCSVSSVAQESGFGLSHMTQSSFLKPEDLCGSGYQVAGMLVRHCSMLLYSPVTTEGSVSSFENLVNHFFLPRQLYETQDSNKFSTLNESDIFPCFVMESMQEQLPEFTRGIAQLNWRSDPYICRIIKDIVKIHYKHFGPGAIASMVLHSPTLDFRTHILQFATYDQITYLTESKVLPVSGCEQITYQHNILSNWVNFAYAIFSNTHSSGIYLSDAPFLVCPILLSNTLKDLTSALNSDSRKHSIHILKMYKEAVASVTCKETRSRILELCCNLDKKTMDPSCNLVAYFGLK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.8	Very low	32.5	Very low	210 Å²	210	130.1 Å²	130.1	100%	1.034	73%	0.725	S	S	*	*				0	96.2	0	-76.7	174.2	132.6	0	0	107.4	D3	M1-D3 VanDerWaalsContact C-N 3.34Å
2	S	34	Very low	32.1	Very low	130 Å²	130	120.3 Å²	120.3	91%	0.909	67%	0.672	S	S	*	*			trans	-101.5	37.7	-175.4	48.9	0	0	0	0	110.9
3	D	30.2	Very low	32.3	Very low	91 Å²	91	118.9 Å²	118.9	49%	0.487	67%	0.671	S	S	.	*			trans	-121.2	110.6	179.6	-160.5	-21.5	0	0	0	109.3	M1 A5 F6	M1-D3 VanDerWaalsContact C-N 3.34Å; D3-A5 PolarHBondContact O-N 3.28Å; D3-A5 VanDerWaalsContact O-N 3.13Å; D3-A5 PolarHBondContact OD1-N 2.78Å; D3-F6 HydrophobicContact CB-CD2 4.41Å; D3-F6 PolarHBondContact O-N 3.16Å
4	P	38	Very low	32.2	Very low	102 Å²	102	122.7 Å²	122.7	66%	0.662	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-61	-15.1	179.5	-19.5	30.7	0	0	0	113.8	F6 W7	P4-F6 PolarHBondContact O-N 2.85Å; P4-F6 VanDerWaalsContact O-N 3.16Å; P4-W7 PolarHBondContact O-N 3.5Å
5	A	35.7	Very low	32	Very low	85 Å²	85	126.7 Å²	126.7	70%	0.702	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-63.8	-16.8	177.4	0	0	0	0	0	113.8	D3	D3-A5 PolarHBondContact O-N 3.28Å; D3-A5 VanDerWaalsContact O-N 3.13Å; D3-A5 PolarHBondContact OD1-N 2.78Å
6	F	30.7	Very low	31.6	Very low	146 Å²	146	130.4 Å²	130.4	64%	0.64	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-91.2	2.9	174.5	-76	-81.5	0	0	0	114.3	D3 P4 T8	D3-F6 HydrophobicContact CB-CD2 4.41Å; D3-F6 PolarHBondContact O-N 3.16Å; P4-F6 PolarHBondContact O-N 2.85Å; P4-F6 VanDerWaalsContact O-N 3.16Å; F6-T8 VanDerWaalsContact C-N 3.32Å; F6-T8 PolarHBondContact O-N 3.18Å; F6-T8 VanDerWaalsContact O-N 3.12Å
7	W	31	Very low	31.5	Very low	215 Å²	215	126.2 Å²	126.2	81%	0.814	69%	0.685	S	S	*	*			trans	-85.5	80.9	172	-73.3	57.8	0	0	0	108.7	P4 P9	P4-W7 PolarHBondContact O-N 3.5Å; W7-P9 WeakPolarHBondContact O-CD 2.97Å
8	T	27	Very low	31.2	Very low	92 Å²	92	129.4 Å²	129.4	56%	0.564	70%	0.699	S	S	*	*			trans	-59.1	120.4	166.3	8.7	0	0	0	0	108.3	F6 S12	F6-T8 VanDerWaalsContact C-N 3.32Å; F6-T8 PolarHBondContact O-N 3.18Å; F6-T8 VanDerWaalsContact O-N 3.12Å; T8-S12 WeakPolarHBondContact CB-OG 3.28Å; T8-S12 VanDerWaalsContact CG2-CB 3.47Å
9	P	30.3	Very low	31.1	Very low	84 Å²	84	125.9 Å²	125.9	55%	0.545	70%	0.696	S	S	.	*			trans	-61.1	164.4	179.5	-19.4	31.3	0	0	0	111.4	W7 D11 S12	W7-P9 WeakPolarHBondContact O-CD 2.97Å; P9-D11 PolarHBondContact O-N 3.21Å; P9-S12 WeakPolarHBondContact O-CB 3.43Å; P9-S12 PolarHBondContact O-N 2.68Å; P9-S12 PolarHBondContact O-OG 3.45Å
10	P	37.6	Very low	31	Very low	119 Å²	119	123.3 Å²	123.3	77%	0.773	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	-17.1	-178.9	-24	32.6	0	0	0	115.2	S12	P10-S12 VanDerWaalsContact C-N 3.31Å
11	D	34.2	Very low	31	Very low	157 Å²	157	123.5 Å²	123.5	84%	0.84	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	6	178	-54	-32.6	0	0	0	113.3	P9	P9-D11 PolarHBondContact O-N 3.21Å
12	S	27.6	Very low	31.3	Very low	13 Å²	13	118.1 Å²	118.1	9%	0.091	66%	0.661	C	S	.	*	S	Bend	trans	-70.6	138.7	175	80.2	0	0	0	0	111.7	T8 P9 P10 E14 F15	T8-S12 WeakPolarHBondContact CB-OG 3.28Å; T8-S12 VanDerWaalsContact CG2-CB 3.47Å; P9-S12 WeakPolarHBondContact O-CB 3.43Å; P9-S12 PolarHBondContact O-N 2.68Å; P9-S12 PolarHBondContact O-OG 3.45Å; P10-S12 VanDerWaalsContact C-N 3.31Å; S12-E14 PolarHBondContact O-N 2.7Å; S12-F15 PolarHBondContact O-N 2.88Å
13	P	34.9	Very low	31.1	Very low	102 Å²	102	115.1 Å²	115.1	66%	0.662	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-60.2	-19.7	-175.4	-15	21.8	0	0	0	114.8	F15 R16	P13-F15 VanDerWaalsContact C-N 3.27Å; P13-F15 PolarHBondContact O-N 2.97Å; P13-R16 PolarHBondContact O-N 3.48Å
14	E	30.8	Very low	31.4	Very low	172 Å²	172	120.1 Å²	120.1	80%	0.804	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-73.5	-15.7	-175.7	-68.2	-173.9	166.6	0	0	113.6	S12	S12-E14 PolarHBondContact O-N 2.7Å
15	F	28.7	Very low	31.1	Very low	183 Å²	183	121.5 Å²	121.5	80%	0.803	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-95.7	15.3	173.1	-96.2	-83.7	0	0	0	114.4	S12 P13 G17	S12-F15 PolarHBondContact O-N 2.88Å; P13-F15 VanDerWaalsContact C-N 3.27Å; P13-F15 PolarHBondContact O-N 2.97Å; F15-G17 PolarHBondContact O-N 3.35Å
16	R	27	Very low	31.1	Very low	185 Å²	185	121.7 Å²	121.7	70%	0.698	65%	0.651	S	S	*	*			trans	-74.5	65.3	166	-70.5	-172.9	-177.9	-173	1.6	111.1	P13 I21	P13-R16 PolarHBondContact O-N 3.48Å; R16-I21 HydrophobicContact CG-CD1 4.45Å
17	G	28.4	Very low	31.2	Very low	59 Å²	59	120.1 Å²	120.1	61%	0.608	65%	0.649	S	S	*	*			trans	-61.7	144.2	153.7	0	0	0	0	0	108.7	F15 G19	F15-G17 PolarHBondContact O-N 3.35Å; G17-G19 PolarHBondContact O-N 2.99Å
18	I	27.7	Very low	31.6	Very low	184 Å²	184	113.1 Å²	113.1	94%	0.944	64%	0.638	S	S	*	*	S	Bend	trans	-70.1	34.5	-167.3	-59.9	161.8	0	0	0	113.1
19	G	28.6	Very low	32	Very low	63 Å²	63	114.5 Å²	114.5	65%	0.649	64%	0.641	S	S	*	*	S	Bend	trans	-88.6	103.9	170.4	0	0	0	0	0	110.3	G17 I21	G17-G19 PolarHBondContact O-N 2.99Å; G19-I21 PolarHBondContact O-N 3.09Å
20	A	29.7	Very low	32.3	Very low	73 Å²	73	116.2 Å²	116.2	60%	0.603	65%	0.646	S	S	*	*			trans	5.9	93.2	167.9	0	0	0	0	0	116.1	F22	A20-F22 HydrophobicContact CB-CE2 4.2Å; A20-F22 HydrophobicContact CB-CZ 4.44Å; A20-F22 WeakPolarHBondContact O-CD2 3.48Å; A20-F22 PolarHBondContact O-N 3.43Å
21	I	30.3	Very low	32.3	Very low	128 Å²	128	113.3 Å²	113.3	66%	0.656	62%	0.623	S	S	*	*			trans	-66.7	100.5	162.6	-59.9	171.6	0	0	0	106.3	R16 G19 S23	R16-I21 HydrophobicContact CG-CD1 4.45Å; G19-I21 PolarHBondContact O-N 3.09Å; I21-S23 PolarHBondContact O-N 3.45Å
22	F	34.8	Very low	32.5	Very low	98 Å²	98	111 Å²	111	43%	0.43	62%	0.615	S	S	.	*			trans	-67.7	111.3	171.1	-73.4	-80	0	0	0	108.6	A20 E24 C77	A20-F22 HydrophobicContact CB-CE2 4.2Å; A20-F22 HydrophobicContact CB-CZ 4.44Å; A20-F22 WeakPolarHBondContact O-CD2 3.48Å; A20-F22 PolarHBondContact O-N 3.43Å; F22-E24 PolarHBondContact O-N 3.19Å; F22-C77 WeakPolarHBondContact CE1-SG 3.13Å; F22-C77 WeakPolarHBondContact CZ-SG 3.47Å
23	S	29.8	Very low	32.8	Very low	67 Å²	67	118.5 Å²	118.5	47%	0.469	65%	0.648	S	S	.	*			trans	-47.8	128.4	169.3	174.9	0	0	0	0	110.2	I21 D25	I21-S23 PolarHBondContact O-N 3.45Å; S23-D25 PolarHBondContact O-N 3.02Å; S23-D25 PolarHBondContact OG-N 2.98Å
24	E	36.9	Very low	32.8	Very low	195 Å²	195	117.2 Å²	117.2	91%	0.911	64%	0.635	S	S	*	*	S	Bend	trans	-63.8	-14.8	168.7	-72	-171.4	146.1	0	0	112	F22	F22-E24 PolarHBondContact O-N 3.19Å
25	D	32.4	Very low	33	Very low	131 Å²	131	115.3 Å²	115.3	70%	0.701	63%	0.631	S	S	*	*			trans	-103	48.1	-179.9	-59.2	-38.5	0	0	0	111.7	S23 D27	S23-D25 PolarHBondContact O-N 3.02Å; S23-D25 PolarHBondContact OG-N 2.98Å; D25-D27 VanDerWaalsContact C-N 3.32Å; D25-D27 PolarHBondContact O-N 3.35Å
26	L	34	Very low	33.5	Very low	90 Å²	90	110.9 Å²	110.9	47%	0.471	61%	0.611	S	S	.	*			trans	-73.9	96.9	162.2	-132.4	111.4	0	0	0	106.9
27	D	34	Very low	33.8	Very low	112 Å²	112	109 Å²	109	60%	0.599	62%	0.615	S	S	*	*			trans	-42.5	134.6	-174.2	-78.4	-45.4	0	0	0	112.9	D25 D29 L30	D25-D27 VanDerWaalsContact C-N 3.32Å; D25-D27 PolarHBondContact O-N 3.35Å; D27-D29 PolarHBondContact O-N 3.34Å; D27-L30 PolarHBondContact O-N 3.37Å; D27-L30 VanDerWaalsContact O-N 3.14Å
28	A	39.3	Very low	34.2	Very low	69 Å²	69	111.6 Å²	111.6	57%	0.57	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-17.2	174.1	0	0	0	0	0	113.2	L31 T32	A28-L31 WeakPolarHBondContact O-CB 3.37Å; A28-L31 PolarHBondContact O-N 2.83Å; A28-T32 PolarHBondContact O-N 3.39Å
29	D	35.3	Very low	34.5	Very low	120 Å²	120	111.8 Å²	111.8	64%	0.642	62%	0.615	S	S	*	*	H	α-helix	trans	-72.7	-26.7	179.7	-66.9	-20.2	0	0	0	113.2	D27 L31 T32	D27-D29 PolarHBondContact O-N 3.34Å; D29-L31 PolarHBondContact O-N 3.25Å; D29-T32 PolarHBondContact O-OG1 3.34Å; D29-T32 VanDerWaalsContact O-OG1 3.08Å
30	L	37.2	Very low	34.9	Very low	121 Å²	121	117 Å²	117	63%	0.634	62%	0.623	S	S	*	*	H	α-helix	trans	-74.2	-13.7	172	-116.8	140.3	0	0	0	112.2	D27	D27-L30 PolarHBondContact O-N 3.37Å; D27-L30 VanDerWaalsContact O-N 3.14Å
31	L	36	Very low	35.2	Very low	58 Å²	58	117.2 Å²	117.2	30%	0.304	62%	0.618	S	S	.	*	H	α-helix	trans	-93.6	-18	179.2	-69.8	167.6	0	0	0	113.4	A28 D29 L78	A28-L31 WeakPolarHBondContact O-CB 3.37Å; A28-L31 PolarHBondContact O-N 2.83Å; D29-L31 PolarHBondContact O-N 3.25Å; L31-L78 HydrophobicContact CD2-CD2 3.35Å
32	T	38.6	Very low	35.5	Very low	107 Å²	107	116.5 Å²	116.5	66%	0.656	62%	0.62	S	S	*	*	H	α-helix	trans	-87.2	-21.8	177.5	42.4	0	0	0	0	113.3	A28 D29	A28-T32 PolarHBondContact O-N 3.39Å; D29-T32 PolarHBondContact O-OG1 3.34Å; D29-T32 VanDerWaalsContact O-OG1 3.08Å
33	E	33.7	Very low	35.7	Very low	172 Å²	172	113.1 Å²	113.1	80%	0.804	61%	0.608	S	S	*	*	S	Bend	trans	-85.1	-6.9	179.6	-74.4	-167.8	160.9	0	0	114.9	D35	E33-D35 PolarHBondContact O-N 3.05Å
34	I	36.6	Very low	36.5	Very low	74 Å²	74	113 Å²	113	38%	0.379	60%	0.599	S	S	.	*			trans	-84.7	75.2	171.7	-48.8	178.5	0	0	0	108.4	F36 L78	I34-F36 HydrophobicContact CB-CE2 4.28Å; I34-F36 HydrophobicContact CG2-CD1 4.41Å; I34-F36 HydrophobicContact CG2-CD2 4.1Å; I34-F36 HydrophobicContact CG2-CE1 3.94Å; I34-F36 HydrophobicContact CG2-CE2 3.63Å; I34-F36 HydrophobicContact CG2-CG 4.48Å; I34-F36 HydrophobicContact CG2-CZ 3.54Å; I34-F36 WeakPolarHBondContact O-CD2 3.41Å; I34-F36 PolarHBondContact O-N 2.96Å; I34-L78 HydrophobicContact CD1-CD1 4.19Å
35	D	33.8	Very low	37	Very low	133 Å²	133	104.3 Å²	104.3	71%	0.711	56%	0.559	S	S	*	*			trans	-73	103.2	172.1	-138.3	-8.1	0	0	0	108.2	E33 D37	E33-D35 PolarHBondContact O-N 3.05Å; D35-D37 PolarHBondContact O-N 2.9Å
36	F	39.5	Very low	37.6	Very low	89 Å²	89	98 Å²	98	39%	0.39	53%	0.525	S	S	.	.			trans	-75.6	56.3	177.8	-69.6	-83.3	0	0	0	110.8	I34 V38 W69 F102	I34-F36 HydrophobicContact CB-CE2 4.28Å; I34-F36 HydrophobicContact CG2-CD1 4.41Å; I34-F36 HydrophobicContact CG2-CD2 4.1Å; I34-F36 HydrophobicContact CG2-CE1 3.94Å; I34-F36 HydrophobicContact CG2-CE2 3.63Å; I34-F36 HydrophobicContact CG2-CG 4.48Å; I34-F36 HydrophobicContact CG2-CZ 3.54Å; I34-F36 WeakPolarHBondContact O-CD2 3.41Å; I34-F36 PolarHBondContact O-N 2.96Å; F36-V38 PolarHBondContact O-N 3.47Å; F36-V38 VanDerWaalsContact O-N 3.1Å; F36-W69 AromaticContact CD1-CH2 3.7Å; F36-W69 HydrophobicContact CD1-CH2 3.7Å; F36-W69 HydrophobicContact CD1-CZ3 4.2Å; F36-W69 AromaticContact CE1-CH2 3.54Å; F36-W69 HydrophobicContact CE1-CH2 3.54Å; F36-W69 AromaticContact CE1-CZ3 3.59Å; F36-W69 HydrophobicContact CE1-CZ3 3.59Å; F36-F102 HydrophobicContact CD1-CD1 4.44Å; F36-F102 AromaticContact CD1-CE1 3.72Å; F36-F102 HydrophobicContact CD1-CE1 3.72Å; F36-F102 AromaticContact CD1-CZ 3.93Å; F36-F102 HydrophobicContact CD1-CZ 3.93Å; F36-F102 AromaticContact CE1-CD1 3.93Å; F36-F102 HydrophobicContact CE1-CD1 3.93Å; F36-F102 AromaticContact CE1-CE1 3.32Å; F36-F102 HydrophobicContact CE1-CE1 3.32Å; F36-F102 HydrophobicContact CE1-CZ 4Å; F36-F102 HydrophobicContact CZ-CD1 4.38Å; F36-F102 HydrophobicContact CZ-CE1 4.17Å
37	D	32.8	Very low	38.3	Very low	146 Å²	146	97.4 Å²	97.4	78%	0.781	52%	0.522	S	S	*	.			trans	-86.5	30.7	-174.5	-132.9	11.2	0	0	0	113.1	D35	D35-D37 PolarHBondContact O-N 2.9Å
38	V	37	Very low	39	Very low	113 Å²	113	92.4 Å²	92.4	69%	0.685	50%	0.495	S	S	*	.	S	Bend	trans	-101.7	109.3	176.4	-177.8	0	0	0	0	108.2	F36 Q40	F36-V38 PolarHBondContact O-N 3.47Å; F36-V38 VanDerWaalsContact O-N 3.1Å; V38-Q40 WeakPolarHBondContact O-CA 3.38Å; V38-Q40 PolarHBondContact O-N 2.93Å
39	Q	35.2	Very low	39.7	Very low	188 Å²	188	90.5 Å²	90.5	88%	0.879	48%	0.477	S	S	*	.			trans	-6.7	89.3	167.7	-73.9	-175	-16.7	0	0	112.8	P41	Q39-P41 WeakPolarHBondContact O-CD 3.41Å
40	Q	36	Very low	40.7	Very low	174 Å²	174	92 Å²	92	81%	0.813	49%	0.486	S	S	*	.			trans	-43.1	100.1	-167.9	-70.7	-179.7	-14.6	0	0	111.3	V38 T42	V38-Q40 WeakPolarHBondContact O-CA 3.38Å; V38-Q40 PolarHBondContact O-N 2.93Å; Q40-T42 PolarHBondContact O-N 2.75Å
41	P	36.2	Very low	41.7	Very low	76 Å²	76	91.1 Å²	91.1	49%	0.494	49%	0.486	S	S	.	.			trans	-66.3	113	163.8	26.9	-25.7	0	0	0	103.8	Q39 P43	Q39-P41 WeakPolarHBondContact O-CD 3.41Å; P41-P43 VanDerWaalsContact O-CD 3.28Å; P41-P43 WeakPolarHBondContact O-CD 3.14Å
42	T	36.7	Very low	42.9	Very low	114 Å²	114	90 Å²	90	70%	0.699	48%	0.481	S	S	*	.			trans	-42.6	111.4	178.7	35.7	0	0	0	0	108.7	Q40 F44	Q40-T42 PolarHBondContact O-N 2.75Å; T42-F44 PolarHBondContact O-N 3.41Å; T42-F44 VanDerWaalsContact O-N 3.11Å
43	P	37.9	Very low	44.3	Very low	26 Å²	26	89 Å²	89	17%	0.169	47%	0.471	C	S	.	.			trans	-63	120.6	-167.9	19	-29.8	0	0	0	109.1	P41 L45 G46	P41-P43 VanDerWaalsContact O-CD 3.28Å; P41-P43 WeakPolarHBondContact O-CD 3.14Å; P43-L45 PolarHBondContact O-N 3.12Å; P43-L45 VanDerWaalsContact O-N 3.14Å; P43-G46 PolarHBondContact O-N 2.94Å; P43-G46 VanDerWaalsContact O-N 3.16Å
44	F	47.6	Very low	46.1	Very low	64 Å²	64	81.7 Å²	81.7	28%	0.281	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25	-167.3	-149.8	-87.1	0	0	0	113.8	T42 R60 L105	T42-F44 PolarHBondContact O-N 3.41Å; T42-F44 VanDerWaalsContact O-N 3.11Å; F44-R60 HydrophobicContact CE1-CB 3.27Å; F44-R60 VanDerWaalsContact CE1-CD 3.5Å; F44-R60 HydrophobicContact CE1-CG 3.83Å; F44-R60 HydrophobicContact CZ-CB 3.39Å; F44-R60 HydrophobicContact CZ-CG 3.48Å; F44-R60 VanDerWaalsContact CZ-CG 3.48Å; F44-L105 HydrophobicContact CB-CD1 4.06Å
45	L	47	Very low	47.8	Very low	13 Å²	13	79 Å²	79	7%	0.068	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-11.1	179.8	-89.9	123.6	0	0	0	114.4	P43 C48 F57 L105 L159	P43-L45 PolarHBondContact O-N 3.12Å; P43-L45 VanDerWaalsContact O-N 3.14Å; L45-C48 PolarHBondContact O-SG 3.2Å; L45-F57 HydrophobicContact CD2-CE2 4.39Å; L45-F57 HydrophobicContact CD2-CZ 4.12Å; L45-F57 HydrophobicContact CG-CE2 4.27Å; L45-F57 HydrophobicContact CG-CZ 4.41Å; L45-L105 HydrophobicContact CD1-CD1 3.8Å; L45-L159 HydrophobicContact CD2-CD2 3.43Å; L45-L159 VanDerWaalsContact CD2-CD2 3.43Å
46	G	46.1	Very low	49.5	Very low	0 Å²	0	78 Å²	78	0%	0	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-14.1	-163.3	0	0	0	0	0	118.1	P43 S101	P43-G46 PolarHBondContact O-N 2.94Å; P43-G46 VanDerWaalsContact O-N 3.16Å; G46-S101 VanDerWaalsContact CA-OG 3.27Å; G46-S101 WeakPolarHBondContact CA-OG 3.36Å
47	L	47.3	Very low	51	Low	77 Å²	77	74 Å²	74	40%	0.403	40%	0.397	S	S	.	.			trans	-106.3	19.4	-176.9	-73	163.4	0	0	0	113.1	C49 T51	L47-C49 PolarHBondContact O-N 3.35Å; L47-T51 PolarHBondContact O-OG1 3.39Å
48	C	49.2	Very low	52.8	Low	6 Å²	6	67.3 Å²	67.3	4%	0.041	36%	0.361	C	S	.	.	H	α-helix	trans	-57.3	-28.4	-167.7	-70.7	0	0	0	0	113.9	L45 D50 S217 I221	L45-C48 PolarHBondContact O-SG 3.2Å; C48-D50 PolarHBondContact O-N 3.45Å; C48-D50 VanDerWaalsContact O-N 3.09Å; C48-S217 VanDerWaalsContact O-CB 3.24Å; C48-S217 WeakPolarHBondContact O-CB 3.31Å; C48-S217 PolarHBondContact O-OG 3.02Å; C48-I221 HydrophobicContact CB-CD1 3.73Å
49	C	55	Low	54.2	Low	29 Å²	29	64.3 Å²	64.3	20%	0.196	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	113.7	173	-74	0	0	0	0	111	L47 T51 R97 H152 S217 C218	L47-C49 PolarHBondContact O-N 3.35Å; C49-T51 VanDerWaalsContact C-N 3.29Å; C49-T51 PolarHBondContact O-N 3.38Å; C49-T51 VanDerWaalsContact O-N 3.12Å; C49-R97 PolarHBondContact SG-NH1 2.72Å; C49-R97 VanDerWaalsContact SG-NH1 3.37Å; C49-H152 PolarHBondContact SG-CE1 2.98Å; C49-H152 PolarHBondContact SG-ND1 2.95Å; C49-H152 VanDerWaalsContact SG-ND1 3.39Å; C49-S217 WeakPolarHBondContact CA-OG 3.14Å; C49-S217 PolarHBondContact N-OG 2.59Å; C49-C218 VanDerWaalsContact SG-SG 3.69Å
50	D	55.5	Low	55.6	Low	153 Å²	153	59.6 Å²	59.6	82%	0.818	32%	0.319	S	S	*	.	H	α-helix	trans	71.2	-8.8	169	-47.3	-36.7	0	0	0	118.4	C48 S217	C48-D50 PolarHBondContact O-N 3.45Å; C48-D50 VanDerWaalsContact O-N 3.09Å; D50-S217 PolarHBondContact N-OG 2.93Å
51	T	58.1	Low	57	Low	102 Å²	102	52 Å²	52	63%	0.626	28%	0.283	S	S	*	.	H	α-helix	trans	-108.4	-25.4	-172.9	64.5	0	0	0	0	116.2	L47 C49	L47-T51 PolarHBondContact O-OG1 3.39Å; C49-T51 VanDerWaalsContact C-N 3.29Å; C49-T51 PolarHBondContact O-N 3.38Å; C49-T51 VanDerWaalsContact O-N 3.12Å
52	V	60.8	Low	58.3	Low	33 Å²	33	53.6 Å²	53.6	20%	0.2	28%	0.284	C	S	.	.	S	Bend	trans	-112.5	120.2	-171.6	-172.1	0	0	0	0	110.7	P54 F57	V52-P54 WeakPolarHBondContact O-CD 3.38Å; V52-F57 HydrophobicContact CG1-CB 3.94Å
53	D	67.6	Low	59.3	Low	87 Å²	87	51.6 Å²	51.6	47%	0.465	27%	0.272	S	S	.	.			trans	-56.3	121.5	166.2	179.2	-12.5	0	0	0	109.3	I55 K56 F57	D53-I55 PolarHBondContact O-N 2.79Å; D53-I55 WeakPolarHBondContact OD1-CB 3.31Å; D53-I55 PolarHBondContact OD1-N 3.23Å; D53-K56 HydrophobicContact CB-CB 3.99Å; D53-K56 WeakPolarHBondContact O-CB 3.3Å; D53-K56 PolarHBondContact O-N 3.07Å; D53-F57 PolarHBondContact O-N 3.44Å
54	P	71.8	Confident	59.9	Low	18 Å²	18	55.6 Å²	55.6	12%	0.117	30%	0.296	C	S	.	.	H	α-helix	trans	-51.4	-30.8	179.9	-26.6	33.2	0	0	0	114.1	V52 F57 L58 T220 I221 V224	V52-P54 WeakPolarHBondContact O-CD 3.38Å; P54-F57 WeakPolarHBondContact O-CB 3.38Å; P54-L58 PolarHBondContact O-N 2.81Å; P54-T220 HydrophobicContact CB-CG2 4.12Å; P54-T220 HydrophobicContact CG-CG2 3.57Å; P54-I221 HydrophobicContact CB-CG1 4.15Å; P54-I221 HydrophobicContact CG-CG1 4.42Å; P54-V224 HydrophobicContact CB-CG2 3.9Å
55	I	73.5	Confident	59.9	Low	18 Å²	18	54.7 Å²	54.7	9%	0.092	30%	0.296	C	S	.	.	H	α-helix	trans	-74.1	-43.7	178.2	-62.2	-53.1	0	0	0	111.5	D53 F57 L58 S59 L305 H309	D53-I55 PolarHBondContact O-N 2.79Å; D53-I55 WeakPolarHBondContact OD1-CB 3.31Å; D53-I55 PolarHBondContact OD1-N 3.23Å; I55-F57 PolarHBondContact O-N 3.18Å; I55-L58 PolarHBondContact O-N 3.2Å; I55-L58 VanDerWaalsContact O-N 3.15Å; I55-S59 PolarHBondContact O-N 2.81Å; I55-S59 VanDerWaalsContact O-N 3.1Å; I55-L305 HydrophobicContact CD1-CB 4.05Å; I55-L305 WeakPolarHBondContact CD1-O 3.48Å; I55-L305 HydrophobicContact CG1-CB 4.13Å; I55-H309 HydrophobicContact CD1-CB 4.1Å; I55-H309 HydrophobicContact CG1-CB 4.45Å; I55-H309 HydrophobicContact CG2-CB 3.55Å; I55-H309 WeakPolarHBondContact CG2-ND1 3.2Å
56	K	69.5	Low	59.9	Low	113 Å²	113	60 Å²	60	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-39.6	173.2	-169	176.8	-178	178	0	110.2	D53 S59 R60	D53-K56 HydrophobicContact CB-CB 3.99Å; D53-K56 WeakPolarHBondContact O-CB 3.3Å; D53-K56 PolarHBondContact O-N 3.07Å; K56-S59 PolarHBondContact O-OG 2.9Å; K56-R60 VanDerWaalsContact O-CD 3.27Å; K56-R60 WeakPolarHBondContact O-CD 2.94Å; K56-R60 WeakPolarHBondContact O-CG 3.37Å; K56-R60 PolarHBondContact O-N 3.2Å
57	F	71	Confident	60	Low	5 Å²	5	62.5 Å²	62.5	2%	0.022	34%	0.344	C	S	.	.	H	α-helix	trans	-59.1	-48.9	173.3	-177.8	-88.7	0	0	0	112	L45 V52 D53 P54 I55 S59 R60 F61 L159 I221 V225	L45-F57 HydrophobicContact CD2-CE2 4.39Å; L45-F57 HydrophobicContact CD2-CZ 4.12Å; L45-F57 HydrophobicContact CG-CE2 4.27Å; L45-F57 HydrophobicContact CG-CZ 4.41Å; V52-F57 HydrophobicContact CG1-CB 3.94Å; D53-F57 PolarHBondContact O-N 3.44Å; P54-F57 WeakPolarHBondContact O-CB 3.38Å; I55-F57 PolarHBondContact O-N 3.18Å; F57-S59 PolarHBondContact O-N 3.39Å; F57-R60 CarbonylContact O-C 3.56Å; F57-R60 PolarHBondContact O-N 3.47Å; F57-F61 HydrophobicContact CD1-CB 4.37Å; F57-F61 HydrophobicContact CE1-CB 4.05Å; F57-F61 AromaticContact CE1-CD2 3.81Å; F57-F61 HydrophobicContact CE1-CD2 3.81Å; F57-F61 HydrophobicContact CE1-CG 4.29Å; F57-F61 HydrophobicContact CZ-CD2 4.16Å; F57-F61 PolarHBondContact O-N 3.18Å; F57-L159 HydrophobicContact CE1-CD1 3.89Å; F57-L159 HydrophobicContact CE1-CD2 3.9Å; F57-L159 HydrophobicContact CE1-CG 4.49Å; F57-L159 HydrophobicContact CZ-CD1 4.12Å; F57-L159 HydrophobicContact CZ-CD2 3.53Å; F57-L159 HydrophobicContact CZ-CG 4.49Å; F57-I221 HydrophobicContact CB-CD1 4.5Å; F57-I221 HydrophobicContact CB-CG1 4.39Å; F57-I221 HydrophobicContact CD1-CG2 3.32Å; F57-I221 HydrophobicContact CD2-CD1 4.44Å; F57-I221 HydrophobicContact CD2-CG2 4.43Å; F57-I221 HydrophobicContact CE1-CG2 3.41Å; F57-I221 VanDerWaalsContact CE1-CG2 3.41Å; F57-I221 HydrophobicContact CE2-CG2 4.49Å; F57-I221 HydrophobicContact CG-CD1 4.33Å; F57-I221 HydrophobicContact CG-CG1 4.36Å; F57-I221 HydrophobicContact CG-CG2 3.88Å; F57-I221 HydrophobicContact CZ-CG2 4.02Å; F57-V225 HydrophobicContact CE1-CG2 4.33Å
58	L	69.6	Low	60.1	Low	5 Å²	5	66.9 Å²	66.9	3%	0.026	36%	0.363	C	S	.	.	H	α-helix	trans	-57.4	-46.6	-179.8	-177.7	71.6	0	0	0	112.5	P54 I55 R60 F61 E62 V224 H228 Y306	P54-L58 PolarHBondContact O-N 2.81Å; I55-L58 PolarHBondContact O-N 3.2Å; I55-L58 VanDerWaalsContact O-N 3.15Å; L58-R60 PolarHBondContact O-N 2.71Å; L58-R60 VanDerWaalsContact O-N 3.11Å; L58-F61 WeakPolarHBondContact O-CB 3.04Å; L58-F61 PolarHBondContact O-N 3.02Å; L58-E62 PolarHBondContact O-N 2.97Å; L58-V224 HydrophobicContact CB-CG1 4.06Å; L58-V224 HydrophobicContact CD1-CG1 4.25Å; L58-V224 HydrophobicContact CD2-CG1 3.99Å; L58-V224 HydrophobicContact CG-CG1 4.32Å; L58-H228 HydrophobicContact CD1-CB 3.93Å; L58-Y306 HydrophobicContact CD2-CD2 3.65Å; L58-Y306 HydrophobicContact CD2-CE2 3.52Å
59	S	67.4	Low	60.4	Low	50 Å²	50	71.4 Å²	71.4	35%	0.35	38%	0.379	S	S	.	.	H	α-helix	trans	-56.9	-30.6	178.2	69.5	0	0	0	0	112.8	I55 K56 F57	I55-S59 PolarHBondContact O-N 2.81Å; I55-S59 VanDerWaalsContact O-N 3.1Å; K56-S59 PolarHBondContact O-OG 2.9Å; F57-S59 PolarHBondContact O-N 3.39Å
60	R	64.1	Low	60.7	Low	88 Å²	88	72.3 Å²	72.3	33%	0.332	39%	0.388	S	S	.	.	H	α-helix	trans	-91.2	-25.2	179.7	-63.2	160.3	147.9	-154.8	4.9	113.1	F44 K56 F57 L58 E62 T63	F44-R60 HydrophobicContact CE1-CB 3.27Å; F44-R60 VanDerWaalsContact CE1-CD 3.5Å; F44-R60 HydrophobicContact CE1-CG 3.83Å; F44-R60 HydrophobicContact CZ-CB 3.39Å; F44-R60 HydrophobicContact CZ-CG 3.48Å; F44-R60 VanDerWaalsContact CZ-CG 3.48Å; K56-R60 VanDerWaalsContact O-CD 3.27Å; K56-R60 WeakPolarHBondContact O-CD 2.94Å; K56-R60 WeakPolarHBondContact O-CG 3.37Å; K56-R60 PolarHBondContact O-N 3.2Å; F57-R60 CarbonylContact O-C 3.56Å; F57-R60 PolarHBondContact O-N 3.47Å; L58-R60 PolarHBondContact O-N 2.71Å; L58-R60 VanDerWaalsContact O-N 3.11Å; R60-E62 PolarHBondContact O-N 2.7Å; R60-T63 VanDerWaalsContact CA-OG1 3.3Å; R60-T63 WeakPolarHBondContact CA-OG1 3.19Å; R60-T63 PolarHBondContact O-N 3.47Å; R60-T63 VanDerWaalsContact O-N 3.09Å; R60-T63 PolarHBondContact O-OG1 3.34Å
61	F	65.3	Low	61.4	Low	14 Å²	14	68.9 Å²	68.9	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-35.9	173.8	-178.7	-95.3	0	0	0	110.9	F57 L58 L159 K163 V225 F229	F57-F61 HydrophobicContact CD1-CB 4.37Å; F57-F61 HydrophobicContact CE1-CB 4.05Å; F57-F61 AromaticContact CE1-CD2 3.81Å; F57-F61 HydrophobicContact CE1-CD2 3.81Å; F57-F61 HydrophobicContact CE1-CG 4.29Å; F57-F61 HydrophobicContact CZ-CD2 4.16Å; F57-F61 PolarHBondContact O-N 3.18Å; L58-F61 WeakPolarHBondContact O-CB 3.04Å; L58-F61 PolarHBondContact O-N 3.02Å; F61-L159 HydrophobicContact CD2-CD2 3.93Å; F61-L159 HydrophobicContact CE2-CD2 3.65Å; F61-L159 HydrophobicContact CE2-CG 4.12Å; F61-K163 HydrophobicContact CD2-CD 3.95Å; F61-K163 HydrophobicContact CE2-CB 3.71Å; F61-K163 HydrophobicContact CE2-CD 3.62Å; F61-K163 HydrophobicContact CE2-CG 3.96Å; F61-K163 HydrophobicContact CZ-CB 3.6Å; F61-K163 HydrophobicContact CZ-CD 4Å; F61-K163 HydrophobicContact CZ-CG 3.86Å; F61-K163 WeakPolarHBondContact O-CE 3.5Å; F61-K163 PolarHBondContact O-NZ 3.48Å; F61-K163 VanDerWaalsContact O-NZ 3.12Å; F61-V225 HydrophobicContact CD2-CG2 4.49Å; F61-V225 HydrophobicContact CE1-CG1 4.29Å; F61-V225 HydrophobicContact CE2-CG2 4.48Å; F61-V225 HydrophobicContact CZ-CG1 4.07Å; F61-F229 HydrophobicContact CE1-CE2 4.24Å; F61-F229 HydrophobicContact CE1-CZ 4.26Å; F61-F229 HydrophobicContact CZ-CE2 4.41Å
62	E	62.8	Low	62.1	Low	110 Å²	110	64.4 Å²	64.4	51%	0.514	34%	0.342	S	S	.	.	S	Bend	trans	-73.5	-23.5	174.4	-64.8	-165.1	138.3	0	0	113.7	L58 R60 H228 K232	L58-E62 PolarHBondContact O-N 2.97Å; R60-E62 PolarHBondContact O-N 2.7Å; E62-H228 IonicContact OE1-CE1 3.4Å; E62-H228 PolarHBondContact OE1-CE1 3.4Å; E62-H228 IonicContact OE1-NE2 3.48Å; E62-H228 PolarHBondContact OE1-NE2 3.48Å; E62-K232 IonicContact OE1-NZ 3.82Å; E62-K232 PolarHBondContact OE1-NZ 2.75Å
63	T	58.4	Low	62.5	Low	72 Å²	72	66 Å²	66	44%	0.442	35%	0.347	S	S	.	.	S	Bend	trans	-83.6	134.2	177.8	55.6	0	0	0	0	112.1	R60 T65	R60-T63 VanDerWaalsContact CA-OG1 3.3Å; R60-T63 WeakPolarHBondContact CA-OG1 3.19Å; R60-T63 PolarHBondContact O-N 3.47Å; R60-T63 VanDerWaalsContact O-N 3.09Å; R60-T63 PolarHBondContact O-OG1 3.34Å; T63-T65 PolarHBondContact O-N 2.95Å
64	T	51.6	Low	62.9	Low	111 Å²	111	67.6 Å²	67.6	68%	0.681	35%	0.352	S	S	*	.			trans	-77.6	111.3	171.7	39.5	0	0	0	0	109.5
65	T	47.4	Very low	63.1	Low	45 Å²	45	67 Å²	67	28%	0.276	35%	0.348	S	S	.	.			trans	-86.2	132.4	170.2	41.6	0	0	0	0	109.7	T63	T63-T65 PolarHBondContact O-N 2.95Å
66	T	45.5	Very low	63.2	Low	124 Å²	124	66.4 Å²	66.4	76%	0.761	35%	0.345	S	S	*	.			trans	-89.6	107.7	-176.3	51.8	0	0	0	0	111.2	E113	T66-E113 WeakPolarHBondContact CA-OE1 3.4Å
67	V	48.1	Very low	63.4	Low	52 Å²	52	62.5 Å²	62.5	32%	0.315	33%	0.331	S	S	.	.			trans	-145.6	110.5	168.8	-158.4	0	0	0	0	109.1	W69 E113	V67-W69 VanDerWaalsContact CG1-CD1 3.4Å; V67-W69 PolarHBondContact O-N 2.91Å; V67-E113 PolarHBondContact N-OE1 3.09Å
68	H	49.8	Very low	63.7	Low	170 Å²	170	64 Å²	64	79%	0.787	34%	0.34	S	S	*	.			trans	-73.9	117	176.9	-76.8	-37.7	0	0	0	111.1	E113	H68-E113 IonicContact CE1-OE2 2.85Å; H68-E113 PolarHBondContact CE1-OE2 3.45Å; H68-E113 VanDerWaalsContact CE1-OE2 3.28Å; H68-E113 IonicContact CG-OE2 2.78Å; H68-E113 IonicContact ND1-OE2 3.28Å; H68-E113 PolarHBondContact ND1-OE2 3.43Å
69	W	56.3	Low	64.2	Low	101 Å²	101	63.9 Å²	63.9	38%	0.383	34%	0.339	S	S	.	.			trans	-130.6	174.3	176.6	-81.4	81.3	0	0	0	111.1	F36 V67 I75 F102 A106	F36-W69 AromaticContact CD1-CH2 3.7Å; F36-W69 HydrophobicContact CD1-CH2 3.7Å; F36-W69 HydrophobicContact CD1-CZ3 4.2Å; F36-W69 AromaticContact CE1-CH2 3.54Å; F36-W69 HydrophobicContact CE1-CH2 3.54Å; F36-W69 AromaticContact CE1-CZ3 3.59Å; F36-W69 HydrophobicContact CE1-CZ3 3.59Å; V67-W69 VanDerWaalsContact CG1-CD1 3.4Å; V67-W69 PolarHBondContact O-N 2.91Å; W69-I75 HydrophobicContact CB-CD1 4.39Å; W69-F102 AromaticContact CE2-CZ 3.93Å; W69-F102 HydrophobicContact CE3-CE1 4.43Å; W69-F102 AromaticContact CH2-CE1 3.58Å; W69-F102 HydrophobicContact CH2-CE1 3.58Å; W69-F102 AromaticContact CH2-CZ 3.53Å; W69-F102 HydrophobicContact CH2-CZ 3.53Å; W69-F102 AromaticContact CZ2-CE1 3.73Å; W69-F102 HydrophobicContact CZ2-CE1 3.73Å; W69-F102 HydrophobicContact CZ2-CE2 4.45Å; W69-F102 AromaticContact CZ2-CZ 3.29Å; W69-F102 HydrophobicContact CZ2-CZ 3.29Å; W69-F102 AromaticContact CZ3-CE1 3.94Å; W69-F102 HydrophobicContact CZ3-CE1 3.94Å; W69-F102 HydrophobicContact CZ3-CZ 4.33Å; W69-A106 HydrophobicContact CB-CB 4.14Å; W69-A106 HydrophobicContact CD2-CB 4.07Å; W69-A106 HydrophobicContact CE3-CB 4.44Å; W69-A106 HydrophobicContact CG-CB 3.88Å
70	A	61.7	Low	64.5	Low	47 Å²	47	65.9 Å²	65.9	39%	0.388	34%	0.339	S	S	.	.	S	Bend	trans	-58.7	177	-178.4	0	0	0	0	0	115	S110	A70-S110 PolarHBondContact O-OG 3.47Å
71	D	70.2	Confident	65	Low	82 Å²	82	64.2 Å²	64.2	44%	0.439	34%	0.336	S	S	.	.			trans	-53.6	128.6	179.4	-172.1	-35.5	0	0	0	110.5	Q73 E74 I75	D71-Q73 PolarHBondContact O-N 3.02Å; D71-Q73 PolarHBondContact OD1-N 3.27Å; D71-E74 HydrophobicContact CB-CG 4.37Å; D71-E74 PolarHBondContact O-N 3.16Å; D71-I75 PolarHBondContact O-N 3.34Å
72	P	72.2	Confident	65.5	Low	7 Å²	7	65.6 Å²	65.6	5%	0.045	34%	0.342	C	S	.	.	H	α-helix	trans	-47.4	-31.6	176.3	-29.3	33.8	0	0	0	115.1	L76 L107 S110 V111 F116 L124	P72-L76 WeakPolarHBondContact O-CG 3.46Å; P72-L76 PolarHBondContact O-N 3.15Å; P72-L76 VanDerWaalsContact O-N 3.1Å; P72-L107 HydrophobicContact CB-CD1 3.99Å; P72-S110 VanDerWaalsContact CD-OG 3.31Å; P72-S110 WeakPolarHBondContact CD-OG 3.37Å; P72-S110 WeakPolarHBondContact CG-OG 3.41Å; P72-V111 HydrophobicContact CB-CG2 4.03Å; P72-V111 HydrophobicContact CG-CG2 4.06Å; P72-F116 HydrophobicContact CG-CE1 3.97Å; P72-F116 HydrophobicContact CG-CZ 3.8Å; P72-L124 HydrophobicContact CB-CD1 3.7Å
73	Q	69.7	Low	66.1	Low	66 Å²	66	60.3 Å²	60.3	31%	0.308	32%	0.318	S	S	.	.	H	α-helix	trans	-68.6	-43.9	-179.7	-64.4	-179.9	18.8	0	0	112	D71 I75 L76 C77	D71-Q73 PolarHBondContact O-N 3.02Å; D71-Q73 PolarHBondContact OD1-N 3.27Å; Q73-I75 VanDerWaalsContact C-N 3.31Å; Q73-I75 PolarHBondContact O-N 3.18Å; Q73-L76 PolarHBondContact O-N 2.84Å; Q73-C77 PolarHBondContact O-N 3.35Å; Q73-C77 PolarHBondContact O-SG 3.37Å
74	E	74.3	Confident	66.7	Low	121 Å²	121	58.9 Å²	58.9	57%	0.565	31%	0.309	S	S	*	.	H	α-helix	trans	-62	-42.2	177.6	-67.9	-179.1	167.3	0	0	110.8	D71 L76 C77 L78	D71-E74 HydrophobicContact CB-CG 4.37Å; D71-E74 PolarHBondContact O-N 3.16Å; E74-L76 VanDerWaalsContact C-N 3.34Å; E74-L76 PolarHBondContact O-N 3.3Å; E74-C77 WeakPolarHBondContact O-CB 3.38Å; E74-C77 PolarHBondContact O-N 2.78Å; E74-L78 WeakPolarHBondContact O-CG 3.4Å; E74-L78 PolarHBondContact O-N 3.45Å
75	I	76.4	Confident	67.6	Low	6 Å²	6	57.7 Å²	57.7	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-42.2	177.8	-57.1	172.3	0	0	0	110.8	W69 D71 Q73 C77 L78 L79 L103 A106 L107	W69-I75 HydrophobicContact CB-CD1 4.39Å; D71-I75 PolarHBondContact O-N 3.34Å; Q73-I75 VanDerWaalsContact C-N 3.31Å; Q73-I75 PolarHBondContact O-N 3.18Å; I75-C77 VanDerWaalsContact C-N 3.35Å; I75-C77 PolarHBondContact O-N 2.78Å; I75-L78 PolarHBondContact O-N 2.95Å; I75-L79 VanDerWaalsContact O-CB 3.3Å; I75-L79 WeakPolarHBondContact O-CB 3.45Å; I75-L79 PolarHBondContact O-N 3.35Å; I75-L103 HydrophobicContact CG2-CB 4.21Å; I75-L103 HydrophobicContact CG2-CD2 4.08Å; I75-L103 WeakPolarHBondContact CG2-O 3.4Å; I75-A106 HydrophobicContact CD1-CB 3.98Å; I75-A106 HydrophobicContact CG2-CB 4.46Å; I75-L107 HydrophobicContact CB-CD1 4.44Å; I75-L107 HydrophobicContact CG2-CB 3.77Å; I75-L107 HydrophobicContact CG2-CD1 4.5Å
76	L	75.2	Confident	68.6	Low	6 Å²	6	55.6 Å²	55.6	3%	0.031	29%	0.285	C	S	.	.	H	α-helix	trans	-65.7	-35.5	177.3	-78.8	165.9	0	0	0	112.8	P72 Q73 E74 L79 R80 L107 L124 C127 I128 V131	P72-L76 WeakPolarHBondContact O-CG 3.46Å; P72-L76 PolarHBondContact O-N 3.15Å; P72-L76 VanDerWaalsContact O-N 3.1Å; Q73-L76 PolarHBondContact O-N 2.84Å; E74-L76 VanDerWaalsContact C-N 3.34Å; E74-L76 PolarHBondContact O-N 3.3Å; L76-L79 HydrophobicContact CD2-CD2 4.25Å; L76-L79 PolarHBondContact O-N 2.94Å; L76-R80 PolarHBondContact O-N 3.41Å; L76-L107 HydrophobicContact CD1-CD1 4.05Å; L76-L107 HydrophobicContact CD2-CD1 4.28Å; L76-L107 HydrophobicContact CD2-CD2 3.51Å; L76-L107 HydrophobicContact CG-CD1 3.76Å; L76-L107 HydrophobicContact CG-CD2 3.96Å; L76-L124 HydrophobicContact CD1-CD1 3.65Å; L76-C127 HydrophobicContact CB-CB 4.05Å; L76-C127 HydrophobicContact CD1-CB 3.45Å; L76-C127 VanDerWaalsContact CD1-CB 3.45Å; L76-C127 HydrophobicContact CG-CB 4.3Å; L76-I128 HydrophobicContact CD1-CG1 3.99Å; L76-I128 HydrophobicContact CD2-CG1 4.25Å; L76-V131 HydrophobicContact CD2-CG2 4.04Å
77	C	74.3	Confident	69.6	Low	30 Å²	30	55.3 Å²	55.3	20%	0.203	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-47.4	174.1	-66.9	0	0	0	0	111.6	F22 Q73 E74 I75 L79 R80 N81	F22-C77 WeakPolarHBondContact CE1-SG 3.13Å; F22-C77 WeakPolarHBondContact CZ-SG 3.47Å; Q73-C77 PolarHBondContact O-N 3.35Å; Q73-C77 PolarHBondContact O-SG 3.37Å; E74-C77 WeakPolarHBondContact O-CB 3.38Å; E74-C77 PolarHBondContact O-N 2.78Å; I75-C77 VanDerWaalsContact C-N 3.35Å; I75-C77 PolarHBondContact O-N 2.78Å; C77-L79 VanDerWaalsContact C-N 3.31Å; C77-L79 PolarHBondContact O-N 3.1Å; C77-R80 PolarHBondContact O-N 3Å; C77-N81 PolarHBondContact O-N 3.06Å; C77-N81 VanDerWaalsContact O-N 3.09Å
78	L	77.3	Confident	70.6	Confident	37 Å²	37	61.1 Å²	61.1	19%	0.194	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-43.4	174.9	-69.6	171.9	0	0	0	111.3	L31 I34 E74 I75 R80 N81 K82 L103	L31-L78 HydrophobicContact CD2-CD2 3.35Å; I34-L78 HydrophobicContact CD1-CD1 4.19Å; E74-L78 WeakPolarHBondContact O-CG 3.4Å; E74-L78 PolarHBondContact O-N 3.45Å; I75-L78 PolarHBondContact O-N 2.95Å; L78-R80 PolarHBondContact O-N 3.09Å; L78-N81 PolarHBondContact O-N 3.12Å; L78-K82 WeakPolarHBondContact O-CG 3.23Å; L78-K82 PolarHBondContact O-N 3.45Å; L78-L103 HydrophobicContact CB-CD1 4.01Å; L78-L103 HydrophobicContact CB-CD2 3.93Å; L78-L103 HydrophobicContact CD1-CD2 4.1Å
79	L	80	Confident	71	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-46.9	177.4	-178.9	69.4	0	0	0	111.2	I75 L76 C77 N81 K82 L83 V100 L103 L104 V131	I75-L79 VanDerWaalsContact O-CB 3.3Å; I75-L79 WeakPolarHBondContact O-CB 3.45Å; I75-L79 PolarHBondContact O-N 3.35Å; L76-L79 HydrophobicContact CD2-CD2 4.25Å; L76-L79 PolarHBondContact O-N 2.94Å; C77-L79 VanDerWaalsContact C-N 3.31Å; C77-L79 PolarHBondContact O-N 3.1Å; L79-N81 VanDerWaalsContact C-N 3.34Å; L79-N81 PolarHBondContact O-N 2.74Å; L79-K82 PolarHBondContact O-N 2.79Å; L79-L83 HydrophobicContact CD1-CD1 4.39Å; L79-L83 HydrophobicContact CG-CD1 4Å; L79-L83 VanDerWaalsContact O-CG 3.25Å; L79-L83 WeakPolarHBondContact O-CG 3.24Å; L79-L83 PolarHBondContact O-N 3.1Å; L79-V100 HydrophobicContact CD1-CB 4.46Å; L79-V100 HydrophobicContact CD1-CG1 3.84Å; L79-V100 HydrophobicContact CD1-CG2 4.5Å; L79-L103 HydrophobicContact CD1-CB 4.25Å; L79-L104 HydrophobicContact CD1-CD2 4.01Å; L79-L104 HydrophobicContact CD1-CG 4Å; L79-L104 HydrophobicContact CD2-CD2 3.64Å; L79-V131 HydrophobicContact CD2-CG1 4.22Å
80	R	72.9	Confident	70.9	Confident	93 Å²	93	53.8 Å²	53.8	35%	0.351	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-44.9	177.6	-173.8	-179.8	175.5	-140.4	-2.4	111.4	L76 C77 L78 L83 V84 V131	L76-R80 PolarHBondContact O-N 3.41Å; C77-R80 PolarHBondContact O-N 3Å; L78-R80 PolarHBondContact O-N 3.09Å; R80-L83 PolarHBondContact O-N 3.41Å; R80-V84 WeakPolarHBondContact O-CG2 3.41Å; R80-V84 PolarHBondContact O-N 2.93Å; R80-V131 HydrophobicContact CB-CG2 4.48Å
81	N	75.4	Confident	70.4	Confident	52 Å²	52	60.6 Å²	60.6	28%	0.278	30%	0.299	S	S	.	.	H	α-helix	trans	-62.7	-45.4	178.8	-71.9	-8.2	0	0	0	111.8	C77 L78 L79 L83 V84 L85	C77-N81 PolarHBondContact O-N 3.06Å; C77-N81 VanDerWaalsContact O-N 3.09Å; L78-N81 PolarHBondContact O-N 3.12Å; L79-N81 VanDerWaalsContact C-N 3.34Å; L79-N81 PolarHBondContact O-N 2.74Å; N81-L83 VanDerWaalsContact C-N 3.3Å; N81-L83 PolarHBondContact O-N 3.39Å; N81-V84 PolarHBondContact O-N 3.35Å; N81-L85 WeakPolarHBondContact O-CG 3.15Å; N81-L85 PolarHBondContact O-N 3.06Å; N81-L85 VanDerWaalsContact O-N 3.15Å
82	K	76.6	Confident	69.4	Low	43 Å²	43	64.7 Å²	64.7	19%	0.187	32%	0.315	C	S	.	.	H	α-helix	trans	-62.1	-37.4	175.9	-66.3	-74.4	-178.8	167.3	0	111.6	L78 L79 L85 L86 L96 D99 V100 L103	L78-K82 WeakPolarHBondContact O-CG 3.23Å; L78-K82 PolarHBondContact O-N 3.45Å; L79-K82 PolarHBondContact O-N 2.79Å; K82-L85 WeakPolarHBondContact O-CB 3.12Å; K82-L85 PolarHBondContact O-N 3.11Å; K82-L86 WeakPolarHBondContact O-CB 3.43Å; K82-L86 PolarHBondContact O-N 3.05Å; K82-L96 HydrophobicContact CD-CD1 3.55Å; K82-L96 HydrophobicContact CD-CG 4.49Å; K82-D99 HydrophobicContact CD-CB 4.26Å; K82-D99 IonicContact NZ-OD2 2.62Å; K82-D99 PolarHBondContact NZ-OD2 3.34Å; K82-V100 HydrophobicContact CB-CG2 3.87Å; K82-L103 HydrophobicContact CG-CD1 3.88Å
83	L	74.3	Confident	68.6	Low	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-68.4	-36.4	176.2	-70.4	167.6	0	0	0	113.6	L79 R80 N81 L85 L86 K87 V100 V131 F134 L135 A153 I157	L79-L83 HydrophobicContact CD1-CD1 4.39Å; L79-L83 HydrophobicContact CG-CD1 4Å; L79-L83 VanDerWaalsContact O-CG 3.25Å; L79-L83 WeakPolarHBondContact O-CG 3.24Å; L79-L83 PolarHBondContact O-N 3.1Å; R80-L83 PolarHBondContact O-N 3.41Å; N81-L83 VanDerWaalsContact C-N 3.3Å; N81-L83 PolarHBondContact O-N 3.39Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.43Å; L83-L86 PolarHBondContact O-N 3.33Å; L83-K87 WeakPolarHBondContact O-CB 3.45Å; L83-K87 PolarHBondContact O-N 3.23Å; L83-V100 HydrophobicContact CD2-CG1 4.44Å; L83-V100 HydrophobicContact CD2-CG2 4.41Å; L83-V131 HydrophobicContact CD1-CG1 3.99Å; L83-F134 HydrophobicContact CB-CD1 4.26Å; L83-F134 HydrophobicContact CB-CE1 3.91Å; L83-L135 HydrophobicContact CD1-CD2 4.47Å; L83-A153 HydrophobicContact CD2-CB 4.42Å; L83-I157 HydrophobicContact CD1-CD1 3.48Å; L83-I157 VanDerWaalsContact CD1-CD1 3.48Å; L83-I157 HydrophobicContact CD2-CD1 3.52Å; L83-I157 HydrophobicContact CG-CD1 4.1Å
84	V	71.7	Confident	68.2	Low	42 Å²	42	70.3 Å²	70.3	26%	0.255	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-43.2	172.7	172.3	0	0	0	0	110.7	R80 N81 K87 K88 F134	R80-V84 WeakPolarHBondContact O-CG2 3.41Å; R80-V84 PolarHBondContact O-N 2.93Å; N81-V84 PolarHBondContact O-N 3.35Å; V84-K87 PolarHBondContact O-N 3.42Å; V84-K88 HydrophobicContact CG1-CD 4.45Å; V84-K88 WeakPolarHBondContact O-CG 3.29Å; V84-K88 PolarHBondContact O-N 3.32Å; V84-F134 HydrophobicContact CB-CZ 4.21Å; V84-F134 HydrophobicContact CG2-CE1 4.17Å; V84-F134 HydrophobicContact CG2-CE2 3.7Å; V84-F134 HydrophobicContact CG2-CZ 3.48Å; V84-F134 VanDerWaalsContact CG2-CZ 3.48Å
85	L	70.6	Confident	67.6	Low	85 Å²	85	70.2 Å²	70.2	45%	0.445	34%	0.343	S	S	.	.	H	α-helix	trans	-64.4	-42	175.5	-67.5	170.6	0	0	0	111.9	N81 K82 L83 K87 K88 S89 L96	N81-L85 WeakPolarHBondContact O-CG 3.15Å; N81-L85 PolarHBondContact O-N 3.06Å; N81-L85 VanDerWaalsContact O-N 3.15Å; K82-L85 WeakPolarHBondContact O-CB 3.12Å; K82-L85 PolarHBondContact O-N 3.11Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.43Å; L85-K87 VanDerWaalsContact C-N 3.32Å; L85-K87 PolarHBondContact O-N 3.02Å; L85-K88 PolarHBondContact O-N 3.49Å; L85-S89 WeakPolarHBondContact O-CB 3.38Å; L85-S89 PolarHBondContact O-N 3.18Å; L85-S89 PolarHBondContact O-OG 3.49Å; L85-L96 HydrophobicContact CB-CD1 4.42Å; L85-L96 HydrophobicContact CB-CD2 4.01Å; L85-L96 HydrophobicContact CD1-CD1 4.34Å
86	L	68.9	Low	67.1	Low	2 Å²	2	70.3 Å²	70.3	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-68.1	-31.8	-178.3	-142.1	143.8	0	0	0	111.9	K82 L83 L96 V100 N149 F150 A153	K82-L86 WeakPolarHBondContact O-CB 3.43Å; K82-L86 PolarHBondContact O-N 3.05Å; L83-L86 PolarHBondContact O-N 3.33Å; L86-L96 HydrophobicContact CB-CD2 3.67Å; L86-L96 HydrophobicContact CD1-CB 4.39Å; L86-L96 HydrophobicContact CD1-CD2 3.73Å; L86-L96 HydrophobicContact CD1-CG 3.98Å; L86-L96 HydrophobicContact CG-CD2 3.7Å; L86-L96 HydrophobicContact CG-CG 4.49Å; L86-V100 HydrophobicContact CD1-CG2 3.95Å; L86-N149 HydrophobicContact CD2-CB 4.42Å; L86-F150 HydrophobicContact CB-CD2 4.08Å; L86-F150 HydrophobicContact CD2-CB 3.6Å; L86-F150 HydrophobicContact CD2-CD2 3.53Å; L86-F150 HydrophobicContact CD2-CG 4.02Å; L86-F150 HydrophobicContact CG-CD2 4.42Å; L86-A153 HydrophobicContact CD1-CB 4.46Å; L86-A153 HydrophobicContact CD2-CB 4.35Å
87	K	66.5	Low	66.7	Low	117 Å²	117	70.6 Å²	70.6	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-72.5	-30.7	174.7	-167	171.9	-177.2	172.2	0	113.1	L83 V84 L85 F134 F150	L83-K87 WeakPolarHBondContact O-CB 3.45Å; L83-K87 PolarHBondContact O-N 3.23Å; V84-K87 PolarHBondContact O-N 3.42Å; L85-K87 VanDerWaalsContact C-N 3.32Å; L85-K87 PolarHBondContact O-N 3.02Å; K87-F134 HydrophobicContact CD-CE1 4.36Å; K87-F134 HydrophobicContact CD-CZ 3.98Å; K87-F150 HydrophobicContact CB-CD2 4.26Å; K87-F150 HydrophobicContact CB-CE2 3.71Å; K87-F150 HydrophobicContact CB-CZ 4.24Å; K87-F150 HydrophobicContact CD-CZ 4.39Å; K87-F150 HydrophobicContact CG-CE2 4.27Å; K87-F150 HydrophobicContact CG-CZ 4.33Å
88	K	68.9	Low	66.3	Low	175 Å²	175	71.3 Å²	71.3	76%	0.761	35%	0.346	S	S	*	.	H	α-helix	trans	-85	-16	-176.8	-74.5	-178.8	179.3	178.8	0	114.4	V84 L85	V84-K88 HydrophobicContact CG1-CD 4.45Å; V84-K88 WeakPolarHBondContact O-CG 3.29Å; V84-K88 PolarHBondContact O-N 3.32Å; L85-K88 PolarHBondContact O-N 3.49Å
89	S	56.5	Low	66	Low	30 Å²	30	72 Å²	72	21%	0.21	35%	0.35	C	S	.	.			trans	-117.4	138	-163.4	55.9	0	0	0	0	114.7	L85 F93 N147	L85-S89 WeakPolarHBondContact O-CB 3.38Å; L85-S89 PolarHBondContact O-N 3.18Å; L85-S89 PolarHBondContact O-OG 3.49Å; S89-F93 VanDerWaalsContact CB-CE2 3.44Å; S89-F93 VanDerWaalsContact OG-CD2 3.3Å; S89-F93 WeakPolarHBondContact OG-CD2 3.38Å; S89-F93 VanDerWaalsContact OG-CE2 3.26Å; S89-F93 WeakPolarHBondContact OG-CE2 3.44Å; S89-N147 PolarHBondContact O-ND2 3.3Å; S89-N147 VanDerWaalsContact O-ND2 3.12Å
90	S	55.8	Low	65.8	Low	87 Å²	87	71.9 Å²	71.9	61%	0.608	35%	0.349	S	S	*	.			trans	-108.5	-15.6	-169	47.1	0	0	0	0	116.7
91	F	50	Low	65.7	Low	189 Å²	189	67.4 Å²	67.4	83%	0.829	33%	0.333	S	S	*	.	S	Bend	trans	-132.1	-12.7	-164.4	-82.8	-78.5	0	0	0	121
92	E	50.3	Low	65.4	Low	169 Å²	169	66.8 Å²	66.8	79%	0.79	33%	0.328	S	S	*	.			trans	-145.8	70.3	-172.5	-67.8	-171.1	159	0	0	116.2
93	F	55.6	Low	65.4	Low	67 Å²	67	65.3 Å²	65.3	29%	0.294	32%	0.322	S	S	.	.			trans	-148	46.6	-167.9	-76.4	-60	0	0	0	118.8	S89 L96 R97	S89-F93 VanDerWaalsContact CB-CE2 3.44Å; S89-F93 VanDerWaalsContact OG-CD2 3.3Å; S89-F93 WeakPolarHBondContact OG-CD2 3.38Å; S89-F93 VanDerWaalsContact OG-CE2 3.26Å; S89-F93 WeakPolarHBondContact OG-CE2 3.44Å; F93-L96 HydrophobicContact CB-CB 3.98Å; F93-L96 HydrophobicContact CD1-CB 3.09Å; F93-L96 HydrophobicContact CD1-CD1 4.39Å; F93-L96 HydrophobicContact CD1-CD2 3.79Å; F93-L96 HydrophobicContact CD1-CG 3.95Å; F93-L96 HydrophobicContact CE1-CB 3.73Å; F93-L96 HydrophobicContact CE1-CD1 4.19Å; F93-L96 HydrophobicContact CE1-CD2 3.98Å; F93-L96 HydrophobicContact CE1-CG 4.21Å; F93-L96 HydrophobicContact CG-CB 3.77Å; F93-L96 HydrophobicContact CG-CD2 4.03Å; F93-L96 HydrophobicContact CZ-CD2 4.47Å; F93-R97 PolarHBondContact O-N 3.22Å
94	Q	59.6	Low	65.5	Low	124 Å²	124	65.4 Å²	65.4	58%	0.579	32%	0.322	S	S	*	.	H	α-helix	trans	-61.2	-38.2	158.9	-159.8	107.6	4.1	0	0	110.5	N98	Q94-N98 PolarHBondContact O-N 2.88Å; Q94-N98 PolarHBondContact O-ND2 2.89Å; Q94-N98 PolarHBondContact O-OD1 3.03Å
95	N	63.2	Low	65.4	Low	119 Å²	119	64.5 Å²	64.5	64%	0.636	32%	0.316	S	S	*	.	H	α-helix	trans	-68.6	-47.1	-178.3	-67.4	-6.6	0	0	0	113.2	R97 N98 D99	N95-R97 VanDerWaalsContact C-N 3.26Å; N95-R97 PolarHBondContact O-N 3.01Å; N95-N98 CarbonylContact O-C 3.49Å; N95-N98 WeakPolarHBondContact O-CA 3.2Å; N95-N98 WeakPolarHBondContact O-CB 3.48Å; N95-N98 PolarHBondContact O-N 3.44Å; N95-D99 PolarHBondContact O-N 2.88Å
96	L	66.4	Low	65.4	Low	8 Å²	8	60.5 Å²	60.5	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-68.5	-27.6	179.9	-167.6	88	0	0	0	112.2	K82 L85 L86 F93 V100	K82-L96 HydrophobicContact CD-CD1 3.55Å; K82-L96 HydrophobicContact CD-CG 4.49Å; L85-L96 HydrophobicContact CB-CD1 4.42Å; L85-L96 HydrophobicContact CB-CD2 4.01Å; L85-L96 HydrophobicContact CD1-CD1 4.34Å; L86-L96 HydrophobicContact CB-CD2 3.67Å; L86-L96 HydrophobicContact CD1-CB 4.39Å; L86-L96 HydrophobicContact CD1-CD2 3.73Å; L86-L96 HydrophobicContact CD1-CG 3.98Å; L86-L96 HydrophobicContact CG-CD2 3.7Å; L86-L96 HydrophobicContact CG-CG 4.49Å; F93-L96 HydrophobicContact CB-CB 3.98Å; F93-L96 HydrophobicContact CD1-CB 3.09Å; F93-L96 HydrophobicContact CD1-CD1 4.39Å; F93-L96 HydrophobicContact CD1-CD2 3.79Å; F93-L96 HydrophobicContact CD1-CG 3.95Å; F93-L96 HydrophobicContact CE1-CB 3.73Å; F93-L96 HydrophobicContact CE1-CD1 4.19Å; F93-L96 HydrophobicContact CE1-CD2 3.98Å; F93-L96 HydrophobicContact CE1-CG 4.21Å; F93-L96 HydrophobicContact CG-CB 3.77Å; F93-L96 HydrophobicContact CG-CD2 4.03Å; F93-L96 HydrophobicContact CZ-CD2 4.47Å; L96-V100 WeakPolarHBondContact O-CG2 3.36Å; L96-V100 PolarHBondContact O-N 3.04Å; L96-V100 VanDerWaalsContact O-N 3.09Å
97	R	65.8	Low	65.8	Low	12 Å²	12	60.6 Å²	60.6	5%	0.045	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-50.8	165.8	-178.5	-169.7	172.4	179.8	2.5	110.3	C49 F93 N95 D99 V100 S101 H152 E156 C218	C49-R97 PolarHBondContact SG-NH1 2.72Å; C49-R97 VanDerWaalsContact SG-NH1 3.37Å; F93-R97 PolarHBondContact O-N 3.22Å; N95-R97 VanDerWaalsContact C-N 3.26Å; N95-R97 PolarHBondContact O-N 3.01Å; R97-D99 PolarHBondContact O-N 2.9Å; R97-V100 PolarHBondContact O-N 3.24Å; R97-S101 PolarHBondContact O-N 2.86Å; R97-S101 PolarHBondContact O-OG 2.89Å; R97-H152 PolarHBondContact NH1-ND1 2.9Å; R97-E156 IonicContact CZ-OE1 3.43Å; R97-E156 IonicContact NE-OE1 2.71Å; R97-E156 PolarHBondContact NE-OE1 3.13Å; R97-E156 IonicContact NH2-OE1 3.19Å; R97-E156 PolarHBondContact NH2-OE1 2.89Å; R97-C218 PolarHBondContact NH2-SG 3.45Å; R97-C218 VanDerWaalsContact NH2-SG 3.39Å
98	N	66.5	Low	66.2	Low	45 Å²	45	55.2 Å²	55.2	24%	0.241	27%	0.273	C	S	.	.	H	α-helix	trans	-56.1	-40.3	178.5	-64.2	-19.9	0	0	0	111.5	Q94 N95 S101 F102	Q94-N98 PolarHBondContact O-N 2.88Å; Q94-N98 PolarHBondContact O-ND2 2.89Å; Q94-N98 PolarHBondContact O-OD1 3.03Å; N95-N98 CarbonylContact O-C 3.49Å; N95-N98 WeakPolarHBondContact O-CA 3.2Å; N95-N98 WeakPolarHBondContact O-CB 3.48Å; N95-N98 PolarHBondContact O-N 3.44Å; N98-S101 PolarHBondContact O-N 3.27Å; N98-F102 WeakPolarHBondContact O-CB 3.27Å; N98-F102 PolarHBondContact O-N 3.44Å
99	D	70.5	Confident	66.2	Low	50 Å²	50	47 Å²	47	27%	0.267	24%	0.237	S	C	.	.	H	α-helix	trans	-60.1	-48.1	174.4	-67.2	-4.1	0	0	0	111.7	K82 N95 R97 F102 L103	K82-D99 HydrophobicContact CD-CB 4.26Å; K82-D99 IonicContact NZ-OD2 2.62Å; K82-D99 PolarHBondContact NZ-OD2 3.34Å; N95-D99 PolarHBondContact O-N 2.88Å; R97-D99 PolarHBondContact O-N 2.9Å; D99-F102 WeakPolarHBondContact O-CB 3.33Å; D99-F102 PolarHBondContact O-N 2.84Å; D99-L103 WeakPolarHBondContact O-CB 3.42Å; D99-L103 VanDerWaalsContact O-CG 3.28Å; D99-L103 WeakPolarHBondContact O-CG 3.41Å; D99-L103 PolarHBondContact O-N 2.95Å
100	V	75.2	Confident	67	Low	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-48.9	177.6	166.7	0	0	0	0	110.4	L79 K82 L83 L86 L96 R97 F102 L103 L104 A153	L79-V100 HydrophobicContact CD1-CB 4.46Å; L79-V100 HydrophobicContact CD1-CG1 3.84Å; L79-V100 HydrophobicContact CD1-CG2 4.5Å; K82-V100 HydrophobicContact CB-CG2 3.87Å; L83-V100 HydrophobicContact CD2-CG1 4.44Å; L83-V100 HydrophobicContact CD2-CG2 4.41Å; L86-V100 HydrophobicContact CD1-CG2 3.95Å; L96-V100 WeakPolarHBondContact O-CG2 3.36Å; L96-V100 PolarHBondContact O-N 3.04Å; L96-V100 VanDerWaalsContact O-N 3.09Å; R97-V100 PolarHBondContact O-N 3.24Å; V100-F102 PolarHBondContact O-N 3.42Å; V100-L103 PolarHBondContact O-N 3.15Å; V100-L104 HydrophobicContact CG1-CD1 3.92Å; V100-L104 HydrophobicContact CG1-CG 4.41Å; V100-L104 WeakPolarHBondContact O-CB 3.38Å; V100-L104 VanDerWaalsContact O-CG 3.24Å; V100-L104 WeakPolarHBondContact O-CG 3.46Å; V100-L104 PolarHBondContact O-N 3.01Å; V100-A153 HydrophobicContact CG1-CB 4.12Å
101	S	70.8	Confident	68	Low	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-36.7	178.4	-48.4	0	0	0	0	112.3	G46 R97 N98 L105 E156	G46-S101 VanDerWaalsContact CA-OG 3.27Å; G46-S101 WeakPolarHBondContact CA-OG 3.36Å; R97-S101 PolarHBondContact O-N 2.86Å; R97-S101 PolarHBondContact O-OG 2.89Å; N98-S101 PolarHBondContact O-N 3.27Å; S101-L105 PolarHBondContact O-N 2.98Å; S101-E156 WeakPolarHBondContact CB-OE2 3.44Å; S101-E156 PolarHBondContact OG-OE2 3.24Å
102	F	69.5	Low	68.9	Low	39 Å²	39	33.8 Å²	33.8	17%	0.171	17%	0.167	C	C	.	.	H	α-helix	trans	-67.3	-47.2	176.3	-174.8	-87.1	0	0	0	111.7	F36 W69 N98 D99 V100 L104 L105 A106	F36-F102 HydrophobicContact CD1-CD1 4.44Å; F36-F102 AromaticContact CD1-CE1 3.72Å; F36-F102 HydrophobicContact CD1-CE1 3.72Å; F36-F102 AromaticContact CD1-CZ 3.93Å; F36-F102 HydrophobicContact CD1-CZ 3.93Å; F36-F102 AromaticContact CE1-CD1 3.93Å; F36-F102 HydrophobicContact CE1-CD1 3.93Å; F36-F102 AromaticContact CE1-CE1 3.32Å; F36-F102 HydrophobicContact CE1-CE1 3.32Å; F36-F102 HydrophobicContact CE1-CZ 4Å; F36-F102 HydrophobicContact CZ-CD1 4.38Å; F36-F102 HydrophobicContact CZ-CE1 4.17Å; W69-F102 AromaticContact CE2-CZ 3.93Å; W69-F102 HydrophobicContact CE3-CE1 4.43Å; W69-F102 AromaticContact CH2-CE1 3.58Å; W69-F102 HydrophobicContact CH2-CE1 3.58Å; W69-F102 AromaticContact CH2-CZ 3.53Å; W69-F102 HydrophobicContact CH2-CZ 3.53Å; W69-F102 AromaticContact CZ2-CE1 3.73Å; W69-F102 HydrophobicContact CZ2-CE1 3.73Å; W69-F102 HydrophobicContact CZ2-CE2 4.45Å; W69-F102 AromaticContact CZ2-CZ 3.29Å; W69-F102 HydrophobicContact CZ2-CZ 3.29Å; W69-F102 AromaticContact CZ3-CE1 3.94Å; W69-F102 HydrophobicContact CZ3-CE1 3.94Å; W69-F102 HydrophobicContact CZ3-CZ 4.33Å; N98-F102 WeakPolarHBondContact O-CB 3.27Å; N98-F102 PolarHBondContact O-N 3.44Å; D99-F102 WeakPolarHBondContact O-CB 3.33Å; D99-F102 PolarHBondContact O-N 2.84Å; V100-F102 PolarHBondContact O-N 3.42Å; F102-L104 VanDerWaalsContact C-N 3.28Å; F102-L104 PolarHBondContact O-N 3.19Å; F102-L105 WeakPolarHBondContact O-CB 3.38Å; F102-L105 PolarHBondContact O-N 3Å; F102-L105 VanDerWaalsContact O-N 3.15Å; F102-A106 PolarHBondContact O-N 3.04Å
103	L	75.8	Confident	69.7	Low	12 Å²	12	28.8 Å²	28.8	6%	0.063	14%	0.144	C	C	.	.	H	α-helix	trans	-61	-38.7	176	-72.1	169.3	0	0	0	111.5	I75 L78 L79 K82 D99 V100 A106 L107	I75-L103 HydrophobicContact CG2-CB 4.21Å; I75-L103 HydrophobicContact CG2-CD2 4.08Å; I75-L103 WeakPolarHBondContact CG2-O 3.4Å; L78-L103 HydrophobicContact CB-CD1 4.01Å; L78-L103 HydrophobicContact CB-CD2 3.93Å; L78-L103 HydrophobicContact CD1-CD2 4.1Å; L79-L103 HydrophobicContact CD1-CB 4.25Å; K82-L103 HydrophobicContact CG-CD1 3.88Å; D99-L103 WeakPolarHBondContact O-CB 3.42Å; D99-L103 VanDerWaalsContact O-CG 3.28Å; D99-L103 WeakPolarHBondContact O-CG 3.41Å; D99-L103 PolarHBondContact O-N 2.95Å; V100-L103 PolarHBondContact O-N 3.15Å; L103-A106 PolarHBondContact O-N 2.98Å; L103-L107 VanDerWaalsContact O-CB 3.27Å; L103-L107 WeakPolarHBondContact O-CB 3.27Å; L103-L107 PolarHBondContact O-N 2.81Å
104	L	77	Confident	70.2	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-39.5	174.9	-71.3	172	0	0	0	112.6	L79 V100 F102 C108 E156 I157 T160	L79-L104 HydrophobicContact CD1-CD2 4.01Å; L79-L104 HydrophobicContact CD1-CG 4Å; L79-L104 HydrophobicContact CD2-CD2 3.64Å; V100-L104 HydrophobicContact CG1-CD1 3.92Å; V100-L104 HydrophobicContact CG1-CG 4.41Å; V100-L104 WeakPolarHBondContact O-CB 3.38Å; V100-L104 VanDerWaalsContact O-CG 3.24Å; V100-L104 WeakPolarHBondContact O-CG 3.46Å; V100-L104 PolarHBondContact O-N 3.01Å; F102-L104 VanDerWaalsContact C-N 3.28Å; F102-L104 PolarHBondContact O-N 3.19Å; L104-C108 WeakPolarHBondContact O-CB 3.43Å; L104-C108 PolarHBondContact O-N 3.26Å; L104-E156 HydrophobicContact CD1-CB 3.78Å; L104-I157 HydrophobicContact CD1-CG1 3.88Å; L104-I157 HydrophobicContact CD2-CB 4.47Å; L104-I157 HydrophobicContact CD2-CG1 3.97Å; L104-I157 HydrophobicContact CG-CG1 4.47Å; L104-T160 HydrophobicContact CB-CG2 4.14Å; L104-T160 HydrophobicContact CD2-CG2 3.91Å; L104-T160 WeakPolarHBondContact O-CG2 3.47Å
105	L	69.5	Low	70.3	Confident	22 Å²	22	29.9 Å²	29.9	12%	0.115	15%	0.153	C	C	.	.	H	α-helix	trans	-64.1	-47	174.2	-178.6	73.9	0	0	0	111.3	F44 L45 S101 F102 L107 C108 S109	F44-L105 HydrophobicContact CB-CD1 4.06Å; L45-L105 HydrophobicContact CD1-CD1 3.8Å; S101-L105 PolarHBondContact O-N 2.98Å; F102-L105 WeakPolarHBondContact O-CB 3.38Å; F102-L105 PolarHBondContact O-N 3Å; F102-L105 VanDerWaalsContact O-N 3.15Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-C108 PolarHBondContact O-N 3.26Å; L105-S109 WeakPolarHBondContact O-CB 3.29Å; L105-S109 PolarHBondContact O-N 3.4Å; L105-S109 PolarHBondContact O-OG 2.72Å
106	A	71.5	Confident	70.5	Confident	2 Å²	2	25.3 Å²	25.3	2%	0.017	13%	0.128	C	C	.	.	H	α-helix	trans	-61	-44.5	177.9	0	0	0	0	0	110.8	W69 I75 F102 L103 S109 S110	W69-A106 HydrophobicContact CB-CB 4.14Å; W69-A106 HydrophobicContact CD2-CB 4.07Å; W69-A106 HydrophobicContact CE3-CB 4.44Å; W69-A106 HydrophobicContact CG-CB 3.88Å; I75-A106 HydrophobicContact CD1-CB 3.98Å; I75-A106 HydrophobicContact CG2-CB 4.46Å; F102-A106 PolarHBondContact O-N 3.04Å; L103-A106 PolarHBondContact O-N 2.98Å; A106-S109 PolarHBondContact O-N 3.05Å; A106-S110 WeakPolarHBondContact O-CB 3.36Å; A106-S110 PolarHBondContact O-N 2.82Å
107	L	77.4	Confident	70.4	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-59.5	-50.2	176.1	179.7	64.4	0	0	0	111.3	P72 I75 L76 L103 L105 S109 S110 V111 I164	P72-L107 HydrophobicContact CB-CD1 3.99Å; I75-L107 HydrophobicContact CB-CD1 4.44Å; I75-L107 HydrophobicContact CG2-CB 3.77Å; I75-L107 HydrophobicContact CG2-CD1 4.5Å; L76-L107 HydrophobicContact CD1-CD1 4.05Å; L76-L107 HydrophobicContact CD2-CD1 4.28Å; L76-L107 HydrophobicContact CD2-CD2 3.51Å; L76-L107 HydrophobicContact CG-CD1 3.76Å; L76-L107 HydrophobicContact CG-CD2 3.96Å; L103-L107 VanDerWaalsContact O-CB 3.27Å; L103-L107 WeakPolarHBondContact O-CB 3.27Å; L103-L107 PolarHBondContact O-N 2.81Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L107-S109 VanDerWaalsContact C-N 3.33Å; L107-S109 PolarHBondContact O-N 3.43Å; L107-S110 PolarHBondContact O-N 3.5Å; L107-V111 HydrophobicContact CD1-CG2 4.14Å; L107-V111 WeakPolarHBondContact O-CB 3.36Å; L107-V111 VanDerWaalsContact O-CG2 3.27Å; L107-V111 WeakPolarHBondContact O-CG2 3.31Å; L107-V111 PolarHBondContact O-N 2.8Å; L107-I164 HydrophobicContact CD2-CD1 3.77Å; L107-I164 HydrophobicContact CG-CD1 3.84Å
108	C	74.3	Confident	70.3	Confident	4 Å²	4	36.6 Å²	36.6	3%	0.027	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-45.1	-178.6	-170.3	0	0	0	0	111.3	L104 L105 V111 T112 T160 K163	L104-C108 WeakPolarHBondContact O-CB 3.43Å; L104-C108 PolarHBondContact O-N 3.26Å; L105-C108 PolarHBondContact O-N 3.26Å; C108-V111 PolarHBondContact O-N 3.05Å; C108-T112 WeakPolarHBondContact O-CG2 3.24Å; C108-T112 PolarHBondContact O-N 3.01Å; C108-T112 PolarHBondContact O-OG1 3.02Å; C108-T160 HydrophobicContact CB-CG2 4.14Å; C108-K163 WeakPolarHBondContact SG-CD 3.19Å; C108-K163 VanDerWaalsContact SG-CE 3.56Å
109	S	70.2	Confident	70.4	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-48.5	-178.6	-51.2	0	0	0	0	110.2	L105 A106 L107 V111 T112 E113	L105-S109 WeakPolarHBondContact O-CB 3.29Å; L105-S109 PolarHBondContact O-N 3.4Å; L105-S109 PolarHBondContact O-OG 2.72Å; A106-S109 PolarHBondContact O-N 3.05Å; L107-S109 VanDerWaalsContact C-N 3.33Å; L107-S109 PolarHBondContact O-N 3.43Å; S109-V111 VanDerWaalsContact C-N 3.33Å; S109-V111 PolarHBondContact O-N 3.06Å; S109-T112 PolarHBondContact O-N 2.89Å; S109-T112 PolarHBondContact O-OG1 2.83Å; S109-T112 VanDerWaalsContact O-OG1 3.12Å; S109-E113 WeakPolarHBondContact O-CB 3.18Å; S109-E113 WeakPolarHBondContact O-CG 3.19Å; S109-E113 PolarHBondContact O-N 3.15Å
110	S	73.2	Confident	70.5	Confident	5 Å²	5	44.1 Å²	44.1	4%	0.035	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-45.7	177.6	-173.4	0	0	0	0	111.4	A70 P72 A106 L107 T114	A70-S110 PolarHBondContact O-OG 3.47Å; P72-S110 VanDerWaalsContact CD-OG 3.31Å; P72-S110 WeakPolarHBondContact CD-OG 3.37Å; P72-S110 WeakPolarHBondContact CG-OG 3.41Å; A106-S110 WeakPolarHBondContact O-CB 3.36Å; A106-S110 PolarHBondContact O-N 2.82Å; L107-S110 PolarHBondContact O-N 3.5Å; S110-T114 WeakPolarHBondContact O-CB 3.33Å; S110-T114 VanDerWaalsContact O-CG2 3.28Å; S110-T114 WeakPolarHBondContact O-CG2 3.23Å; S110-T114 PolarHBondContact O-N 2.96Å; S110-T114 PolarHBondContact O-OG1 3.1Å
111	V	74.9	Confident	70.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-69.8	-38.4	178.5	173.8	0	0	0	0	113.1	P72 L107 C108 S109 E113 F116 L124 I164 F167	P72-V111 HydrophobicContact CB-CG2 4.03Å; P72-V111 HydrophobicContact CG-CG2 4.06Å; L107-V111 HydrophobicContact CD1-CG2 4.14Å; L107-V111 WeakPolarHBondContact O-CB 3.36Å; L107-V111 VanDerWaalsContact O-CG2 3.27Å; L107-V111 WeakPolarHBondContact O-CG2 3.31Å; L107-V111 PolarHBondContact O-N 2.8Å; C108-V111 PolarHBondContact O-N 3.05Å; S109-V111 VanDerWaalsContact C-N 3.33Å; S109-V111 PolarHBondContact O-N 3.06Å; V111-E113 VanDerWaalsContact C-N 3.34Å; V111-F116 HydrophobicContact CB-CE2 4.19Å; V111-F116 HydrophobicContact CB-CZ 4.27Å; V111-F116 HydrophobicContact CG1-CE2 3.82Å; V111-F116 HydrophobicContact CG1-CZ 4.28Å; V111-F116 HydrophobicContact CG2-CE2 4.42Å; V111-F116 HydrophobicContact CG2-CZ 4.06Å; V111-F116 WeakPolarHBondContact O-CE2 3.42Å; V111-L124 HydrophobicContact CG1-CD2 4.2Å; V111-L124 HydrophobicContact CG2-CD1 4.14Å; V111-L124 HydrophobicContact CG2-CD2 3.91Å; V111-I164 HydrophobicContact CB-CG1 4.42Å; V111-I164 HydrophobicContact CG1-CG1 4.27Å; V111-I164 HydrophobicContact CG1-CG2 3.93Å; V111-F167 HydrophobicContact CG1-CD1 4.26Å; V111-F167 WeakPolarHBondContact O-CE1 3.48Å
112	T	69	Low	70.6	Confident	23 Å²	23	46.8 Å²	46.8	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-75.5	-22.8	-178.6	51.9	0	0	0	0	113.8	C108 S109 F167	C108-T112 WeakPolarHBondContact O-CG2 3.24Å; C108-T112 PolarHBondContact O-N 3.01Å; C108-T112 PolarHBondContact O-OG1 3.02Å; S109-T112 PolarHBondContact O-N 2.89Å; S109-T112 PolarHBondContact O-OG1 2.83Å; S109-T112 VanDerWaalsContact O-OG1 3.12Å; T112-F167 HydrophobicContact CG2-CB 4.32Å; T112-F167 HydrophobicContact CG2-CD2 4.03Å; T112-F167 HydrophobicContact CG2-CG 4.07Å; T112-F167 WeakPolarHBondContact O-CE2 3.4Å; T112-F167 WeakPolarHBondContact O-CZ 3.21Å
113	E	67.2	Low	70.7	Confident	64 Å²	64	47.3 Å²	47.3	30%	0.299	23%	0.23	S	C	.	.	H	α-helix	trans	-92.7	-24.5	-179.7	-71	-179.2	-178.3	0	0	113.5	T66 V67 H68 S109 V111	T66-E113 WeakPolarHBondContact CA-OE1 3.4Å; V67-E113 PolarHBondContact N-OE1 3.09Å; H68-E113 IonicContact CE1-OE2 2.85Å; H68-E113 PolarHBondContact CE1-OE2 3.45Å; H68-E113 VanDerWaalsContact CE1-OE2 3.28Å; H68-E113 IonicContact CG-OE2 2.78Å; H68-E113 IonicContact ND1-OE2 3.28Å; H68-E113 PolarHBondContact ND1-OE2 3.43Å; S109-E113 WeakPolarHBondContact O-CB 3.18Å; S109-E113 WeakPolarHBondContact O-CG 3.19Å; S109-E113 PolarHBondContact O-N 3.15Å; V111-E113 VanDerWaalsContact C-N 3.34Å
114	T	66	Low	70.8	Confident	52 Å²	52	46.8 Å²	46.8	32%	0.319	23%	0.227	S	C	.	.			trans	-86.2	125.3	-176.2	45.4	0	0	0	0	111.6	S110 F116	S110-T114 WeakPolarHBondContact O-CB 3.33Å; S110-T114 VanDerWaalsContact O-CG2 3.28Å; S110-T114 WeakPolarHBondContact O-CG2 3.23Å; S110-T114 PolarHBondContact O-N 2.96Å; S110-T114 PolarHBondContact O-OG1 3.1Å; T114-F116 WeakPolarHBondContact O-CD2 3.43Å; T114-F116 PolarHBondContact O-N 3.31Å; T114-F116 VanDerWaalsContact O-N 3.16Å; T114-F116 WeakPolarHBondContact OG1-CE2 3.23Å; T114-F116 WeakPolarHBondContact OG1-CZ 3.33Å
115	E	62.6	Low	70.8	Confident	161 Å²	161	46.7 Å²	46.7	75%	0.752	23%	0.227	S	C	*	.			trans	-75.2	98.7	161.6	-74.7	-164.5	153.1	0	0	108.7	E117	E115-E117 PolarHBondContact O-N 2.86Å
116	F	66.5	Low	71	Confident	24 Å²	24	47 Å²	47	11%	0.105	24%	0.236	C	C	.	.			trans	-71.1	130.8	176.9	-67.2	-79.6	0	0	0	111.3	P72 V111 T114 V121 L124 Y174	P72-F116 HydrophobicContact CG-CE1 3.97Å; P72-F116 HydrophobicContact CG-CZ 3.8Å; V111-F116 HydrophobicContact CB-CE2 4.19Å; V111-F116 HydrophobicContact CB-CZ 4.27Å; V111-F116 HydrophobicContact CG1-CE2 3.82Å; V111-F116 HydrophobicContact CG1-CZ 4.28Å; V111-F116 HydrophobicContact CG2-CE2 4.42Å; V111-F116 HydrophobicContact CG2-CZ 4.06Å; V111-F116 WeakPolarHBondContact O-CE2 3.42Å; T114-F116 WeakPolarHBondContact O-CD2 3.43Å; T114-F116 PolarHBondContact O-N 3.31Å; T114-F116 VanDerWaalsContact O-N 3.16Å; T114-F116 WeakPolarHBondContact OG1-CE2 3.23Å; T114-F116 WeakPolarHBondContact OG1-CZ 3.33Å; F116-V121 HydrophobicContact CB-CG2 3.62Å; F116-V121 HydrophobicContact CG-CG2 4.24Å; F116-L124 HydrophobicContact CE1-CD2 4.12Å; F116-L124 HydrophobicContact CE2-CD2 4.11Å; F116-L124 HydrophobicContact CZ-CD2 3.76Å; F116-Y174 PolarHBondContact O-OH 3.33Å
117	E	65.5	Low	71.3	Confident	146 Å²	146	47.9 Å²	47.9	68%	0.682	24%	0.241	S	C	*	.			trans	-60.8	145.4	156.8	-67.4	-169.9	172	0	0	109.2	E115 R119 S120	E115-E117 PolarHBondContact O-N 2.86Å; E117-R119 PolarHBondContact O-N 2.87Å; E117-S120 PolarHBondContact N-OG 3Å; E117-S120 PolarHBondContact O-N 3.11Å; E117-S120 PolarHBondContact O-OG 3.15Å
118	K	64.4	Low	71.4	Confident	111 Å²	111	47.8 Å²	47.8	48%	0.483	24%	0.24	S	C	.	.	H	α-helix	trans	-48.9	-34.3	178.3	-75.2	-179.2	176.6	168.2	0	112.6	S120 V121 E173 Y174 L177	K118-S120 PolarHBondContact O-N 2.89Å; K118-V121 PolarHBondContact O-N 2.99Å; K118-E173 WeakPolarHBondContact CE-OE2 3.27Å; K118-E173 IonicContact NZ-OE2 3.94Å; K118-E173 PolarHBondContact NZ-OE2 2.8Å; K118-Y174 HydrophobicContact CG-CE1 4.45Å; K118-L177 WeakPolarHBondContact O-CD2 3.37Å
119	R	68.4	Low	71.4	Confident	215 Å²	215	51 Å²	51	81%	0.811	25%	0.252	S	S	*	.	H	α-helix	trans	-66.1	-31.5	178.8	-69.4	-177.4	177.8	175.5	0.2	114	E117 P123	E117-R119 PolarHBondContact O-N 2.87Å; R119-P123 WeakPolarHBondContact O-CD 3.4Å
120	S	71.7	Confident	71.6	Confident	37 Å²	37	53.5 Å²	53.5	26%	0.259	27%	0.27	S	S	.	.	H	α-helix	trans	-81	-19.4	-179.1	41.4	0	0	0	0	114.2	E117 K118 P123 L124	E117-S120 PolarHBondContact N-OG 3Å; E117-S120 PolarHBondContact O-N 3.11Å; E117-S120 PolarHBondContact O-OG 3.15Å; K118-S120 PolarHBondContact O-N 2.89Å; S120-P123 WeakPolarHBondContact O-CD 3.27Å; S120-P123 WeakPolarHBondContact O-CG 3.01Å; S120-L124 PolarHBondContact O-N 3.4Å
121	V	74.2	Confident	71.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70.3	-38.6	179.5	176.8	0	0	0	0	111.8	F116 K118 L124 V125 Y174 L177 V178	F116-V121 HydrophobicContact CB-CG2 3.62Å; F116-V121 HydrophobicContact CG-CG2 4.24Å; K118-V121 PolarHBondContact O-N 2.99Å; V121-L124 PolarHBondContact O-N 3.38Å; V121-V125 HydrophobicContact CG1-CG2 3.97Å; V121-V125 WeakPolarHBondContact O-CB 3.45Å; V121-V125 VanDerWaalsContact O-CG2 3.23Å; V121-V125 WeakPolarHBondContact O-CG2 3.28Å; V121-V125 PolarHBondContact O-N 3.06Å; V121-Y174 HydrophobicContact CG2-CD1 3.89Å; V121-Y174 HydrophobicContact CG2-CE1 3.84Å; V121-Y174 HydrophobicContact CG2-CG 4.36Å; V121-L177 HydrophobicContact CB-CD2 3.67Å; V121-L177 HydrophobicContact CG1-CD2 3.89Å; V121-V178 HydrophobicContact CG1-CG2 3.94Å
122	V	73.2	Confident	71.8	Confident	57 Å²	57	53.5 Å²	53.5	35%	0.345	27%	0.269	S	S	.	.	H	α-helix	trans	-57.1	-55.3	178.8	-179.6	0	0	0	0	112.3	L124 V125 G126 L177 T181	V122-L124 VanDerWaalsContact C-N 3.35Å; V122-L124 PolarHBondContact O-N 3.4Å; V122-V125 PolarHBondContact O-N 3.22Å; V122-G126 PolarHBondContact O-N 2.86Å; V122-L177 HydrophobicContact CG2-CD1 3.59Å; V122-L177 HydrophobicContact CG2-CD2 3.78Å; V122-L177 HydrophobicContact CG2-CG 3.69Å; V122-T181 HydrophobicContact CG1-CG2 4.02Å
123	P	72.8	Confident	71.9	Confident	50 Å²	50	54 Å²	54	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-64.5	-37	179.4	21.4	-30.2	0	0	0	112.6	R119 S120 V125 G126 C127	R119-P123 WeakPolarHBondContact O-CD 3.4Å; S120-P123 WeakPolarHBondContact O-CD 3.27Å; S120-P123 WeakPolarHBondContact O-CG 3.01Å; P123-V125 PolarHBondContact O-N 3.43Å; P123-G126 PolarHBondContact O-N 3.27Å; P123-C127 PolarHBondContact O-N 2.88Å; P123-C127 PolarHBondContact O-SG 3.04Å; P123-C127 VanDerWaalsContact O-SG 3.38Å
124	L	77.4	Confident	72.1	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-56.9	-51.5	173.5	173.8	63.3	0	0	0	111.8	P72 L76 V111 F116 S120 V121 V122 G126 C127 I128	P72-L124 HydrophobicContact CB-CD1 3.7Å; L76-L124 HydrophobicContact CD1-CD1 3.65Å; V111-L124 HydrophobicContact CG1-CD2 4.2Å; V111-L124 HydrophobicContact CG2-CD1 4.14Å; V111-L124 HydrophobicContact CG2-CD2 3.91Å; F116-L124 HydrophobicContact CE1-CD2 4.12Å; F116-L124 HydrophobicContact CE2-CD2 4.11Å; F116-L124 HydrophobicContact CZ-CD2 3.76Å; S120-L124 PolarHBondContact O-N 3.4Å; V121-L124 PolarHBondContact O-N 3.38Å; V122-L124 VanDerWaalsContact C-N 3.35Å; V122-L124 PolarHBondContact O-N 3.4Å; L124-G126 VanDerWaalsContact C-N 3.28Å; L124-G126 PolarHBondContact O-N 3.5Å; L124-C127 PolarHBondContact O-N 3.44Å; L124-I128 HydrophobicContact CD1-CD1 4.31Å; L124-I128 HydrophobicContact CG-CD1 4.27Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 2.99Å
125	V	77.1	Confident	72.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-35.9	178.8	175.4	0	0	0	0	110.9	V121 V122 P123 I128 R129 L168 V178 T181 L182	V121-V125 HydrophobicContact CG1-CG2 3.97Å; V121-V125 WeakPolarHBondContact O-CB 3.45Å; V121-V125 VanDerWaalsContact O-CG2 3.23Å; V121-V125 WeakPolarHBondContact O-CG2 3.28Å; V121-V125 PolarHBondContact O-N 3.06Å; V122-V125 PolarHBondContact O-N 3.22Å; P123-V125 PolarHBondContact O-N 3.43Å; V125-I128 PolarHBondContact O-N 3.22Å; V125-R129 WeakPolarHBondContact O-CB 3.17Å; V125-R129 PolarHBondContact O-N 2.92Å; V125-L168 HydrophobicContact CG2-CD1 4.32Å; V125-V178 HydrophobicContact CG1-CG1 4.5Å; V125-V178 HydrophobicContact CG2-CG1 4.41Å; V125-V178 HydrophobicContact CG2-CG2 3.97Å; V125-T181 HydrophobicContact CB-CG2 3.92Å; V125-T181 HydrophobicContact CG1-CG2 3.73Å; V125-L182 HydrophobicContact CG1-CD1 4.36Å; V125-L182 HydrophobicContact CG1-CD2 3.74Å; V125-L182 HydrophobicContact CG1-CG 3.71Å
126	G	73.7	Confident	72.7	Confident	29 Å²	29	44.1 Å²	44.1	30%	0.299	23%	0.232	S	C	.	.	H	α-helix	trans	-60.9	-44.1	172.6	0	0	0	0	0	113.2	V122 P123 L124 R129 S130	V122-G126 PolarHBondContact O-N 2.86Å; P123-G126 PolarHBondContact O-N 3.27Å; L124-G126 VanDerWaalsContact C-N 3.28Å; L124-G126 PolarHBondContact O-N 3.5Å; G126-R129 WeakPolarHBondContact O-CB 3.39Å; G126-R129 PolarHBondContact O-N 3Å; G126-S130 PolarHBondContact O-N 3.24Å
127	C	77.2	Confident	72.8	Confident	19 Å²	19	44.6 Å²	44.6	13%	0.128	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-43.1	175.2	-70.7	0	0	0	0	111.7	L76 P123 L124 R129 S130 V131	L76-C127 HydrophobicContact CB-CB 4.05Å; L76-C127 HydrophobicContact CD1-CB 3.45Å; L76-C127 VanDerWaalsContact CD1-CB 3.45Å; L76-C127 HydrophobicContact CG-CB 4.3Å; P123-C127 PolarHBondContact O-N 2.88Å; P123-C127 PolarHBondContact O-SG 3.04Å; P123-C127 VanDerWaalsContact O-SG 3.38Å; L124-C127 PolarHBondContact O-N 3.44Å; C127-R129 VanDerWaalsContact C-N 3.33Å; C127-R129 PolarHBondContact O-N 3.38Å; C127-S130 WeakPolarHBondContact O-CB 3.47Å; C127-S130 PolarHBondContact O-N 3.26Å; C127-S130 VanDerWaalsContact O-N 3.13Å; C127-V131 PolarHBondContact O-N 3.05Å
128	I	80.1	Confident	72.8	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-45	174.1	-67.1	169.1	0	0	0	110.5	L76 L124 V125 S130 V131 L132 V161 I164 F165	L76-I128 HydrophobicContact CD1-CG1 3.99Å; L76-I128 HydrophobicContact CD2-CG1 4.25Å; L124-I128 HydrophobicContact CD1-CD1 4.31Å; L124-I128 HydrophobicContact CG-CD1 4.27Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 2.99Å; V125-I128 PolarHBondContact O-N 3.22Å; I128-S130 VanDerWaalsContact C-N 3.27Å; I128-S130 PolarHBondContact O-N 3.36Å; I128-V131 PolarHBondContact O-N 2.8Å; I128-L132 HydrophobicContact CG2-CD1 3.89Å; I128-L132 HydrophobicContact CG2-CG 4.27Å; I128-L132 WeakPolarHBondContact O-CG 3.44Å; I128-L132 PolarHBondContact O-N 2.96Å; I128-V161 HydrophobicContact CG2-CG1 4.2Å; I128-V161 HydrophobicContact CG2-CG2 4.09Å; I128-I164 HydrophobicContact CD1-CD1 4.49Å; I128-I164 HydrophobicContact CD1-CG2 3.81Å; I128-F165 HydrophobicContact CG2-CE2 4.19Å; I128-F165 HydrophobicContact CG2-CZ 3.89Å
129	R	74.9	Confident	72.6	Confident	73 Å²	73	32.7 Å²	32.7	28%	0.275	18%	0.184	S	C	.	.	H	α-helix	trans	-57.2	-39.7	175.2	172.3	175.4	178.6	174.4	-0.5	112	V125 G126 C127 G133 T181 L182 T261 L262	V125-R129 WeakPolarHBondContact O-CB 3.17Å; V125-R129 PolarHBondContact O-N 2.92Å; G126-R129 WeakPolarHBondContact O-CB 3.39Å; G126-R129 PolarHBondContact O-N 3Å; C127-R129 VanDerWaalsContact C-N 3.33Å; C127-R129 PolarHBondContact O-N 3.38Å; R129-G133 PolarHBondContact O-N 2.84Å; R129-T181 PolarHBondContact NH1-O 3.24Å; R129-L182 HydrophobicContact CB-CD2 4.44Å; R129-T261 PolarHBondContact NE-OG1 2.98Å; R129-T261 PolarHBondContact NH2-OG1 3.15Å; R129-L262 HydrophobicContact CG-CD1 4.05Å; R129-L262 HydrophobicContact CG-CD2 3.94Å; R129-L262 HydrophobicContact CG-CG 4.04Å
130	S	73.6	Confident	72.4	Confident	55 Å²	55	25 Å²	25	39%	0.385	16%	0.163	S	C	.	.	H	α-helix	trans	-64.8	-47	175.8	-175.2	0	0	0	0	112.4	G126 C127 I128 L132 G133 F134	G126-S130 PolarHBondContact O-N 3.24Å; C127-S130 WeakPolarHBondContact O-CB 3.47Å; C127-S130 PolarHBondContact O-N 3.26Å; C127-S130 VanDerWaalsContact O-N 3.13Å; I128-S130 VanDerWaalsContact C-N 3.27Å; I128-S130 PolarHBondContact O-N 3.36Å; S130-L132 PolarHBondContact O-N 3.05Å; S130-G133 PolarHBondContact O-N 2.97Å; S130-F134 PolarHBondContact O-N 3.05Å
131	V	76.7	Confident	71.7	Confident	5 Å²	5	23.8 Å²	23.8	3%	0.03	15%	0.153	C	C	.	.	H	α-helix	trans	-60.7	-44.9	177.3	173.5	0	0	0	0	110.9	L76 L79 R80 L83 C127 I128 F134 L135 I157	L76-V131 HydrophobicContact CD2-CG2 4.04Å; L79-V131 HydrophobicContact CD2-CG1 4.22Å; R80-V131 HydrophobicContact CB-CG2 4.48Å; L83-V131 HydrophobicContact CD1-CG1 3.99Å; C127-V131 PolarHBondContact O-N 3.05Å; I128-V131 PolarHBondContact O-N 2.8Å; V131-F134 WeakPolarHBondContact O-CB 3.41Å; V131-F134 PolarHBondContact O-N 3.01Å; V131-L135 WeakPolarHBondContact O-CG 3.48Å; V131-L135 PolarHBondContact O-N 3.45Å; V131-I157 HydrophobicContact CG1-CG2 4.28Å
132	L	76.1	Confident	70.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.7	-43.3	177.2	-68.5	175.8	0	0	0	112.2	I128 S130 F134 L135 W158 V161 F196 L262 V265	I128-L132 HydrophobicContact CG2-CD1 3.89Å; I128-L132 HydrophobicContact CG2-CG 4.27Å; I128-L132 WeakPolarHBondContact O-CG 3.44Å; I128-L132 PolarHBondContact O-N 2.96Å; S130-L132 PolarHBondContact O-N 3.05Å; L132-F134 PolarHBondContact O-N 3.16Å; L132-L135 HydrophobicContact CD2-CD1 4.26Å; L132-L135 PolarHBondContact O-N 3.08Å; L132-W158 HydrophobicContact CD1-CZ3 4.46Å; L132-W158 HydrophobicContact CD2-CD2 4.41Å; L132-W158 HydrophobicContact CD2-CE3 4Å; L132-W158 HydrophobicContact CD2-CH2 3.85Å; L132-W158 HydrophobicContact CD2-CZ2 4.23Å; L132-W158 HydrophobicContact CD2-CZ3 3.72Å; L132-V161 HydrophobicContact CD1-CG1 4.11Å; L132-V161 HydrophobicContact CD2-CG1 4.42Å; L132-V161 HydrophobicContact CD2-CG2 4.17Å; L132-F196 HydrophobicContact CD1-CD1 4.06Å; L132-F196 HydrophobicContact CD1-CE1 3.43Å; L132-F196 VanDerWaalsContact CD1-CE1 3.43Å; L132-F196 HydrophobicContact CD1-CE2 4.49Å; L132-F196 HydrophobicContact CD1-CZ 3.66Å; L132-L262 HydrophobicContact CB-CD2 4.08Å; L132-V265 VanDerWaalsContact O-CG2 3.23Å; L132-V265 WeakPolarHBondContact O-CG2 3.48Å
133	G	71.8	Confident	70.1	Confident	34 Å²	34	29.4 Å²	29.4	35%	0.351	18%	0.177	S	C	.	.	H	α-helix	trans	-61.1	-31.8	175.6	0	0	0	0	0	113.3	R129 S130	R129-G133 PolarHBondContact O-N 2.84Å; S130-G133 PolarHBondContact O-N 2.97Å
134	F	71.1	Confident	69	Low	55 Å²	55	29.3 Å²	29.3	24%	0.241	18%	0.18	C	C	.	.	H	α-helix	trans	-71	-34.4	176.3	178.4	-99.2	0	0	0	113.5	L83 V84 K87 S130 V131 L132	L83-F134 HydrophobicContact CB-CD1 4.26Å; L83-F134 HydrophobicContact CB-CE1 3.91Å; V84-F134 HydrophobicContact CB-CZ 4.21Å; V84-F134 HydrophobicContact CG2-CE1 4.17Å; V84-F134 HydrophobicContact CG2-CE2 3.7Å; V84-F134 HydrophobicContact CG2-CZ 3.48Å; V84-F134 VanDerWaalsContact CG2-CZ 3.48Å; K87-F134 HydrophobicContact CD-CE1 4.36Å; K87-F134 HydrophobicContact CD-CZ 3.98Å; S130-F134 PolarHBondContact O-N 3.05Å; V131-F134 WeakPolarHBondContact O-CB 3.41Å; V131-F134 PolarHBondContact O-N 3.01Å; L132-F134 PolarHBondContact O-N 3.16Å
135	L	70.6	Confident	67.8	Low	2 Å²	2	40.1 Å²	40.1	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-66.8	-38	-177.1	-74.6	170.1	0	0	0	112.9	L83 V131 L132 F150 H154 I157	L83-L135 HydrophobicContact CD1-CD2 4.47Å; V131-L135 WeakPolarHBondContact O-CG 3.48Å; V131-L135 PolarHBondContact O-N 3.45Å; L132-L135 HydrophobicContact CD2-CD1 4.26Å; L132-L135 PolarHBondContact O-N 3.08Å; L135-F150 HydrophobicContact CD2-CZ 4.3Å; L135-H154 WeakPolarHBondContact CB-NE2 3.3Å; L135-I157 HydrophobicContact CD1-CB 4.17Å; L135-I157 HydrophobicContact CD1-CD1 3.92Å; L135-I157 HydrophobicContact CD1-CG2 3.69Å; L135-I157 HydrophobicContact CD2-CD1 3.74Å; L135-I157 HydrophobicContact CG-CD1 4.35Å
136	G	70.8	Confident	66.7	Low	12 Å²	12	42.5 Å²	42.5	12%	0.124	24%	0.242	C	C	.	.			trans	64.5	-170.7	-175	0	0	0	0	0	113.1	H154	G136-H154 PolarHBondContact O-CE1 3.46Å
137	P	68	Low	66	Low	34 Å²	34	42.8 Å²	42.8	22%	0.221	24%	0.237	C	C	.	.			trans	-72.3	137.3	-178.9	28.5	-29.4	0	0	0	110.3	T139 S140 C264 V265	P137-T139 PolarHBondContact O-N 3.4Å; P137-S140 WeakPolarHBondContact O-CB 3.46Å; P137-S140 PolarHBondContact O-N 3.4Å; P137-S140 VanDerWaalsContact O-N 3.09Å; P137-S140 PolarHBondContact O-OG 3.01Å; P137-C264 WeakPolarHBondContact CD-O 3.18Å; P137-V265 WeakPolarHBondContact CA-O 3.16Å
138	L	65.3	Low	65.4	Low	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.7	-176.2	-156.6	118.4	0	0	0	112	L141 H154 L155 N203 Y207	L138-L141 VanDerWaalsContact O-CB 3.28Å; L138-L141 WeakPolarHBondContact O-CB 3.48Å; L138-L141 PolarHBondContact O-N 3.13Å; L138-H154 HydrophobicContact CD1-CB 4.17Å; L138-H154 WeakPolarHBondContact CD1-ND1 3.18Å; L138-L155 HydrophobicContact CD1-CD2 4.22Å; L138-N203 HydrophobicContact CB-CB 3.88Å; L138-N203 WeakPolarHBondContact CB-OD1 3.38Å; L138-N203 PolarHBondContact N-OD1 3.32Å; L138-Y207 VanDerWaalsContact CD2-CB 3.47Å; L138-Y207 HydrophobicContact CD2-CD1 4.22Å; L138-Y207 HydrophobicContact CD2-CD2 3.42Å; L138-Y207 VanDerWaalsContact CD2-CD2 3.42Å; L138-Y207 HydrophobicContact CD2-CE2 4.22Å; L138-Y207 HydrophobicContact CD2-CG 3.43Å; L138-Y207 VanDerWaalsContact CD2-CG 3.43Å
139	T	59.9	Low	64.8	Low	4 Å²	4	50.8 Å²	50.8	3%	0.025	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-22.1	-178.3	60.2	0	0	0	0	114.9	P137 L141 L142 L206 Y272	P137-T139 PolarHBondContact O-N 3.4Å; T139-L141 PolarHBondContact O-N 3.44Å; T139-L142 HydrophobicContact CG2-CD1 4.42Å; T139-L142 PolarHBondContact O-N 3Å; T139-L206 HydrophobicContact CG2-CB 3.7Å; T139-L206 HydrophobicContact CG2-CD2 3.28Å; T139-L206 HydrophobicContact CG2-CG 3.52Å; T139-Y272 VanDerWaalsContact CB-OH 3.29Å; T139-Y272 WeakPolarHBondContact CB-OH 3.45Å; T139-Y272 PolarHBondContact O-OH 2.9Å; T139-Y272 WeakPolarHBondContact OG1-CE2 3.46Å; T139-Y272 PolarHBondContact OG1-OH 3.34Å
140	S	63.5	Low	64.6	Low	54 Å²	54	47.5 Å²	47.5	38%	0.378	26%	0.259	S	S	.	.	H	α-helix	trans	-59	-20	169	65.7	0	0	0	0	112.3	P137	P137-S140 WeakPolarHBondContact O-CB 3.46Å; P137-S140 PolarHBondContact O-N 3.4Å; P137-S140 VanDerWaalsContact O-N 3.09Å; P137-S140 PolarHBondContact O-OG 3.01Å
141	L	58.9	Low	64.5	Low	11 Å²	11	45.6 Å²	45.6	6%	0.058	24%	0.244	C	C	.	.	H	α-helix	trans	-85.7	-18	176.5	-54.3	168	0	0	0	113.4	L138 T139 T146 F150 I151 H154	L138-L141 VanDerWaalsContact O-CB 3.28Å; L138-L141 WeakPolarHBondContact O-CB 3.48Å; L138-L141 PolarHBondContact O-N 3.13Å; T139-L141 PolarHBondContact O-N 3.44Å; L141-T146 PolarHBondContact O-OG1 3.18Å; L141-F150 HydrophobicContact CD1-CD1 3.56Å; L141-F150 HydrophobicContact CD1-CE1 3.67Å; L141-F150 HydrophobicContact CD2-CD1 3.34Å; L141-F150 HydrophobicContact CD2-CE1 3.41Å; L141-F150 VanDerWaalsContact CD2-CE1 3.41Å; L141-F150 HydrophobicContact CD2-CG 4.5Å; L141-F150 HydrophobicContact CG-CD1 4.05Å; L141-F150 HydrophobicContact CG-CE1 4.12Å; L141-I151 HydrophobicContact CB-CG1 4.24Å; L141-I151 HydrophobicContact CD1-CG1 4.42Å; L141-H154 HydrophobicContact CD1-CB 4.46Å; L141-H154 VanDerWaalsContact CD1-ND1 3.31Å; L141-H154 WeakPolarHBondContact CD1-ND1 3.44Å
142	L	56.5	Low	64.3	Low	50 Å²	50	46.4 Å²	46.4	26%	0.262	25%	0.247	S	C	.	.	H	α-helix	trans	-79.4	-33.2	177.4	-74.3	172.2	0	0	0	112.4	T139 Y207 L210 T211	T139-L142 HydrophobicContact CG2-CD1 4.42Å; T139-L142 PolarHBondContact O-N 3Å; L142-Y207 HydrophobicContact CD1-CD2 3.95Å; L142-Y207 HydrophobicContact CD2-CD2 3.8Å; L142-Y207 HydrophobicContact CD2-CE2 3.74Å; L142-Y207 HydrophobicContact CG-CD2 4Å; L142-Y207 HydrophobicContact CG-CE2 4.38Å; L142-L210 HydrophobicContact CD1-CB 4.16Å; L142-L210 HydrophobicContact CD1-CD1 3.94Å; L142-T211 HydrophobicContact CD2-CG2 3.48Å; L142-T211 VanDerWaalsContact CD2-CG2 3.48Å
143	E	55.3	Low	64.1	Low	126 Å²	126	46.4 Å²	46.4	59%	0.589	25%	0.247	S	C	*	.	H	α-helix	trans	-68.3	-39.6	-179.2	-75.1	173.1	-163.1	0	0	112.3	Y272	E143-Y272 PolarHBondContact OE1-OH 2.78Å
144	A	50.7	Low	64.4	Low	47 Å²	47	44.8 Å²	44.8	39%	0.388	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	135.7	170.4	0	0	0	0	0	107.3	T146	A144-T146 HydrophobicContact CB-CG2 3.32Å; A144-T146 PolarHBondContact O-N 3.33Å; A144-T146 PolarHBondContact O-OG1 3.47Å
145	K	52.3	Low	64.7	Low	228 Å²	228	42.2 Å²	42.2	99%	0.991	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	54	169.6	-72.2	177.3	175.5	174.6	0	110.8
146	T	53.6	Low	64.9	Low	51 Å²	51	42.5 Å²	42.5	31%	0.313	22%	0.221	S	C	.	.			trans	-78.2	156.2	-164.5	50.9	0	0	0	0	111.5	L141 A144 K148	L141-T146 PolarHBondContact O-OG1 3.18Å; A144-T146 HydrophobicContact CB-CG2 3.32Å; A144-T146 PolarHBondContact O-N 3.33Å; A144-T146 PolarHBondContact O-OG1 3.47Å; T146-K148 PolarHBondContact O-N 2.96Å; T146-K148 VanDerWaalsContact O-N 3.16Å
147	N	59.9	Low	65.4	Low	35 Å²	35	42 Å²	42	19%	0.187	22%	0.215	C	C	.	.			trans	-48	113.8	179.9	-165.7	-16	0	0	0	110.3	S89 N149 F150	S89-N147 PolarHBondContact O-ND2 3.3Å; S89-N147 VanDerWaalsContact O-ND2 3.12Å; N147-N149 PolarHBondContact O-N 3.43Å; N147-N149 WeakPolarHBondContact OD1-CB 3.26Å; N147-N149 PolarHBondContact OD1-N 3.31Å; N147-N149 PolarHBondContact OD1-ND2 3.34Å; N147-F150 PolarHBondContact O-N 2.87Å
148	K	64.5	Low	66.1	Low	158 Å²	158	40.5 Å²	40.5	69%	0.687	21%	0.205	S	C	*	.	H	α-helix	trans	-47.3	-31.5	175.7	-73.9	-178.1	176.3	-179.1	0	112	T146 F150 I151 H152	T146-K148 PolarHBondContact O-N 2.96Å; T146-K148 VanDerWaalsContact O-N 3.16Å; K148-F150 PolarHBondContact O-N 3.29Å; K148-I151 PolarHBondContact O-N 3.31Å; K148-H152 PolarHBondContact O-CD2 2.96Å; K148-H152 VanDerWaalsContact O-CG 3.26Å; K148-H152 PolarHBondContact O-N 3.37Å; K148-H152 VanDerWaalsContact O-N 3.1Å; K148-H152 PolarHBondContact O-ND1 3.38Å
149	N	66.3	Low	66.6	Low	30 Å²	30	40.8 Å²	40.8	16%	0.16	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-35	177	-62.8	-31.8	0	0	0	113.5	L86 N147 H152 A153	L86-N149 HydrophobicContact CD2-CB 4.42Å; N147-N149 PolarHBondContact O-N 3.43Å; N147-N149 WeakPolarHBondContact OD1-CB 3.26Å; N147-N149 PolarHBondContact OD1-N 3.31Å; N147-N149 PolarHBondContact OD1-ND2 3.34Å; N149-H152 PolarHBondContact O-N 2.92Å; N149-A153 WeakPolarHBondContact O-CB 3.44Å; N149-A153 PolarHBondContact O-N 2.92Å
150	F	70.4	Confident	67.5	Low	5 Å²	5	40.6 Å²	40.6	2%	0.022	21%	0.206	C	C	.	.	H	α-helix	trans	-69.7	-39.1	177.7	-167.8	-91.7	0	0	0	111.5	L86 K87 L135 L141 N147 K148 H152 A153 H154	L86-F150 HydrophobicContact CB-CD2 4.08Å; L86-F150 HydrophobicContact CD2-CB 3.6Å; L86-F150 HydrophobicContact CD2-CD2 3.53Å; L86-F150 HydrophobicContact CD2-CG 4.02Å; L86-F150 HydrophobicContact CG-CD2 4.42Å; K87-F150 HydrophobicContact CB-CD2 4.26Å; K87-F150 HydrophobicContact CB-CE2 3.71Å; K87-F150 HydrophobicContact CB-CZ 4.24Å; K87-F150 HydrophobicContact CD-CZ 4.39Å; K87-F150 HydrophobicContact CG-CE2 4.27Å; K87-F150 HydrophobicContact CG-CZ 4.33Å; L135-F150 HydrophobicContact CD2-CZ 4.3Å; L141-F150 HydrophobicContact CD1-CD1 3.56Å; L141-F150 HydrophobicContact CD1-CE1 3.67Å; L141-F150 HydrophobicContact CD2-CD1 3.34Å; L141-F150 HydrophobicContact CD2-CE1 3.41Å; L141-F150 VanDerWaalsContact CD2-CE1 3.41Å; L141-F150 HydrophobicContact CD2-CG 4.5Å; L141-F150 HydrophobicContact CG-CD1 4.05Å; L141-F150 HydrophobicContact CG-CE1 4.12Å; N147-F150 PolarHBondContact O-N 2.87Å; K148-F150 PolarHBondContact O-N 3.29Å; F150-H152 VanDerWaalsContact C-N 3.34Å; F150-A153 PolarHBondContact O-N 2.82Å; F150-H154 VanDerWaalsContact O-CB 3.31Å; F150-H154 WeakPolarHBondContact O-CB 3.33Å; F150-H154 PolarHBondContact O-N 3.46Å
151	I	71.7	Confident	68.3	Low	15 Å²	15	38.4 Å²	38.4	8%	0.077	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-45.7	173.7	-61	172.2	0	0	0	109.8	L141 K148 H154 L155 Y207	L141-I151 HydrophobicContact CB-CG1 4.24Å; L141-I151 HydrophobicContact CD1-CG1 4.42Å; K148-I151 PolarHBondContact O-N 3.31Å; I151-H154 WeakPolarHBondContact O-CB 3.4Å; I151-H154 PolarHBondContact O-N 3.21Å; I151-L155 HydrophobicContact CG2-CD1 4.24Å; I151-L155 WeakPolarHBondContact O-CG 3.37Å; I151-L155 PolarHBondContact O-N 2.91Å; I151-Y207 HydrophobicContact CD1-CE2 4.3Å; I151-Y207 HydrophobicContact CG2-CE2 3.81Å
152	H	72.3	Confident	69.3	Low	21 Å²	21	37.9 Å²	37.9	10%	0.097	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-45.2	177.4	-60.8	164.4	0	0	0	112.4	C49 R97 K148 N149 F150 H154 L155 E156 C216	C49-H152 PolarHBondContact SG-CE1 2.98Å; C49-H152 PolarHBondContact SG-ND1 2.95Å; C49-H152 VanDerWaalsContact SG-ND1 3.39Å; R97-H152 PolarHBondContact NH1-ND1 2.9Å; K148-H152 PolarHBondContact O-CD2 2.96Å; K148-H152 VanDerWaalsContact O-CG 3.26Å; K148-H152 PolarHBondContact O-N 3.37Å; K148-H152 VanDerWaalsContact O-N 3.1Å; K148-H152 PolarHBondContact O-ND1 3.38Å; N149-H152 PolarHBondContact O-N 2.92Å; F150-H152 VanDerWaalsContact C-N 3.34Å; H152-H154 VanDerWaalsContact C-N 3.28Å; H152-H154 PolarHBondContact O-N 3.11Å; H152-L155 PolarHBondContact O-N 3.34Å; H152-E156 WeakPolarHBondContact O-CG 3.46Å; H152-E156 PolarHBondContact O-N 2.84Å; H152-C216 VanDerWaalsContact CD2-SG 3.52Å; H152-C216 PolarHBondContact NE2-SG 3.49Å
153	A	73.2	Confident	70.3	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-42.1	174.7	0	0	0	0	0	111.4	L83 L86 V100 N149 F150 L155 E156 I157	L83-A153 HydrophobicContact CD2-CB 4.42Å; L86-A153 HydrophobicContact CD1-CB 4.46Å; L86-A153 HydrophobicContact CD2-CB 4.35Å; V100-A153 HydrophobicContact CG1-CB 4.12Å; N149-A153 WeakPolarHBondContact O-CB 3.44Å; N149-A153 PolarHBondContact O-N 2.92Å; F150-A153 PolarHBondContact O-N 2.82Å; A153-L155 PolarHBondContact O-N 3.3Å; A153-E156 PolarHBondContact O-N 3.26Å; A153-I157 WeakPolarHBondContact O-CD1 3.34Å; A153-I157 WeakPolarHBondContact O-CG1 3.41Å; A153-I157 PolarHBondContact O-N 3.19Å
154	H	78.4	Confident	71.5	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.5	-44.5	177	-160.7	172	0	0	0	111.6	L135 G136 L138 L141 F150 I151 H152 I157 W158	L135-H154 WeakPolarHBondContact CB-NE2 3.3Å; G136-H154 PolarHBondContact O-CE1 3.46Å; L138-H154 HydrophobicContact CD1-CB 4.17Å; L138-H154 WeakPolarHBondContact CD1-ND1 3.18Å; L141-H154 HydrophobicContact CD1-CB 4.46Å; L141-H154 VanDerWaalsContact CD1-ND1 3.31Å; L141-H154 WeakPolarHBondContact CD1-ND1 3.44Å; F150-H154 VanDerWaalsContact O-CB 3.31Å; F150-H154 WeakPolarHBondContact O-CB 3.33Å; F150-H154 PolarHBondContact O-N 3.46Å; I151-H154 WeakPolarHBondContact O-CB 3.4Å; I151-H154 PolarHBondContact O-N 3.21Å; H152-H154 VanDerWaalsContact C-N 3.28Å; H152-H154 PolarHBondContact O-N 3.11Å; H154-I157 PolarHBondContact O-N 3.44Å; H154-W158 AromaticContact CD2-CD1 3.46Å; H154-W158 VanDerWaalsContact CD2-CD1 3.46Å; H154-W158 AromaticContact CD2-NE1 3.25Å; H154-W158 PolarHBondContact CD2-NE1 3.16Å; H154-W158 VanDerWaalsContact CD2-NE1 3.25Å; H154-W158 AromaticContact NE2-CD1 3.77Å; H154-W158 AromaticContact NE2-NE1 3.05Å; H154-W158 PolarHBondContact NE2-NE1 3.2Å; H154-W158 PolarHBondContact O-N 3.29Å; H154-W158 VanDerWaalsContact O-N 3.15Å
155	L	76.5	Confident	73	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-41.5	175.9	-66.5	169.6	0	0	0	112.3	L138 I151 H152 A153 W158 L159 L204 C218 D219 L222	L138-L155 HydrophobicContact CD1-CD2 4.22Å; I151-L155 HydrophobicContact CG2-CD1 4.24Å; I151-L155 WeakPolarHBondContact O-CG 3.37Å; I151-L155 PolarHBondContact O-N 2.91Å; H152-L155 PolarHBondContact O-N 3.34Å; A153-L155 PolarHBondContact O-N 3.3Å; L155-W158 PolarHBondContact O-N 3.23Å; L155-L159 PolarHBondContact O-N 3.43Å; L155-L159 VanDerWaalsContact O-N 3.08Å; L155-L204 HydrophobicContact CD2-CD2 3.72Å; L155-C218 HydrophobicContact CB-CB 4.47Å; L155-C218 HydrophobicContact CD1-CB 4.04Å; L155-D219 HydrophobicContact CD1-CB 4.05Å; L155-L222 HydrophobicContact CD2-CD2 3.66Å
156	E	75.8	Confident	74.2	Confident	8 Å²	8	20.1 Å²	20.1	4%	0.037	10%	0.099	C	C	.	.	H	α-helix	trans	-65.9	-38.4	177.9	-72.2	172.3	-161.2	0	0	112.2	R97 S101 L104 H152 A153 L159 T160	R97-E156 IonicContact CZ-OE1 3.43Å; R97-E156 IonicContact NE-OE1 2.71Å; R97-E156 PolarHBondContact NE-OE1 3.13Å; R97-E156 IonicContact NH2-OE1 3.19Å; R97-E156 PolarHBondContact NH2-OE1 2.89Å; S101-E156 WeakPolarHBondContact CB-OE2 3.44Å; S101-E156 PolarHBondContact OG-OE2 3.24Å; L104-E156 HydrophobicContact CD1-CB 3.78Å; H152-E156 WeakPolarHBondContact O-CG 3.46Å; H152-E156 PolarHBondContact O-N 2.84Å; A153-E156 PolarHBondContact O-N 3.26Å; E156-L159 PolarHBondContact O-N 2.9Å; E156-T160 WeakPolarHBondContact O-CB 3.23Å; E156-T160 PolarHBondContact O-N 2.95Å; E156-T160 PolarHBondContact O-OG1 3.35Å
157	I	79.8	Confident	75.3	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-62.1	-47.8	174.7	-66.7	159.1	0	0	0	110.2	L83 L104 V131 L135 A153 H154 L159 T160 V161	L83-I157 HydrophobicContact CD1-CD1 3.48Å; L83-I157 VanDerWaalsContact CD1-CD1 3.48Å; L83-I157 HydrophobicContact CD2-CD1 3.52Å; L83-I157 HydrophobicContact CG-CD1 4.1Å; L104-I157 HydrophobicContact CD1-CG1 3.88Å; L104-I157 HydrophobicContact CD2-CB 4.47Å; L104-I157 HydrophobicContact CD2-CG1 3.97Å; L104-I157 HydrophobicContact CG-CG1 4.47Å; V131-I157 HydrophobicContact CG1-CG2 4.28Å; L135-I157 HydrophobicContact CD1-CB 4.17Å; L135-I157 HydrophobicContact CD1-CD1 3.92Å; L135-I157 HydrophobicContact CD1-CG2 3.69Å; L135-I157 HydrophobicContact CD2-CD1 3.74Å; L135-I157 HydrophobicContact CG-CD1 4.35Å; A153-I157 WeakPolarHBondContact O-CD1 3.34Å; A153-I157 WeakPolarHBondContact O-CG1 3.41Å; A153-I157 PolarHBondContact O-N 3.19Å; H154-I157 PolarHBondContact O-N 3.44Å; I157-L159 VanDerWaalsContact C-N 3.27Å; I157-L159 PolarHBondContact O-N 2.85Å; I157-T160 PolarHBondContact O-N 3.5Å; I157-T160 VanDerWaalsContact O-N 3.16Å; I157-V161 HydrophobicContact CG2-CG2 4.02Å; I157-V161 WeakPolarHBondContact O-CB 3.33Å; I157-V161 VanDerWaalsContact O-CG2 3.26Å; I157-V161 WeakPolarHBondContact O-CG2 3.36Å; I157-V161 PolarHBondContact O-N 3.24Å
158	W	82.3	Confident	76.2	Confident	2 Å²	2	18 Å²	18	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-58.2	-42.6	178.3	-81.9	120.3	0	0	0	112.4	L132 H154 L155 T160 V161 L162 F196 I199 V200 L222 V265	L132-W158 HydrophobicContact CD1-CZ3 4.46Å; L132-W158 HydrophobicContact CD2-CD2 4.41Å; L132-W158 HydrophobicContact CD2-CE3 4Å; L132-W158 HydrophobicContact CD2-CH2 3.85Å; L132-W158 HydrophobicContact CD2-CZ2 4.23Å; L132-W158 HydrophobicContact CD2-CZ3 3.72Å; H154-W158 AromaticContact CD2-CD1 3.46Å; H154-W158 VanDerWaalsContact CD2-CD1 3.46Å; H154-W158 AromaticContact CD2-NE1 3.25Å; H154-W158 PolarHBondContact CD2-NE1 3.16Å; H154-W158 VanDerWaalsContact CD2-NE1 3.25Å; H154-W158 AromaticContact NE2-CD1 3.77Å; H154-W158 AromaticContact NE2-NE1 3.05Å; H154-W158 PolarHBondContact NE2-NE1 3.2Å; H154-W158 PolarHBondContact O-N 3.29Å; H154-W158 VanDerWaalsContact O-N 3.15Å; L155-W158 PolarHBondContact O-N 3.23Å; W158-T160 VanDerWaalsContact C-N 3.32Å; W158-T160 PolarHBondContact O-N 3.31Å; W158-V161 PolarHBondContact O-N 3.19Å; W158-L162 WeakPolarHBondContact O-CB 3.28Å; W158-L162 VanDerWaalsContact O-CG 3.3Å; W158-L162 WeakPolarHBondContact O-CG 3.2Å; W158-L162 PolarHBondContact O-N 3.42Å; W158-F196 HydrophobicContact CH2-CD1 4.18Å; W158-F196 HydrophobicContact CZ3-CB 4.46Å; W158-F196 AromaticContact CZ3-CD1 3.85Å; W158-F196 HydrophobicContact CZ3-CD1 3.85Å; W158-I199 HydrophobicContact CH2-CB 4.37Å; W158-I199 HydrophobicContact CH2-CG2 3.67Å; W158-I199 HydrophobicContact CZ2-CG2 3.98Å; W158-V200 HydrophobicContact CB-CG1 4.42Å; W158-V200 HydrophobicContact CB-CG2 4.11Å; W158-V200 HydrophobicContact CD2-CG2 3.4Å; W158-V200 VanDerWaalsContact CD2-CG2 3.4Å; W158-V200 HydrophobicContact CE3-CG2 3.09Å; W158-V200 HydrophobicContact CG-CG2 3.88Å; W158-V200 HydrophobicContact CH2-CG2 4.2Å; W158-V200 HydrophobicContact CZ2-CG2 4.46Å; W158-V200 HydrophobicContact CZ3-CG2 3.54Å; W158-L222 HydrophobicContact CB-CD1 4.43Å; W158-L222 HydrophobicContact CB-CD2 4.13Å; W158-V265 HydrophobicContact CH2-CG1 3.85Å; W158-V265 HydrophobicContact CZ2-CG1 3.45Å; W158-V265 VanDerWaalsContact CZ2-CG1 3.45Å
159	L	77.8	Confident	76.8	Confident	8 Å²	8	11.1 Å²	11.1	4%	0.042	6%	0.056	C	C	.	.	H	α-helix	trans	-62.7	-41.5	178	-165.1	135	0	0	0	112.3	L45 F57 F61 L155 E156 I157 K163 I221 L222 V225	L45-L159 HydrophobicContact CD2-CD2 3.43Å; L45-L159 VanDerWaalsContact CD2-CD2 3.43Å; F57-L159 HydrophobicContact CE1-CD1 3.89Å; F57-L159 HydrophobicContact CE1-CD2 3.9Å; F57-L159 HydrophobicContact CE1-CG 4.49Å; F57-L159 HydrophobicContact CZ-CD1 4.12Å; F57-L159 HydrophobicContact CZ-CD2 3.53Å; F57-L159 HydrophobicContact CZ-CG 4.49Å; F61-L159 HydrophobicContact CD2-CD2 3.93Å; F61-L159 HydrophobicContact CE2-CD2 3.65Å; F61-L159 HydrophobicContact CE2-CG 4.12Å; L155-L159 PolarHBondContact O-N 3.43Å; L155-L159 VanDerWaalsContact O-N 3.08Å; E156-L159 PolarHBondContact O-N 2.9Å; I157-L159 VanDerWaalsContact C-N 3.27Å; I157-L159 PolarHBondContact O-N 2.85Å; L159-K163 PolarHBondContact O-N 2.65Å; L159-K163 VanDerWaalsContact O-N 3.08Å; L159-I221 HydrophobicContact CD1-CG2 3.47Å; L159-I221 VanDerWaalsContact CD1-CG2 3.47Å; L159-L222 HydrophobicContact CB-CD1 3.94Å; L159-L222 HydrophobicContact CD1-CD1 4.1Å; L159-L222 HydrophobicContact CG-CD1 4.32Å; L159-V225 HydrophobicContact CD1-CG2 3.88Å; L159-V225 HydrophobicContact CG-CG2 4.45Å
160	T	77.6	Confident	77.2	Confident	1 Å²	1	15.5 Å²	15.5	1%	0.006	8%	0.079	C	C	.	.	H	α-helix	trans	-67.4	-44.3	178.2	-54.5	0	0	0	0	111.4	L104 C108 E156 I157 W158 L162 K163 I164	L104-T160 HydrophobicContact CB-CG2 4.14Å; L104-T160 HydrophobicContact CD2-CG2 3.91Å; L104-T160 WeakPolarHBondContact O-CG2 3.47Å; C108-T160 HydrophobicContact CB-CG2 4.14Å; E156-T160 WeakPolarHBondContact O-CB 3.23Å; E156-T160 PolarHBondContact O-N 2.95Å; E156-T160 PolarHBondContact O-OG1 3.35Å; I157-T160 PolarHBondContact O-N 3.5Å; I157-T160 VanDerWaalsContact O-N 3.16Å; W158-T160 VanDerWaalsContact C-N 3.32Å; W158-T160 PolarHBondContact O-N 3.31Å; T160-L162 PolarHBondContact O-N 3.05Å; T160-K163 WeakPolarHBondContact O-CB 3.28Å; T160-K163 PolarHBondContact O-N 2.98Å; T160-I164 HydrophobicContact CG2-CD1 4.01Å; T160-I164 WeakPolarHBondContact O-CG1 3.41Å; T160-I164 PolarHBondContact O-N 2.95Å
161	V	81	Confident	77.5	Confident	8 Å²	8	19.5 Å²	19.5	5%	0.048	9%	0.094	C	C	.	.	H	α-helix	trans	-61.9	-43.8	177.2	167.6	0	0	0	0	111.2	I128 L132 I157 W158 K163 I164 F165	I128-V161 HydrophobicContact CG2-CG1 4.2Å; I128-V161 HydrophobicContact CG2-CG2 4.09Å; L132-V161 HydrophobicContact CD1-CG1 4.11Å; L132-V161 HydrophobicContact CD2-CG1 4.42Å; L132-V161 HydrophobicContact CD2-CG2 4.17Å; I157-V161 HydrophobicContact CG2-CG2 4.02Å; I157-V161 WeakPolarHBondContact O-CB 3.33Å; I157-V161 VanDerWaalsContact O-CG2 3.26Å; I157-V161 WeakPolarHBondContact O-CG2 3.36Å; I157-V161 PolarHBondContact O-N 3.24Å; W158-V161 PolarHBondContact O-N 3.19Å; V161-K163 VanDerWaalsContact C-N 3.32Å; V161-K163 PolarHBondContact O-N 3.36Å; V161-I164 PolarHBondContact O-N 3.17Å; V161-F165 HydrophobicContact CG1-CD2 3.5Å; V161-F165 VanDerWaalsContact CG1-CD2 3.5Å; V161-F165 HydrophobicContact CG1-CE2 3.32Å; V161-F165 HydrophobicContact CG1-CZ 4.4Å; V161-F165 WeakPolarHBondContact O-CD2 3.38Å; V161-F165 PolarHBondContact O-N 2.68Å
162	L	80	Confident	77.4	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.1	-39.3	174.9	-73.1	174.5	0	0	0	111.8	W158 T160 N166 F196 L197 V200 L222 F229	W158-L162 WeakPolarHBondContact O-CB 3.28Å; W158-L162 VanDerWaalsContact O-CG 3.3Å; W158-L162 WeakPolarHBondContact O-CG 3.2Å; W158-L162 PolarHBondContact O-N 3.42Å; T160-L162 PolarHBondContact O-N 3.05Å; L162-N166 VanDerWaalsContact O-CB 3.24Å; L162-N166 WeakPolarHBondContact O-CB 3.03Å; L162-N166 PolarHBondContact O-N 3.01Å; L162-F196 HydrophobicContact CD2-CB 4.49Å; L162-L197 HydrophobicContact CD1-CD1 4.47Å; L162-L197 HydrophobicContact CD2-CB 4.35Å; L162-L197 HydrophobicContact CD2-CD1 4.25Å; L162-V200 HydrophobicContact CD1-CG1 4.46Å; L162-V200 HydrophobicContact CD1-CG2 4.23Å; L162-V200 HydrophobicContact CG-CG2 4.46Å; L162-L222 HydrophobicContact CD1-CD1 4.16Å; L162-F229 HydrophobicContact CB-CE2 4.49Å
163	K	77.6	Confident	77.5	Confident	31 Å²	31	28.2 Å²	28.2	14%	0.135	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-45.3	175.8	-169.9	163.9	171.9	173.1	0	111.8	F61 C108 L159 T160 V161 N166 F167	F61-K163 HydrophobicContact CD2-CD 3.95Å; F61-K163 HydrophobicContact CE2-CB 3.71Å; F61-K163 HydrophobicContact CE2-CD 3.62Å; F61-K163 HydrophobicContact CE2-CG 3.96Å; F61-K163 HydrophobicContact CZ-CB 3.6Å; F61-K163 HydrophobicContact CZ-CD 4Å; F61-K163 HydrophobicContact CZ-CG 3.86Å; F61-K163 WeakPolarHBondContact O-CE 3.5Å; F61-K163 PolarHBondContact O-NZ 3.48Å; F61-K163 VanDerWaalsContact O-NZ 3.12Å; C108-K163 WeakPolarHBondContact SG-CD 3.19Å; C108-K163 VanDerWaalsContact SG-CE 3.56Å; L159-K163 PolarHBondContact O-N 2.65Å; L159-K163 VanDerWaalsContact O-N 3.08Å; T160-K163 WeakPolarHBondContact O-CB 3.28Å; T160-K163 PolarHBondContact O-N 2.98Å; V161-K163 VanDerWaalsContact C-N 3.32Å; V161-K163 PolarHBondContact O-N 3.36Å; K163-N166 PolarHBondContact O-N 3.36Å; K163-F167 PolarHBondContact O-N 2.86Å
164	I	79.5	Confident	77.7	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.5	-48.6	177.5	-71.2	166.4	0	0	0	110.8	L107 V111 I128 T160 V161 N166 F167 L168	L107-I164 HydrophobicContact CD2-CD1 3.77Å; L107-I164 HydrophobicContact CG-CD1 3.84Å; V111-I164 HydrophobicContact CB-CG1 4.42Å; V111-I164 HydrophobicContact CG1-CG1 4.27Å; V111-I164 HydrophobicContact CG1-CG2 3.93Å; I128-I164 HydrophobicContact CD1-CD1 4.49Å; I128-I164 HydrophobicContact CD1-CG2 3.81Å; T160-I164 HydrophobicContact CG2-CD1 4.01Å; T160-I164 WeakPolarHBondContact O-CG1 3.41Å; T160-I164 PolarHBondContact O-N 2.95Å; V161-I164 PolarHBondContact O-N 3.17Å; I164-N166 PolarHBondContact O-N 3.33Å; I164-F167 WeakPolarHBondContact O-CB 3.45Å; I164-F167 PolarHBondContact O-N 3.28Å; I164-L168 HydrophobicContact CG2-CD1 3.85Å; I164-L168 HydrophobicContact CG2-CG 4.33Å; I164-L168 WeakPolarHBondContact O-CG 3.48Å; I164-L168 PolarHBondContact O-N 3.49Å
165	F	81.8	Confident	77.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.9	-36.6	179	-74.7	-46.8	0	0	0	112.6	I128 V161 F167 L168 C169 V178 L182 C193 F196	I128-F165 HydrophobicContact CG2-CE2 4.19Å; I128-F165 HydrophobicContact CG2-CZ 3.89Å; V161-F165 HydrophobicContact CG1-CD2 3.5Å; V161-F165 VanDerWaalsContact CG1-CD2 3.5Å; V161-F165 HydrophobicContact CG1-CE2 3.32Å; V161-F165 HydrophobicContact CG1-CZ 4.4Å; V161-F165 WeakPolarHBondContact O-CD2 3.38Å; V161-F165 PolarHBondContact O-N 2.68Å; F165-F167 VanDerWaalsContact C-N 3.3Å; F165-F167 PolarHBondContact O-N 3.36Å; F165-L168 HydrophobicContact CD1-CD1 4.47Å; F165-L168 PolarHBondContact O-N 2.95Å; F165-C169 WeakPolarHBondContact O-CB 3.4Å; F165-C169 PolarHBondContact O-N 3.08Å; F165-C169 PolarHBondContact O-SG 2.74Å; F165-V178 HydrophobicContact CD1-CG1 4.11Å; F165-V178 HydrophobicContact CE1-CG1 3.98Å; F165-L182 HydrophobicContact CE1-CD1 4.17Å; F165-L182 HydrophobicContact CZ-CD1 4.19Å; F165-L182 HydrophobicContact CZ-CD2 4.4Å; F165-C193 HydrophobicContact CB-CB 4.27Å; F165-F196 AromaticContact CD2-CD2 3.61Å; F165-F196 HydrophobicContact CD2-CD2 3.61Å; F165-F196 HydrophobicContact CD2-CE2 4.1Å; F165-F196 HydrophobicContact CD2-CG 4.28Å; F165-F196 HydrophobicContact CE1-CE2 4.47Å; F165-F196 AromaticContact CE2-CD2 3.21Å; F165-F196 HydrophobicContact CE2-CD2 3.21Å; F165-F196 AromaticContact CE2-CE2 3.25Å; F165-F196 HydrophobicContact CE2-CE2 3.25Å; F165-F196 AromaticContact CE2-CG 3.99Å; F165-F196 HydrophobicContact CE2-CG 3.99Å; F165-F196 HydrophobicContact CE2-CZ 4.07Å; F165-F196 AromaticContact CZ-CD2 3.91Å; F165-F196 HydrophobicContact CZ-CD2 3.91Å; F165-F196 AromaticContact CZ-CE2 3.5Å; F165-F196 HydrophobicContact CZ-CE2 3.5Å; F165-F196 VanDerWaalsContact CZ-CE2 3.5Å; F165-F196 HydrophobicContact CZ-CZ 4.3Å
166	N	77.5	Confident	77.5	Confident	46 Å²	46	36.4 Å²	36.4	25%	0.246	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-44.9	171.7	179.3	43.2	0	0	0	111.2	L162 K163 I164 N170 F229	L162-N166 VanDerWaalsContact O-CB 3.24Å; L162-N166 WeakPolarHBondContact O-CB 3.03Å; L162-N166 PolarHBondContact O-N 3.01Å; K163-N166 PolarHBondContact O-N 3.36Å; I164-N166 PolarHBondContact O-N 3.33Å; N166-N170 WeakPolarHBondContact O-CB 3.37Å; N166-N170 PolarHBondContact O-N 3.02Å; N166-N170 VanDerWaalsContact O-N 3.09Å; N166-N170 PolarHBondContact O-ND2 3.47Å; N166-N170 PolarHBondContact OD1-ND2 3.36Å; N166-F229 HydrophobicContact CB-CE1 3.77Å; N166-F229 HydrophobicContact CB-CZ 3.66Å; N166-F229 VanDerWaalsContact CG-CE1 3.42Å
167	F	78	Confident	77.5	Confident	41 Å²	41	37.9 Å²	37.9	18%	0.18	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-50.4	176.2	176.5	-98.6	0	0	0	112.5	V111 T112 K163 I164 F165 N170	V111-F167 HydrophobicContact CG1-CD1 4.26Å; V111-F167 WeakPolarHBondContact O-CE1 3.48Å; T112-F167 HydrophobicContact CG2-CB 4.32Å; T112-F167 HydrophobicContact CG2-CD2 4.03Å; T112-F167 HydrophobicContact CG2-CG 4.07Å; T112-F167 WeakPolarHBondContact O-CE2 3.4Å; T112-F167 WeakPolarHBondContact O-CZ 3.21Å; K163-F167 PolarHBondContact O-N 2.86Å; I164-F167 WeakPolarHBondContact O-CB 3.45Å; I164-F167 PolarHBondContact O-N 3.28Å; F165-F167 VanDerWaalsContact C-N 3.3Å; F165-F167 PolarHBondContact O-N 3.36Å; F167-N170 PolarHBondContact O-N 3.04Å
168	L	77.9	Confident	77.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-43.9	-178.9	-67.7	175.1	0	0	0	111.8	V125 I164 F165 N170 R171 Y174 V178	V125-L168 HydrophobicContact CG2-CD1 4.32Å; I164-L168 HydrophobicContact CG2-CD1 3.85Å; I164-L168 HydrophobicContact CG2-CG 4.33Å; I164-L168 WeakPolarHBondContact O-CG 3.48Å; I164-L168 PolarHBondContact O-N 3.49Å; F165-L168 HydrophobicContact CD1-CD1 4.47Å; F165-L168 PolarHBondContact O-N 2.95Å; L168-N170 VanDerWaalsContact C-N 3.32Å; L168-N170 PolarHBondContact O-N 3.19Å; L168-R171 PolarHBondContact O-N 3.19Å; L168-Y174 HydrophobicContact CD2-CD2 3.99Å; L168-Y174 HydrophobicContact CD2-CE2 4.37Å; L168-V178 HydrophobicContact CB-CG2 4.35Å; L168-V178 HydrophobicContact CD1-CG2 4.37Å
169	C	76.6	Confident	77.1	Confident	14 Å²	14	37.8 Å²	37.8	10%	0.095	20%	0.197	C	C	.	.	H	α-helix	trans	-76.3	-16	-176.9	-63.2	0	0	0	0	113.8	F165 R171 V175 N191 C193	F165-C169 WeakPolarHBondContact O-CB 3.4Å; F165-C169 PolarHBondContact O-N 3.08Å; F165-C169 PolarHBondContact O-SG 2.74Å; C169-R171 PolarHBondContact O-N 3.14Å; C169-V175 HydrophobicContact CB-CG2 4.34Å; C169-V175 WeakPolarHBondContact O-CG2 3.37Å; C169-N191 WeakPolarHBondContact CB-OD1 3.45Å; C169-N191 PolarHBondContact SG-OD1 3.36Å; C169-C193 HydrophobicContact CB-CB 4.41Å
170	N	74.9	Confident	76.9	Confident	122 Å²	122	43.4 Å²	43.4	65%	0.652	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-16.7	169.4	-77.4	-26	0	0	0	112.5	N166 F167 L168	N166-N170 WeakPolarHBondContact O-CB 3.37Å; N166-N170 PolarHBondContact O-N 3.02Å; N166-N170 VanDerWaalsContact O-N 3.09Å; N166-N170 PolarHBondContact O-ND2 3.47Å; N166-N170 PolarHBondContact OD1-ND2 3.36Å; F167-N170 PolarHBondContact O-N 3.04Å; L168-N170 VanDerWaalsContact C-N 3.32Å; L168-N170 PolarHBondContact O-N 3.19Å
171	R	76.6	Confident	76.8	Confident	90 Å²	90	44.6 Å²	44.6	34%	0.34	23%	0.23	S	C	.	.	S	Bend	trans	-101	109	174.2	-66.1	178.4	178.4	-151.7	1.3	109.3	L168 C169 E173 Y174	L168-R171 PolarHBondContact O-N 3.19Å; C169-R171 PolarHBondContact O-N 3.14Å; R171-E173 PolarHBondContact O-N 3.08Å; R171-Y174 HydrophobicContact CB-CD2 3.71Å; R171-Y174 HydrophobicContact CB-CE2 4.11Å; R171-Y174 HydrophobicContact CB-CG 4.37Å; R171-Y174 HydrophobicContact CG-CD2 4.35Å; R171-Y174 HydrophobicContact CG-CE2 4.35Å; R171-Y174 PolarHBondContact O-N 3.07Å
172	A	70.8	Confident	76.4	Confident	89 Å²	89	44.2 Å²	44.2	74%	0.736	23%	0.228	S	C	*	.	H	α-helix	trans	-50.9	-34.8	-176.1	0	0	0	0	0	113.5	Y174 V175	A172-Y174 VanDerWaalsContact C-N 3.3Å; A172-Y174 PolarHBondContact O-N 3.16Å; A172-V175 PolarHBondContact O-N 3.28Å
173	E	73.7	Confident	76	Confident	130 Å²	130	45.6 Å²	45.6	61%	0.607	24%	0.243	S	C	*	.	H	α-helix	trans	-66.3	-24.5	-179.4	-61.2	-168.5	-145.2	0	0	115.1	K118 R171	K118-E173 WeakPolarHBondContact CE-OE2 3.27Å; K118-E173 IonicContact NZ-OE2 3.94Å; K118-E173 PolarHBondContact NZ-OE2 2.8Å; R171-E173 PolarHBondContact O-N 3.08Å
174	Y	78	Confident	75.6	Confident	16 Å²	16	44.2 Å²	44.2	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-93.2	-21	179.5	-59.6	-32.7	0	0	0	112.3	F116 K118 V121 L168 R171 A172 E176 L177 V178	F116-Y174 PolarHBondContact O-OH 3.33Å; K118-Y174 HydrophobicContact CG-CE1 4.45Å; V121-Y174 HydrophobicContact CG2-CD1 3.89Å; V121-Y174 HydrophobicContact CG2-CE1 3.84Å; V121-Y174 HydrophobicContact CG2-CG 4.36Å; L168-Y174 HydrophobicContact CD2-CD2 3.99Å; L168-Y174 HydrophobicContact CD2-CE2 4.37Å; R171-Y174 HydrophobicContact CB-CD2 3.71Å; R171-Y174 HydrophobicContact CB-CE2 4.11Å; R171-Y174 HydrophobicContact CB-CG 4.37Å; R171-Y174 HydrophobicContact CG-CD2 4.35Å; R171-Y174 HydrophobicContact CG-CE2 4.35Å; R171-Y174 PolarHBondContact O-N 3.07Å; A172-Y174 VanDerWaalsContact C-N 3.3Å; A172-Y174 PolarHBondContact O-N 3.16Å; Y174-E176 VanDerWaalsContact C-N 3.35Å; Y174-E176 PolarHBondContact O-N 2.88Å; Y174-L177 PolarHBondContact O-N 3.14Å; Y174-V178 VanDerWaalsContact O-CB 3.31Å; Y174-V178 WeakPolarHBondContact O-CB 3.19Å; Y174-V178 WeakPolarHBondContact O-CG2 3.38Å; Y174-V178 PolarHBondContact O-N 2.85Å
175	V	75.7	Confident	74.7	Confident	34 Å²	34	48.9 Å²	48.9	21%	0.206	26%	0.257	C	S	.	.	H	α-helix	trans	-56.4	-48.3	-175	176.5	0	0	0	0	111.5	C169 A172 N179	C169-V175 HydrophobicContact CB-CG2 4.34Å; C169-V175 WeakPolarHBondContact O-CG2 3.37Å; A172-V175 PolarHBondContact O-N 3.28Å; V175-N179 VanDerWaalsContact O-CB 3.29Å; V175-N179 WeakPolarHBondContact O-CB 3.49Å; V175-N179 PolarHBondContact O-N 3.06Å; V175-N179 PolarHBondContact O-ND2 3.41Å
176	E	73.9	Confident	73.3	Confident	124 Å²	124	52.7 Å²	52.7	58%	0.579	28%	0.282	S	S	*	.	H	α-helix	trans	-62.9	-46.1	-179	-169.4	175	-171.3	0	0	111.6	Y174 N179 E180	Y174-E176 VanDerWaalsContact C-N 3.35Å; Y174-E176 PolarHBondContact O-N 2.88Å; E176-N179 PolarHBondContact O-N 3.47Å; E176-E180 WeakPolarHBondContact O-CB 3.24Å; E176-E180 PolarHBondContact O-N 2.96Å
177	L	76.1	Confident	72.3	Confident	38 Å²	38	54.5 Å²	54.5	20%	0.199	29%	0.289	C	S	.	.	H	α-helix	trans	-66.7	-42.4	-179.2	-169.4	80	0	0	0	112.5	K118 V121 V122 Y174 E180 T181	K118-L177 WeakPolarHBondContact O-CD2 3.37Å; V121-L177 HydrophobicContact CB-CD2 3.67Å; V121-L177 HydrophobicContact CG1-CD2 3.89Å; V122-L177 HydrophobicContact CG2-CD1 3.59Å; V122-L177 HydrophobicContact CG2-CD2 3.78Å; V122-L177 HydrophobicContact CG2-CG 3.69Å; Y174-L177 PolarHBondContact O-N 3.14Å; L177-E180 PolarHBondContact O-N 3.47Å; L177-T181 WeakPolarHBondContact O-CB 3.25Å; L177-T181 PolarHBondContact O-N 3.09Å; L177-T181 PolarHBondContact O-OG1 3.05Å
178	V	77.6	Confident	71	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.3	-47.9	176.2	171.7	0	0	0	0	109.4	V121 V125 F165 L168 Y174 E180 T181 L182 A192	V121-V178 HydrophobicContact CG1-CG2 3.94Å; V125-V178 HydrophobicContact CG1-CG1 4.5Å; V125-V178 HydrophobicContact CG2-CG1 4.41Å; V125-V178 HydrophobicContact CG2-CG2 3.97Å; F165-V178 HydrophobicContact CD1-CG1 4.11Å; F165-V178 HydrophobicContact CE1-CG1 3.98Å; L168-V178 HydrophobicContact CB-CG2 4.35Å; L168-V178 HydrophobicContact CD1-CG2 4.37Å; Y174-V178 VanDerWaalsContact O-CB 3.31Å; Y174-V178 WeakPolarHBondContact O-CB 3.19Å; Y174-V178 WeakPolarHBondContact O-CG2 3.38Å; Y174-V178 PolarHBondContact O-N 2.85Å; V178-E180 VanDerWaalsContact C-N 3.34Å; V178-E180 PolarHBondContact O-N 3.27Å; V178-T181 PolarHBondContact O-N 3.27Å; V178-L182 HydrophobicContact CG1-CD1 3.66Å; V178-L182 HydrophobicContact CG1-CG 4.47Å; V178-L182 WeakPolarHBondContact O-CB 3.28Å; V178-L182 WeakPolarHBondContact O-CD1 3.33Å; V178-L182 WeakPolarHBondContact O-CG 3.46Å; V178-L182 PolarHBondContact O-N 3.09Å; V178-A192 HydrophobicContact CG1-CB 3.59Å
179	N	75.9	Confident	69.8	Low	1 Å²	1	62.4 Å²	62.4	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-60.5	-42.3	177.7	-76.8	-10.5	0	0	0	112.2	V175 E176 L182 G183 L184 L190 A192	V175-N179 VanDerWaalsContact O-CB 3.29Å; V175-N179 WeakPolarHBondContact O-CB 3.49Å; V175-N179 PolarHBondContact O-N 3.06Å; V175-N179 PolarHBondContact O-ND2 3.41Å; E176-N179 PolarHBondContact O-N 3.47Å; N179-L182 PolarHBondContact O-N 3.18Å; N179-G183 PolarHBondContact O-N 2.93Å; N179-L184 HydrophobicContact CB-CB 4.36Å; N179-L184 PolarHBondContact O-N 3.43Å; N179-L190 PolarHBondContact ND2-O 3.41Å; N179-L190 PolarHBondContact OD1-O 2.95Å; N179-A192 WeakPolarHBondContact OD1-CB 3.17Å; N179-A192 PolarHBondContact OD1-N 2.93Å
180	E	74.2	Confident	68.9	Low	126 Å²	126	64 Å²	64	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-63.3	-48.1	176.8	-172	179.3	-173.8	0	0	111.8	E176 L177 V178 L182 G183	E176-E180 WeakPolarHBondContact O-CB 3.24Å; E176-E180 PolarHBondContact O-N 2.96Å; L177-E180 PolarHBondContact O-N 3.47Å; V178-E180 VanDerWaalsContact C-N 3.34Å; V178-E180 PolarHBondContact O-N 3.27Å; E180-L182 PolarHBondContact O-N 3.31Å; E180-G183 PolarHBondContact O-N 3.43Å
181	T	74.9	Confident	68.6	Low	26 Å²	26	61.7 Å²	61.7	16%	0.16	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-32.7	179.6	-50.7	0	0	0	0	112.1	V122 V125 R129 L177 V178	V122-T181 HydrophobicContact CG1-CG2 4.02Å; V125-T181 HydrophobicContact CB-CG2 3.92Å; V125-T181 HydrophobicContact CG1-CG2 3.73Å; R129-T181 PolarHBondContact NH1-O 3.24Å; L177-T181 WeakPolarHBondContact O-CB 3.25Å; L177-T181 PolarHBondContact O-N 3.09Å; L177-T181 PolarHBondContact O-OG1 3.05Å; V178-T181 PolarHBondContact O-N 3.27Å
182	L	74.1	Confident	68.4	Low	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.5	176.6	-66.3	169.6	0	0	0	113.8	V125 R129 F165 V178 N179 E180 L184 A192 F196 N260 L262	V125-L182 HydrophobicContact CG1-CD1 4.36Å; V125-L182 HydrophobicContact CG1-CD2 3.74Å; V125-L182 HydrophobicContact CG1-CG 3.71Å; R129-L182 HydrophobicContact CB-CD2 4.44Å; F165-L182 HydrophobicContact CE1-CD1 4.17Å; F165-L182 HydrophobicContact CZ-CD1 4.19Å; F165-L182 HydrophobicContact CZ-CD2 4.4Å; V178-L182 HydrophobicContact CG1-CD1 3.66Å; V178-L182 HydrophobicContact CG1-CG 4.47Å; V178-L182 WeakPolarHBondContact O-CB 3.28Å; V178-L182 WeakPolarHBondContact O-CD1 3.33Å; V178-L182 WeakPolarHBondContact O-CG 3.46Å; V178-L182 PolarHBondContact O-N 3.09Å; N179-L182 PolarHBondContact O-N 3.18Å; E180-L182 PolarHBondContact O-N 3.31Å; L182-L184 HydrophobicContact CB-CD1 4Å; L182-L184 HydrophobicContact CB-CG 3.85Å; L182-L184 HydrophobicContact CD1-CD1 4Å; L182-A192 HydrophobicContact CD1-CB 3.46Å; L182-A192 VanDerWaalsContact CD1-CB 3.46Å; L182-F196 HydrophobicContact CD1-CD2 4.45Å; L182-F196 HydrophobicContact CD1-CE2 3.59Å; L182-F196 HydrophobicContact CD1-CZ 4.42Å; L182-F196 HydrophobicContact CD2-CE2 3.78Å; L182-F196 HydrophobicContact CD2-CZ 3.82Å; L182-F196 HydrophobicContact CG-CE2 4.29Å; L182-N260 PolarHBondContact O-ND2 2.55Å; L182-L262 HydrophobicContact CD2-CD1 3.83Å
183	G	70.5	Confident	68.6	Low	30 Å²	30	53.7 Å²	53.7	31%	0.309	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	31.8	-177.4	0	0	0	0	0	114	N179 E180	N179-G183 PolarHBondContact O-N 2.93Å; E180-G183 PolarHBondContact O-N 3.43Å
184	L	70	Confident	68.6	Low	1 Å²	1	49.4 Å²	49.4	1%	0.005	29%	0.287	C	S	.	.			trans	-90.5	103.1	-179.5	-59.6	175.7	0	0	0	110.5	N179 L182 A192 Y195 F256	N179-L184 HydrophobicContact CB-CB 4.36Å; N179-L184 PolarHBondContact O-N 3.43Å; L182-L184 HydrophobicContact CB-CD1 4Å; L182-L184 HydrophobicContact CB-CG 3.85Å; L182-L184 HydrophobicContact CD1-CD1 4Å; L184-A192 HydrophobicContact CD1-CB 3.89Å; L184-Y195 HydrophobicContact CD1-CD1 4.16Å; L184-Y195 HydrophobicContact CD1-CG 4.21Å; L184-Y195 HydrophobicContact CD2-CD1 3.62Å; L184-Y195 HydrophobicContact CD2-CD2 3.89Å; L184-Y195 HydrophobicContact CD2-CE1 3.79Å; L184-Y195 HydrophobicContact CD2-CE2 4.07Å; L184-Y195 HydrophobicContact CD2-CG 3.65Å; L184-F256 HydrophobicContact CD2-CE1 4.28Å
185	K	59.2	Low	68.5	Low	98 Å²	98	49 Å²	49	43%	0.426	29%	0.286	S	S	.	.	S	Bend	trans	-120.6	145.5	173.7	-70.5	178	-171.5	155	0	111.4	E258	K185-E258 IonicContact NZ-OE1 2.7Å; K185-E258 PolarHBondContact NZ-OE1 3.3Å; K185-E258 IonicContact NZ-OE2 3.56Å; K185-E258 PolarHBondContact NZ-OE2 3.44Å
186	P	54.3	Low	68.7	Low	81 Å²	81	47.4 Å²	47.4	53%	0.526	28%	0.276	S	S	.	.	S	Bend	cis	-75.5	140.5	-2.9	27.8	-31	0	0	0	113.3	S188 S189	P186-S188 PolarHBondContact O-N 3.38Å; P186-S189 PolarHBondContact O-N 3.15Å
187	Q	54.4	Low	69	Low	84 Å²	84	42.2 Å²	42.2	39%	0.393	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23	-173	-71.9	169	-29.8	0	0	114.2
188	S	50.7	Low	69.1	Low	122 Å²	122	42.1 Å²	42.1	85%	0.853	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-14.7	-174.1	57	0	0	0	0	115	P186	P186-S188 PolarHBondContact O-N 3.38Å
189	S	54.6	Low	69.2	Low	84 Å²	84	42.1 Å²	42.1	59%	0.587	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-21.4	-174.9	62.6	0	0	0	0	114.7	P186	P186-S189 PolarHBondContact O-N 3.15Å
190	L	56.2	Low	69.5	Low	49 Å²	49	42.1 Å²	42.1	26%	0.257	25%	0.252	S	S	.	.			trans	-110.6	106.2	-174.6	-82.1	143.6	0	0	0	110.8	N179 F256	N179-L190 PolarHBondContact ND2-O 3.41Å; N179-L190 PolarHBondContact OD1-O 2.95Å; L190-F256 HydrophobicContact CD1-CE1 4.06Å
191	N	69	Low	70	Confident	72 Å²	72	36.1 Å²	36.1	39%	0.385	22%	0.224	S	C	.	.			trans	-77.6	126.9	164.7	178.9	-14.4	0	0	0	108.4	C169 C193 G194 Y195	C169-N191 WeakPolarHBondContact CB-OD1 3.45Å; C169-N191 PolarHBondContact SG-OD1 3.36Å; N191-C193 PolarHBondContact O-N 3.22Å; N191-C193 VanDerWaalsContact O-N 3.15Å; N191-C193 WeakPolarHBondContact OD1-CB 3.4Å; N191-C193 PolarHBondContact OD1-N 3.31Å; N191-G194 WeakPolarHBondContact O-CA 3.21Å; N191-G194 PolarHBondContact O-N 3.31Å; N191-Y195 PolarHBondContact O-N 3.47Å
192	A	72.3	Confident	70.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-47	-40.9	175.6	0	0	0	0	0	113.7	V178 N179 L182 L184 G194 Y195 F196	V178-A192 HydrophobicContact CG1-CB 3.59Å; N179-A192 WeakPolarHBondContact OD1-CB 3.17Å; N179-A192 PolarHBondContact OD1-N 2.93Å; L182-A192 HydrophobicContact CD1-CB 3.46Å; L182-A192 VanDerWaalsContact CD1-CB 3.46Å; L184-A192 HydrophobicContact CD1-CB 3.89Å; A192-G194 VanDerWaalsContact C-N 3.3Å; A192-G194 PolarHBondContact O-N 3.08Å; A192-Y195 PolarHBondContact O-N 3.25Å; A192-F196 WeakPolarHBondContact O-CD2 3.4Å; A192-F196 PolarHBondContact O-N 3.24Å
193	C	75	Confident	70.7	Confident	12 Å²	12	35.5 Å²	35.5	8%	0.081	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-42.2	175.4	-171.7	0	0	0	0	111.5	F165 C169 N191 L197	F165-C193 HydrophobicContact CB-CB 4.27Å; C169-C193 HydrophobicContact CB-CB 4.41Å; N191-C193 PolarHBondContact O-N 3.22Å; N191-C193 VanDerWaalsContact O-N 3.15Å; N191-C193 WeakPolarHBondContact OD1-CB 3.4Å; N191-C193 PolarHBondContact OD1-N 3.31Å; C193-L197 WeakPolarHBondContact O-CB 3.4Å; C193-L197 PolarHBondContact O-N 3.03Å
194	G	73.6	Confident	71.3	Confident	40 Å²	40	34.1 Å²	34.1	41%	0.412	21%	0.205	S	C	.	.	H	α-helix	trans	-68.5	-37.7	177	0	0	0	0	0	113.3	N191 A192 D198	N191-G194 WeakPolarHBondContact O-CA 3.21Å; N191-G194 PolarHBondContact O-N 3.31Å; A192-G194 VanDerWaalsContact C-N 3.3Å; A192-G194 PolarHBondContact O-N 3.08Å; G194-D198 WeakPolarHBondContact O-CB 3.47Å; G194-D198 PolarHBondContact O-N 3.38Å; G194-D198 VanDerWaalsContact O-N 3.16Å
195	Y	76.9	Confident	71.9	Confident	6 Å²	6	34.1 Å²	34.1	2%	0.024	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-48.5	175.6	174.3	-105	0	0	0	112.1	L184 N191 A192 D198 I199 F256 E263	L184-Y195 HydrophobicContact CD1-CD1 4.16Å; L184-Y195 HydrophobicContact CD1-CG 4.21Å; L184-Y195 HydrophobicContact CD2-CD1 3.62Å; L184-Y195 HydrophobicContact CD2-CD2 3.89Å; L184-Y195 HydrophobicContact CD2-CE1 3.79Å; L184-Y195 HydrophobicContact CD2-CE2 4.07Å; L184-Y195 HydrophobicContact CD2-CG 3.65Å; N191-Y195 PolarHBondContact O-N 3.47Å; A192-Y195 PolarHBondContact O-N 3.25Å; Y195-D198 VanDerWaalsContact O-CB 3.28Å; Y195-D198 WeakPolarHBondContact O-CB 3.37Å; Y195-D198 PolarHBondContact O-N 2.94Å; Y195-I199 HydrophobicContact CD1-CD1 4.04Å; Y195-I199 HydrophobicContact CE1-CD1 3.42Å; Y195-I199 VanDerWaalsContact CE1-CD1 3.42Å; Y195-I199 HydrophobicContact CE2-CD1 4.24Å; Y195-I199 PolarHBondContact O-N 3.18Å; Y195-F256 HydrophobicContact CD2-CE1 4.45Å; Y195-F256 HydrophobicContact CD2-CE2 4.32Å; Y195-F256 AromaticContact CD2-CZ 3.61Å; Y195-F256 HydrophobicContact CD2-CZ 3.61Å; Y195-F256 HydrophobicContact CE2-CE1 4.21Å; Y195-F256 AromaticContact CE2-CE2 3.59Å; Y195-F256 HydrophobicContact CE2-CE2 3.59Å; Y195-F256 AromaticContact CE2-CZ 3.27Å; Y195-F256 HydrophobicContact CE2-CZ 3.27Å; Y195-E263 PolarHBondContact OH-OE1 2.99Å
196	F	79.9	Confident	72.7	Confident	1 Å²	1	29.5 Å²	29.5	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-72.5	-35.2	179.4	-76.7	-65.8	0	0	0	113	L132 W158 L162 F165 L182 A192 D198 I199 V200 L262	L132-F196 HydrophobicContact CD1-CD1 4.06Å; L132-F196 HydrophobicContact CD1-CE1 3.43Å; L132-F196 VanDerWaalsContact CD1-CE1 3.43Å; L132-F196 HydrophobicContact CD1-CE2 4.49Å; L132-F196 HydrophobicContact CD1-CZ 3.66Å; W158-F196 HydrophobicContact CH2-CD1 4.18Å; W158-F196 HydrophobicContact CZ3-CB 4.46Å; W158-F196 AromaticContact CZ3-CD1 3.85Å; W158-F196 HydrophobicContact CZ3-CD1 3.85Å; L162-F196 HydrophobicContact CD2-CB 4.49Å; F165-F196 AromaticContact CD2-CD2 3.61Å; F165-F196 HydrophobicContact CD2-CD2 3.61Å; F165-F196 HydrophobicContact CD2-CE2 4.1Å; F165-F196 HydrophobicContact CD2-CG 4.28Å; F165-F196 HydrophobicContact CE1-CE2 4.47Å; F165-F196 AromaticContact CE2-CD2 3.21Å; F165-F196 HydrophobicContact CE2-CD2 3.21Å; F165-F196 AromaticContact CE2-CE2 3.25Å; F165-F196 HydrophobicContact CE2-CE2 3.25Å; F165-F196 AromaticContact CE2-CG 3.99Å; F165-F196 HydrophobicContact CE2-CG 3.99Å; F165-F196 HydrophobicContact CE2-CZ 4.07Å; F165-F196 AromaticContact CZ-CD2 3.91Å; F165-F196 HydrophobicContact CZ-CD2 3.91Å; F165-F196 AromaticContact CZ-CE2 3.5Å; F165-F196 HydrophobicContact CZ-CE2 3.5Å; F165-F196 VanDerWaalsContact CZ-CE2 3.5Å; F165-F196 HydrophobicContact CZ-CZ 4.3Å; L182-F196 HydrophobicContact CD1-CD2 4.45Å; L182-F196 HydrophobicContact CD1-CE2 3.59Å; L182-F196 HydrophobicContact CD1-CZ 4.42Å; L182-F196 HydrophobicContact CD2-CE2 3.78Å; L182-F196 HydrophobicContact CD2-CZ 3.82Å; L182-F196 HydrophobicContact CG-CE2 4.29Å; A192-F196 WeakPolarHBondContact O-CD2 3.4Å; A192-F196 PolarHBondContact O-N 3.24Å; F196-D198 PolarHBondContact O-N 3.46Å; F196-I199 HydrophobicContact CD1-CD1 4.1Å; F196-I199 HydrophobicContact CE1-CD1 4.36Å; F196-I199 PolarHBondContact O-N 3.31Å; F196-I199 VanDerWaalsContact O-N 3.13Å; F196-V200 VanDerWaalsContact O-CG2 3.28Å; F196-V200 WeakPolarHBondContact O-CG2 3.46Å; F196-V200 PolarHBondContact O-N 3.46Å; F196-L262 HydrophobicContact CE1-CD1 4.29Å; F196-L262 HydrophobicContact CE1-CD2 4.38Å; F196-L262 HydrophobicContact CZ-CD1 3.78Å; F196-L262 HydrophobicContact CZ-CD2 4.44Å
197	L	79	Confident	73.7	Confident	16 Å²	16	26.9 Å²	26.9	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-53.4	-39.7	170.3	-169.2	88.8	0	0	0	110.7	L162 C193 L201 I226 F229 V230	L162-L197 HydrophobicContact CD1-CD1 4.47Å; L162-L197 HydrophobicContact CD2-CB 4.35Å; L162-L197 HydrophobicContact CD2-CD1 4.25Å; C193-L197 WeakPolarHBondContact O-CB 3.4Å; C193-L197 PolarHBondContact O-N 3.03Å; L197-L201 WeakPolarHBondContact O-CB 3.46Å; L197-L201 PolarHBondContact O-N 3.03Å; L197-I226 HydrophobicContact CD1-CB 4.48Å; L197-I226 HydrophobicContact CD1-CG1 4.14Å; L197-I226 HydrophobicContact CD1-CG2 4.36Å; L197-F229 HydrophobicContact CD1-CB 3.82Å; L197-F229 HydrophobicContact CD1-CD2 4.1Å; L197-F229 HydrophobicContact CD1-CG 4.19Å; L197-F229 HydrophobicContact CD2-CB 4.42Å; L197-V230 HydrophobicContact CD2-CG2 3.92Å
198	D	78.3	Confident	74.8	Confident	35 Å²	35	23 Å²	23	19%	0.187	15%	0.147	C	C	.	.	H	α-helix	trans	-67.3	-41.6	178.3	-158.1	46.8	0	0	0	112.8	G194 Y195 F196 L201 E202 K244 R266	G194-D198 WeakPolarHBondContact O-CB 3.47Å; G194-D198 PolarHBondContact O-N 3.38Å; G194-D198 VanDerWaalsContact O-N 3.16Å; Y195-D198 VanDerWaalsContact O-CB 3.28Å; Y195-D198 WeakPolarHBondContact O-CB 3.37Å; Y195-D198 PolarHBondContact O-N 2.94Å; F196-D198 PolarHBondContact O-N 3.46Å; D198-L201 PolarHBondContact O-N 2.85Å; D198-E202 WeakPolarHBondContact O-CG 3.45Å; D198-E202 PolarHBondContact O-N 2.64Å; D198-K244 WeakPolarHBondContact OD1-CD 3.31Å; D198-K244 WeakPolarHBondContact OD1-CE 3.23Å; D198-K244 IonicContact OD1-NZ 2.92Å; D198-K244 PolarHBondContact OD1-NZ 2.95Å; D198-K244 IonicContact OD2-NZ 3.02Å; D198-K244 PolarHBondContact OD2-NZ 3.1Å; D198-R266 IonicContact OD2-NH2 3.07Å; D198-R266 PolarHBondContact OD2-NH2 3.4Å
199	I	79.9	Confident	75.7	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.7	-44.6	175.3	-67.2	173.4	0	0	0	111.4	W158 Y195 F196 L201 E202 N203 V265	W158-I199 HydrophobicContact CH2-CB 4.37Å; W158-I199 HydrophobicContact CH2-CG2 3.67Å; W158-I199 HydrophobicContact CZ2-CG2 3.98Å; Y195-I199 HydrophobicContact CD1-CD1 4.04Å; Y195-I199 HydrophobicContact CE1-CD1 3.42Å; Y195-I199 VanDerWaalsContact CE1-CD1 3.42Å; Y195-I199 HydrophobicContact CE2-CD1 4.24Å; Y195-I199 PolarHBondContact O-N 3.18Å; F196-I199 HydrophobicContact CD1-CD1 4.1Å; F196-I199 HydrophobicContact CE1-CD1 4.36Å; F196-I199 PolarHBondContact O-N 3.31Å; F196-I199 VanDerWaalsContact O-N 3.13Å; I199-L201 VanDerWaalsContact C-N 3.32Å; I199-E202 PolarHBondContact O-N 3.1Å; I199-N203 WeakPolarHBondContact CG2-ND2 3.37Å; I199-N203 WeakPolarHBondContact O-CB 3.4Å; I199-N203 PolarHBondContact O-N 3.05Å; I199-N203 PolarHBondContact O-ND2 3.25Å; I199-V265 HydrophobicContact CG2-CG1 4.23Å
200	V	82.5	Confident	76.3	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-61.5	-46.5	177.7	178.9	0	0	0	0	109.8	W158 L162 F196 E202 N203 L204 L222 I226	W158-V200 HydrophobicContact CB-CG1 4.42Å; W158-V200 HydrophobicContact CB-CG2 4.11Å; W158-V200 HydrophobicContact CD2-CG2 3.4Å; W158-V200 VanDerWaalsContact CD2-CG2 3.4Å; W158-V200 HydrophobicContact CE3-CG2 3.09Å; W158-V200 HydrophobicContact CG-CG2 3.88Å; W158-V200 HydrophobicContact CH2-CG2 4.2Å; W158-V200 HydrophobicContact CZ2-CG2 4.46Å; W158-V200 HydrophobicContact CZ3-CG2 3.54Å; L162-V200 HydrophobicContact CD1-CG1 4.46Å; L162-V200 HydrophobicContact CD1-CG2 4.23Å; L162-V200 HydrophobicContact CG-CG2 4.46Å; F196-V200 VanDerWaalsContact O-CG2 3.28Å; F196-V200 WeakPolarHBondContact O-CG2 3.46Å; F196-V200 PolarHBondContact O-N 3.46Å; V200-E202 VanDerWaalsContact C-N 3.35Å; V200-E202 PolarHBondContact O-N 3.2Å; V200-N203 PolarHBondContact O-N 3.32Å; V200-L204 HydrophobicContact CG1-CD1 4.22Å; V200-L204 HydrophobicContact CG1-CG 4.3Å; V200-L204 WeakPolarHBondContact O-CB 3.42Å; V200-L204 WeakPolarHBondContact O-CG 3.42Å; V200-L204 PolarHBondContact O-N 2.95Å; V200-L222 HydrophobicContact CG1-CD1 4.29Å; V200-L222 HydrophobicContact CG1-CD2 3.7Å; V200-L222 HydrophobicContact CG1-CG 4.05Å; V200-I226 HydrophobicContact CB-CD1 4.47Å; V200-I226 HydrophobicContact CG1-CD1 3.74Å
201	L	84.1	Confident	76.7	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-57.8	-47.3	177.9	176.7	62.7	0	0	0	111.5	L197 D198 I199 N203 L204 I205 W223 I226 W237 F240 K244	L197-L201 WeakPolarHBondContact O-CB 3.46Å; L197-L201 PolarHBondContact O-N 3.03Å; D198-L201 PolarHBondContact O-N 2.85Å; I199-L201 VanDerWaalsContact C-N 3.32Å; L201-N203 PolarHBondContact O-N 3.22Å; L201-L204 PolarHBondContact O-N 2.88Å; L201-I205 HydrophobicContact CD1-CD1 4Å; L201-I205 HydrophobicContact CD1-CG1 4.13Å; L201-I205 HydrophobicContact CG-CD1 3.79Å; L201-I205 HydrophobicContact CG-CG1 4.35Å; L201-I205 WeakPolarHBondContact O-CB 3.47Å; L201-I205 WeakPolarHBondContact O-CG1 3.48Å; L201-I205 PolarHBondContact O-N 3.26Å; L201-W223 HydrophobicContact CD1-CH2 3.94Å; L201-W223 HydrophobicContact CD1-CZ3 3.63Å; L201-I226 HydrophobicContact CD1-CG2 4.41Å; L201-W237 HydrophobicContact CD1-CH2 3.79Å; L201-F240 HydrophobicContact CD2-CE1 3.55Å; L201-F240 HydrophobicContact CD2-CZ 4.13Å; L201-K244 HydrophobicContact CD2-CG 3.98Å
202	E	83.4	Confident	76.1	Confident	11 Å²	11	14.5 Å²	14.5	5%	0.051	9%	0.086	C	C	.	.	H	α-helix	trans	-62.4	-42.8	178	-76.7	179.1	-172.3	0	0	112.8	D198 I199 V200 L204 I205 L206 K244 L248 R266 P267 F269	D198-E202 WeakPolarHBondContact O-CG 3.45Å; D198-E202 PolarHBondContact O-N 2.64Å; I199-E202 PolarHBondContact O-N 3.1Å; V200-E202 VanDerWaalsContact C-N 3.35Å; V200-E202 PolarHBondContact O-N 3.2Å; E202-L204 VanDerWaalsContact C-N 3.34Å; E202-I205 PolarHBondContact O-N 2.93Å; E202-L206 PolarHBondContact O-N 2.86Å; E202-L206 VanDerWaalsContact O-N 3.14Å; E202-K244 WeakPolarHBondContact OE1-CE 3.36Å; E202-K244 IonicContact OE1-NZ 2.74Å; E202-K244 PolarHBondContact OE1-NZ 2.99Å; E202-L248 HydrophobicContact CG-CD2 4.49Å; E202-R266 IonicContact OE1-NE 3.31Å; E202-R266 WeakPolarHBondContact OE2-CD 3.38Å; E202-R266 WeakPolarHBondContact OE2-CG 3.45Å; E202-R266 IonicContact OE2-NE 2.96Å; E202-R266 PolarHBondContact OE2-NE 3.12Å; E202-P267 HydrophobicContact CB-CG 3.78Å; E202-F269 HydrophobicContact CB-CE2 3.93Å; E202-F269 HydrophobicContact CB-CZ 4.12Å; E202-F269 HydrophobicContact CG-CE2 4.01Å; E202-F269 HydrophobicContact CG-CZ 4.38Å
203	N	82	Confident	75	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.011	12%	0.122	C	C	.	.	H	α-helix	trans	-61.4	-43.6	175.3	-85.7	-65.5	0	0	0	111.5	L138 I199 V200 L201 L206 Y207 V265	L138-N203 HydrophobicContact CB-CB 3.88Å; L138-N203 WeakPolarHBondContact CB-OD1 3.38Å; L138-N203 PolarHBondContact N-OD1 3.32Å; I199-N203 WeakPolarHBondContact CG2-ND2 3.37Å; I199-N203 WeakPolarHBondContact O-CB 3.4Å; I199-N203 PolarHBondContact O-N 3.05Å; I199-N203 PolarHBondContact O-ND2 3.25Å; V200-N203 PolarHBondContact O-N 3.32Å; L201-N203 PolarHBondContact O-N 3.22Å; N203-L206 PolarHBondContact O-N 3.31Å; N203-Y207 VanDerWaalsContact O-CB 3.27Å; N203-Y207 WeakPolarHBondContact O-CB 3.5Å; N203-Y207 PolarHBondContact O-N 2.96Å; N203-V265 PolarHBondContact ND2-O 3.41Å
204	L	82.3	Confident	74.1	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-68	-39.1	177.2	-77.4	-172.6	0	0	0	113.1	L155 V200 L201 E202 L206 Y207 S208 D219 L222 W223 I226	L155-L204 HydrophobicContact CD2-CD2 3.72Å; V200-L204 HydrophobicContact CG1-CD1 4.22Å; V200-L204 HydrophobicContact CG1-CG 4.3Å; V200-L204 WeakPolarHBondContact O-CB 3.42Å; V200-L204 WeakPolarHBondContact O-CG 3.42Å; V200-L204 PolarHBondContact O-N 2.95Å; L201-L204 PolarHBondContact O-N 2.88Å; E202-L204 VanDerWaalsContact C-N 3.34Å; L204-L206 VanDerWaalsContact C-N 3.3Å; L204-L206 PolarHBondContact O-N 3.38Å; L204-Y207 PolarHBondContact O-N 3.1Å; L204-S208 VanDerWaalsContact O-CB 3.31Å; L204-S208 WeakPolarHBondContact O-CB 3.46Å; L204-S208 PolarHBondContact O-N 3.49Å; L204-S208 PolarHBondContact O-OG 3Å; L204-D219 WeakPolarHBondContact CD2-OD1 3.03Å; L204-L222 HydrophobicContact CD1-CB 4.25Å; L204-L222 HydrophobicContact CD1-CD2 3.87Å; L204-L222 HydrophobicContact CD1-CG 3.88Å; L204-L222 HydrophobicContact CD2-CD2 4.06Å; L204-L222 HydrophobicContact CG-CD2 4.14Å; L204-W223 HydrophobicContact CB-CH2 4.12Å; L204-W223 HydrophobicContact CB-CZ2 3.59Å; L204-W223 HydrophobicContact CD1-CD2 4.05Å; L204-W223 HydrophobicContact CD1-CG 4.3Å; L204-W223 HydrophobicContact CD1-CZ2 4.34Å; L204-I226 HydrophobicContact CD1-CD1 3.38Å
205	I	82.7	Confident	73.5	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-55.5	-50.1	175.1	-77.2	168.9	0	0	0	109.4	L201 E202 G209 W223 F241 K244 M245 L248 F269 L291 V295	L201-I205 HydrophobicContact CD1-CD1 4Å; L201-I205 HydrophobicContact CD1-CG1 4.13Å; L201-I205 HydrophobicContact CG-CD1 3.79Å; L201-I205 HydrophobicContact CG-CG1 4.35Å; L201-I205 WeakPolarHBondContact O-CB 3.47Å; L201-I205 WeakPolarHBondContact O-CG1 3.48Å; L201-I205 PolarHBondContact O-N 3.26Å; E202-I205 PolarHBondContact O-N 2.93Å; I205-G209 WeakPolarHBondContact O-CA 3.39Å; I205-G209 PolarHBondContact O-N 3.37Å; I205-W223 HydrophobicContact CG1-CH2 4.14Å; I205-F241 HydrophobicContact CD1-CD2 4.46Å; I205-F241 HydrophobicContact CD1-CE2 3.85Å; I205-F241 HydrophobicContact CG1-CE2 3.9Å; I205-K244 HydrophobicContact CD1-CG 4.37Å; I205-M245 HydrophobicContact CD1-SD 4.09Å; I205-M245 HydrophobicContact CG2-SD 4.04Å; I205-L248 HydrophobicContact CD1-CD1 4.26Å; I205-F269 HydrophobicContact CG2-CE1 4.24Å; I205-F269 HydrophobicContact CG2-CZ 4.36Å; I205-L291 HydrophobicContact CG2-CD2 3.76Å; I205-L291 HydrophobicContact CG2-CG 4.19Å; I205-V295 HydrophobicContact CB-CG2 4.48Å; I205-V295 HydrophobicContact CG1-CG1 4.29Å; I205-V295 HydrophobicContact CG2-CG2 4.17Å; I205-V295 WeakPolarHBondContact O-CG2 3.46Å
206	L	76.4	Confident	73	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-71	-38.3	-178.7	-161.4	60.7	0	0	0	111.3	T139 E202 N203 L204 L210 P267 F269 Y272 L291	T139-L206 HydrophobicContact CG2-CB 3.7Å; T139-L206 HydrophobicContact CG2-CD2 3.28Å; T139-L206 HydrophobicContact CG2-CG 3.52Å; E202-L206 PolarHBondContact O-N 2.86Å; E202-L206 VanDerWaalsContact O-N 3.14Å; N203-L206 PolarHBondContact O-N 3.31Å; L204-L206 VanDerWaalsContact C-N 3.3Å; L204-L206 PolarHBondContact O-N 3.38Å; L206-L210 HydrophobicContact CD1-CD1 4.05Å; L206-L210 HydrophobicContact CD1-CG 4.38Å; L206-L210 HydrophobicContact CG-CD1 3.93Å; L206-L210 WeakPolarHBondContact O-CB 3.48Å; L206-L210 WeakPolarHBondContact O-CD1 3.22Å; L206-L210 WeakPolarHBondContact O-CG 3.41Å; L206-L210 PolarHBondContact O-N 3.05Å; L206-L210 VanDerWaalsContact O-N 3.11Å; L206-P267 HydrophobicContact CD2-CB 3.82Å; L206-F269 HydrophobicContact CB-CE1 4.09Å; L206-F269 HydrophobicContact CB-CZ 4.42Å; L206-F269 HydrophobicContact CD1-CD1 4.11Å; L206-F269 HydrophobicContact CD1-CE1 3.96Å; L206-F269 HydrophobicContact CD2-CE1 4.44Å; L206-F269 HydrophobicContact CG-CE1 4.39Å; L206-Y272 HydrophobicContact CD2-CD2 3.57Å; L206-Y272 HydrophobicContact CD2-CE2 3.69Å; L206-Y272 HydrophobicContact CD2-CG 4.15Å; L206-L291 HydrophobicContact CD1-CD1 4.19Å; L206-L291 HydrophobicContact CD1-CD2 4Å
207	Y	75.6	Confident	72.4	Confident	25 Å²	25	37.2 Å²	37.2	10%	0.098	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-58	177.9	178.1	-102.3	0	0	0	113.7	L138 L142 I151 N203 L204 G209 L210 T211 D219	L138-Y207 VanDerWaalsContact CD2-CB 3.47Å; L138-Y207 HydrophobicContact CD2-CD1 4.22Å; L138-Y207 HydrophobicContact CD2-CD2 3.42Å; L138-Y207 VanDerWaalsContact CD2-CD2 3.42Å; L138-Y207 HydrophobicContact CD2-CE2 4.22Å; L138-Y207 HydrophobicContact CD2-CG 3.43Å; L138-Y207 VanDerWaalsContact CD2-CG 3.43Å; L142-Y207 HydrophobicContact CD1-CD2 3.95Å; L142-Y207 HydrophobicContact CD2-CD2 3.8Å; L142-Y207 HydrophobicContact CD2-CE2 3.74Å; L142-Y207 HydrophobicContact CG-CD2 4Å; L142-Y207 HydrophobicContact CG-CE2 4.38Å; I151-Y207 HydrophobicContact CD1-CE2 4.3Å; I151-Y207 HydrophobicContact CG2-CE2 3.81Å; N203-Y207 VanDerWaalsContact O-CB 3.27Å; N203-Y207 WeakPolarHBondContact O-CB 3.5Å; N203-Y207 PolarHBondContact O-N 2.96Å; L204-Y207 PolarHBondContact O-N 3.1Å; Y207-G209 VanDerWaalsContact C-N 3.27Å; Y207-G209 PolarHBondContact O-N 3.27Å; Y207-L210 PolarHBondContact O-N 3.44Å; Y207-T211 HydrophobicContact CD2-CG2 4.39Å; Y207-T211 HydrophobicContact CE2-CG2 4.1Å; Y207-T211 WeakPolarHBondContact O-CB 3.38Å; Y207-T211 WeakPolarHBondContact O-CG2 3.16Å; Y207-T211 PolarHBondContact O-N 2.99Å; Y207-T211 PolarHBondContact O-OG1 3.02Å; Y207-D219 HydrophobicContact CE1-CB 4.4Å
208	S	75.5	Confident	71.9	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.028	17%	0.174	C	C	.	.	H	α-helix	trans	-66	-31.6	179.5	61.4	0	0	0	0	112.1	L204 W223	L204-S208 VanDerWaalsContact O-CB 3.31Å; L204-S208 WeakPolarHBondContact O-CB 3.46Å; L204-S208 PolarHBondContact O-N 3.49Å; L204-S208 PolarHBondContact O-OG 3Å; S208-W223 WeakPolarHBondContact OG-CZ2 3.14Å
209	G	71.1	Confident	71.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-72.1	-29.2	177.6	0	0	0	0	0	113.9	I205 Y207 N294	I205-G209 WeakPolarHBondContact O-CA 3.39Å; I205-G209 PolarHBondContact O-N 3.37Å; Y207-G209 VanDerWaalsContact C-N 3.27Å; Y207-G209 PolarHBondContact O-N 3.27Å; G209-N294 PolarHBondContact O-ND2 2.93Å
210	L	67	Low	71.6	Confident	30 Å²	30	35.8 Å²	35.8	16%	0.157	17%	0.169	C	C	.	.	H	α-helix	trans	-90.9	-27.9	178.1	-68.7	173.2	0	0	0	113.2	L142 L206 Y207 N212 Y272 Q283 L286	L142-L210 HydrophobicContact CD1-CB 4.16Å; L142-L210 HydrophobicContact CD1-CD1 3.94Å; L206-L210 HydrophobicContact CD1-CD1 4.05Å; L206-L210 HydrophobicContact CD1-CG 4.38Å; L206-L210 HydrophobicContact CG-CD1 3.93Å; L206-L210 WeakPolarHBondContact O-CB 3.48Å; L206-L210 WeakPolarHBondContact O-CD1 3.22Å; L206-L210 WeakPolarHBondContact O-CG 3.41Å; L206-L210 PolarHBondContact O-N 3.05Å; L206-L210 VanDerWaalsContact O-N 3.11Å; Y207-L210 PolarHBondContact O-N 3.44Å; L210-N212 PolarHBondContact O-N 3.04Å; L210-Y272 HydrophobicContact CD1-CE1 4.36Å; L210-Q283 PolarHBondContact O-NE2 3.15Å; L210-L286 HydrophobicContact CD2-CD1 3.92Å
211	T	63.5	Low	71.4	Confident	22 Å²	22	35.8 Å²	35.8	14%	0.135	17%	0.169	C	C	.	.			trans	-91.7	97.5	-178.5	53.9	0	0	0	0	110.9	L142 Y207 F213	L142-T211 HydrophobicContact CD2-CG2 3.48Å; L142-T211 VanDerWaalsContact CD2-CG2 3.48Å; Y207-T211 HydrophobicContact CD2-CG2 4.39Å; Y207-T211 HydrophobicContact CE2-CG2 4.1Å; Y207-T211 WeakPolarHBondContact O-CB 3.38Å; Y207-T211 WeakPolarHBondContact O-CG2 3.16Å; Y207-T211 PolarHBondContact O-N 2.99Å; Y207-T211 PolarHBondContact O-OG1 3.02Å; T211-F213 PolarHBondContact O-N 3.34Å; T211-F213 VanDerWaalsContact O-N 3.13Å
212	N	57.2	Low	71.2	Confident	96 Å²	96	35.9 Å²	35.9	51%	0.513	17%	0.17	S	C	.	.			trans	-70.7	4.4	167.4	-92.8	-31.9	0	0	0	113.3	L210 R354	L210-N212 PolarHBondContact O-N 3.04Å; N212-R354 PolarHBondContact OD1-NH1 3.49Å; N212-R354 VanDerWaalsContact OD1-NH1 3.08Å
213	F	49.2	Very low	71.3	Confident	173 Å²	173	35.3 Å²	35.3	76%	0.759	17%	0.167	S	C	*	.	S	Bend	trans	-84.5	164.2	-171.3	-67.4	-73.9	0	0	0	113	T211 R215	T211-F213 PolarHBondContact O-N 3.34Å; T211-F213 VanDerWaalsContact O-N 3.13Å; F213-R215 PolarHBondContact O-N 3.37Å
214	Q	56.1	Low	71.4	Confident	194 Å²	194	35.3 Å²	35.3	91%	0.907	17%	0.167	S	C	*	.			trans	-40.7	129.1	178.8	-87.6	174	-27	0	0	112.4	C216	Q214-C216 PolarHBondContact O-N 3.45Å; Q214-C216 VanDerWaalsContact O-N 3.09Å
215	R	60.8	Low	71.3	Confident	135 Å²	135	35.3 Å²	35.3	51%	0.509	17%	0.167	S	C	.	.			trans	-54.5	113.3	177.7	-64.8	-178.7	-176.4	153.6	8	109.3	F213 Y298	F213-R215 PolarHBondContact O-N 3.37Å; R215-Y298 HydrophobicContact CG-CE2 3.76Å
216	C	67.5	Low	71.4	Confident	17 Å²	17	35.3 Å²	35.3	12%	0.115	17%	0.167	C	C	.	.			trans	-72.2	131.5	163.8	-179.3	0	0	0	0	108.1	H152 Q214 C218 D219 T220	H152-C216 VanDerWaalsContact CD2-SG 3.52Å; H152-C216 PolarHBondContact NE2-SG 3.49Å; Q214-C216 PolarHBondContact O-N 3.45Å; Q214-C216 VanDerWaalsContact O-N 3.09Å; C216-C218 PolarHBondContact O-N 2.92Å; C216-C218 PolarHBondContact SG-N 2.73Å; C216-C218 VanDerWaalsContact SG-N 3.41Å; C216-D219 HydrophobicContact CB-CB 4.47Å; C216-D219 PolarHBondContact O-N 3Å; C216-T220 PolarHBondContact O-N 2.95Å; C216-T220 VanDerWaalsContact O-N 3.09Å; C216-T220 PolarHBondContact O-OG1 3.48Å; C216-T220 VanDerWaalsContact O-OG1 3.11Å
217	S	66.4	Low	71.8	Confident	17 Å²	17	35.2 Å²	35.2	12%	0.119	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-30.1	175.1	49	0	0	0	0	112.6	C48 C49 D50 T220 I221	C48-S217 VanDerWaalsContact O-CB 3.24Å; C48-S217 WeakPolarHBondContact O-CB 3.31Å; C48-S217 PolarHBondContact O-OG 3.02Å; C49-S217 WeakPolarHBondContact CA-OG 3.14Å; C49-S217 PolarHBondContact N-OG 2.59Å; D50-S217 PolarHBondContact N-OG 2.93Å; S217-T220 WeakPolarHBondContact O-CB 2.9Å; S217-T220 PolarHBondContact O-N 2.81Å; S217-I221 WeakPolarHBondContact O-CB 3.35Å; S217-I221 WeakPolarHBondContact O-CD1 3.37Å; S217-I221 WeakPolarHBondContact O-CG1 3.27Å; S217-I221 PolarHBondContact O-N 3.34Å
218	C	69.6	Low	72.1	Confident	6 Å²	6	34.6 Å²	34.6	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-63.6	-42.4	176.5	-53.3	0	0	0	0	112	C49 R97 L155 C216 I221 L222	C49-C218 VanDerWaalsContact SG-SG 3.69Å; R97-C218 PolarHBondContact NH2-SG 3.45Å; R97-C218 VanDerWaalsContact NH2-SG 3.39Å; L155-C218 HydrophobicContact CB-CB 4.47Å; L155-C218 HydrophobicContact CD1-CB 4.04Å; C216-C218 PolarHBondContact O-N 2.92Å; C216-C218 PolarHBondContact SG-N 2.73Å; C216-C218 VanDerWaalsContact SG-N 3.41Å; C218-I221 PolarHBondContact O-N 2.74Å; C218-L222 PolarHBondContact O-N 2.94Å; C218-L222 VanDerWaalsContact O-N 3.1Å
219	D	74.7	Confident	72.3	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-44.7	174.9	176.5	31.9	0	0	0	110.4	L155 L204 Y207 C216 I221 L222 W223 Y298	L155-D219 HydrophobicContact CD1-CB 4.05Å; L204-D219 WeakPolarHBondContact CD2-OD1 3.03Å; Y207-D219 HydrophobicContact CE1-CB 4.4Å; C216-D219 HydrophobicContact CB-CB 4.47Å; C216-D219 PolarHBondContact O-N 3Å; D219-I221 VanDerWaalsContact C-N 3.29Å; D219-I221 PolarHBondContact O-N 2.92Å; D219-L222 PolarHBondContact O-N 3.15Å; D219-L222 VanDerWaalsContact O-N 3.1Å; D219-W223 PolarHBondContact O-N 2.81Å; D219-W223 PolarHBondContact OD1-NE1 2.79Å; D219-Y298 WeakPolarHBondContact OD2-CE1 3.48Å; D219-Y298 PolarHBondContact OD2-OH 3.45Å
220	T	77.1	Confident	72.7	Confident	13 Å²	13	35.2 Å²	35.2	8%	0.08	17%	0.167	C	C	.	.	H	α-helix	trans	-56.7	-43.9	176.2	-55.5	0	0	0	0	111.9	P54 C216 S217 W223 V224 I302	P54-T220 HydrophobicContact CB-CG2 4.12Å; P54-T220 HydrophobicContact CG-CG2 3.57Å; C216-T220 PolarHBondContact O-N 2.95Å; C216-T220 VanDerWaalsContact O-N 3.09Å; C216-T220 PolarHBondContact O-OG1 3.48Å; C216-T220 VanDerWaalsContact O-OG1 3.11Å; S217-T220 WeakPolarHBondContact O-CB 2.9Å; S217-T220 PolarHBondContact O-N 2.81Å; T220-W223 PolarHBondContact O-N 3.12Å; T220-V224 WeakPolarHBondContact O-CG2 3.39Å; T220-V224 PolarHBondContact O-N 2.77Å; T220-I302 HydrophobicContact CG2-CD1 3.98Å; T220-I302 HydrophobicContact CG2-CG1 3.94Å; T220-I302 HydrophobicContact CG2-CG2 3.95Å
221	I	76.5	Confident	73.2	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-61.5	-45.2	176.5	-73.6	162.6	0	0	0	110.9	C48 P54 F57 L159 S217 C218 D219 W223 V224 V225	C48-I221 HydrophobicContact CB-CD1 3.73Å; P54-I221 HydrophobicContact CB-CG1 4.15Å; P54-I221 HydrophobicContact CG-CG1 4.42Å; F57-I221 HydrophobicContact CB-CD1 4.5Å; F57-I221 HydrophobicContact CB-CG1 4.39Å; F57-I221 HydrophobicContact CD1-CG2 3.32Å; F57-I221 HydrophobicContact CD2-CD1 4.44Å; F57-I221 HydrophobicContact CD2-CG2 4.43Å; F57-I221 HydrophobicContact CE1-CG2 3.41Å; F57-I221 VanDerWaalsContact CE1-CG2 3.41Å; F57-I221 HydrophobicContact CE2-CG2 4.49Å; F57-I221 HydrophobicContact CG-CD1 4.33Å; F57-I221 HydrophobicContact CG-CG1 4.36Å; F57-I221 HydrophobicContact CG-CG2 3.88Å; F57-I221 HydrophobicContact CZ-CG2 4.02Å; L159-I221 HydrophobicContact CD1-CG2 3.47Å; L159-I221 VanDerWaalsContact CD1-CG2 3.47Å; S217-I221 WeakPolarHBondContact O-CB 3.35Å; S217-I221 WeakPolarHBondContact O-CD1 3.37Å; S217-I221 WeakPolarHBondContact O-CG1 3.27Å; S217-I221 PolarHBondContact O-N 3.34Å; C218-I221 PolarHBondContact O-N 2.74Å; D219-I221 VanDerWaalsContact C-N 3.29Å; D219-I221 PolarHBondContact O-N 2.92Å; I221-W223 VanDerWaalsContact C-N 3.34Å; I221-W223 PolarHBondContact O-N 3.49Å; I221-V224 PolarHBondContact O-N 2.92Å; I221-V225 WeakPolarHBondContact O-CG2 3.48Å; I221-V225 PolarHBondContact O-N 3.03Å
222	L	80.7	Confident	73.8	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-39.4	179.7	-167.1	60.4	0	0	0	111.5	L155 W158 L159 L162 V200 L204 C218 D219 V225 I226	L155-L222 HydrophobicContact CD2-CD2 3.66Å; W158-L222 HydrophobicContact CB-CD1 4.43Å; W158-L222 HydrophobicContact CB-CD2 4.13Å; L159-L222 HydrophobicContact CB-CD1 3.94Å; L159-L222 HydrophobicContact CD1-CD1 4.1Å; L159-L222 HydrophobicContact CG-CD1 4.32Å; L162-L222 HydrophobicContact CD1-CD1 4.16Å; V200-L222 HydrophobicContact CG1-CD1 4.29Å; V200-L222 HydrophobicContact CG1-CD2 3.7Å; V200-L222 HydrophobicContact CG1-CG 4.05Å; L204-L222 HydrophobicContact CD1-CB 4.25Å; L204-L222 HydrophobicContact CD1-CD2 3.87Å; L204-L222 HydrophobicContact CD1-CG 3.88Å; L204-L222 HydrophobicContact CD2-CD2 4.06Å; L204-L222 HydrophobicContact CG-CD2 4.14Å; C218-L222 PolarHBondContact O-N 2.94Å; C218-L222 VanDerWaalsContact O-N 3.1Å; D219-L222 PolarHBondContact O-N 3.15Å; D219-L222 VanDerWaalsContact O-N 3.1Å; L222-V225 PolarHBondContact O-N 2.81Å; L222-I226 HydrophobicContact CG-CD1 4.36Å; L222-I226 VanDerWaalsContact O-CG1 3.31Å; L222-I226 WeakPolarHBondContact O-CG1 3.27Å; L222-I226 PolarHBondContact O-N 2.64Å
223	W	86.2	Confident	74.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.1	-45.5	170.5	-80.8	107.8	0	0	0	112.6	L201 L204 I205 S208 D219 T220 I221 V225 I226 M227 W237 V295 Y298 T299 I302	L201-W223 HydrophobicContact CD1-CH2 3.94Å; L201-W223 HydrophobicContact CD1-CZ3 3.63Å; L204-W223 HydrophobicContact CB-CH2 4.12Å; L204-W223 HydrophobicContact CB-CZ2 3.59Å; L204-W223 HydrophobicContact CD1-CD2 4.05Å; L204-W223 HydrophobicContact CD1-CG 4.3Å; L204-W223 HydrophobicContact CD1-CZ2 4.34Å; I205-W223 HydrophobicContact CG1-CH2 4.14Å; S208-W223 WeakPolarHBondContact OG-CZ2 3.14Å; D219-W223 PolarHBondContact O-N 2.81Å; D219-W223 PolarHBondContact OD1-NE1 2.79Å; T220-W223 PolarHBondContact O-N 3.12Å; I221-W223 VanDerWaalsContact C-N 3.34Å; I221-W223 PolarHBondContact O-N 3.49Å; W223-V225 VanDerWaalsContact C-N 3.31Å; W223-V225 PolarHBondContact O-N 3.25Å; W223-I226 PolarHBondContact O-N 2.81Å; W223-M227 HydrophobicContact CB-CE 4.42Å; W223-M227 HydrophobicContact CE3-CE 4.34Å; W223-M227 WeakPolarHBondContact O-CB 3.23Å; W223-M227 VanDerWaalsContact O-CG 3.23Å; W223-M227 WeakPolarHBondContact O-CG 3.49Å; W223-M227 PolarHBondContact O-N 2.79Å; W223-W237 AromaticContact CE3-CH2 3.99Å; W223-W237 HydrophobicContact CE3-CH2 3.99Å; W223-W237 AromaticContact CE3-CZ2 3.91Å; W223-W237 HydrophobicContact CE3-CZ2 3.91Å; W223-W237 AromaticContact CZ3-CH2 3.61Å; W223-W237 HydrophobicContact CZ3-CH2 3.61Å; W223-W237 AromaticContact CZ3-CZ2 3.58Å; W223-W237 HydrophobicContact CZ3-CZ2 3.58Å; W223-V295 HydrophobicContact CH2-CG1 3.7Å; W223-V295 HydrophobicContact CZ2-CG1 4.01Å; W223-Y298 AromaticContact CD1-CE1 3.71Å; W223-Y298 AromaticContact NE1-CD1 3.86Å; W223-Y298 AromaticContact NE1-CE1 3.55Å; W223-T299 HydrophobicContact CD2-CG2 3.61Å; W223-T299 HydrophobicContact CE3-CG2 3.51Å; W223-T299 HydrophobicContact CG-CG2 4.4Å; W223-T299 HydrophobicContact CH2-CG2 3.62Å; W223-T299 HydrophobicContact CZ2-CG2 3.72Å; W223-T299 HydrophobicContact CZ3-CG2 3.51Å; W223-I302 HydrophobicContact CB-CD1 4.03Å; W223-I302 HydrophobicContact CB-CG2 4.03Å; W223-I302 HydrophobicContact CG-CD1 4.15Å
224	V	83	Confident	75.4	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-42.8	176.9	171.7	0	0	0	0	111	P54 L58 T220 I221 M227 H228 I302 Y306	P54-V224 HydrophobicContact CB-CG2 3.9Å; L58-V224 HydrophobicContact CB-CG1 4.06Å; L58-V224 HydrophobicContact CD1-CG1 4.25Å; L58-V224 HydrophobicContact CD2-CG1 3.99Å; L58-V224 HydrophobicContact CG-CG1 4.32Å; T220-V224 WeakPolarHBondContact O-CG2 3.39Å; T220-V224 PolarHBondContact O-N 2.77Å; I221-V224 PolarHBondContact O-N 2.92Å; V224-M227 PolarHBondContact O-N 3.02Å; V224-H228 VanDerWaalsContact O-CB 3.31Å; V224-H228 WeakPolarHBondContact O-CB 3.22Å; V224-H228 PolarHBondContact O-N 3.3Å; V224-I302 HydrophobicContact CG2-CG2 3.4Å; V224-I302 VanDerWaalsContact CG2-CG2 3.4Å; V224-Y306 HydrophobicContact CG1-CD2 4.1Å
225	V	80.9	Confident	76	Confident	1 Å²	1	37 Å²	37	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-44.1	177	171	0	0	0	0	111.3	F57 F61 L159 I221 L222 W223 H228 F229	F57-V225 HydrophobicContact CE1-CG2 4.33Å; F61-V225 HydrophobicContact CD2-CG2 4.49Å; F61-V225 HydrophobicContact CE1-CG1 4.29Å; F61-V225 HydrophobicContact CE2-CG2 4.48Å; F61-V225 HydrophobicContact CZ-CG1 4.07Å; L159-V225 HydrophobicContact CD1-CG2 3.88Å; L159-V225 HydrophobicContact CG-CG2 4.45Å; I221-V225 WeakPolarHBondContact O-CG2 3.48Å; I221-V225 PolarHBondContact O-N 3.03Å; L222-V225 PolarHBondContact O-N 2.81Å; W223-V225 VanDerWaalsContact C-N 3.31Å; W223-V225 PolarHBondContact O-N 3.25Å; V225-H228 WeakPolarHBondContact O-CB 3.15Å; V225-H228 PolarHBondContact O-N 3.18Å; V225-F229 HydrophobicContact CG1-CD2 3.69Å; V225-F229 HydrophobicContact CG1-CE2 3.51Å; V225-F229 WeakPolarHBondContact O-CD2 3.43Å; V225-F229 PolarHBondContact O-N 3.26Å
226	I	84	Confident	76.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-46.7	177.2	-68.4	166.7	0	0	0	111	L197 V200 L201 L204 L222 W223 H228 F229 V230 W237	L197-I226 HydrophobicContact CD1-CB 4.48Å; L197-I226 HydrophobicContact CD1-CG1 4.14Å; L197-I226 HydrophobicContact CD1-CG2 4.36Å; V200-I226 HydrophobicContact CB-CD1 4.47Å; V200-I226 HydrophobicContact CG1-CD1 3.74Å; L201-I226 HydrophobicContact CD1-CG2 4.41Å; L204-I226 HydrophobicContact CD1-CD1 3.38Å; L222-I226 HydrophobicContact CG-CD1 4.36Å; L222-I226 VanDerWaalsContact O-CG1 3.31Å; L222-I226 WeakPolarHBondContact O-CG1 3.27Å; L222-I226 PolarHBondContact O-N 2.64Å; W223-I226 PolarHBondContact O-N 2.81Å; I226-H228 PolarHBondContact O-N 3.16Å; I226-F229 PolarHBondContact O-N 3.38Å; I226-V230 HydrophobicContact CG2-CG2 4.26Å; I226-V230 WeakPolarHBondContact O-CG2 3.18Å; I226-V230 PolarHBondContact O-N 3.07Å; I226-W237 HydrophobicContact CG2-CH2 3.99Å; I226-W237 HydrophobicContact CG2-CZ3 3.7Å
227	M	85.2	Confident	77.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.7	-42.8	176.4	-73.2	170.5	-175.9	0	0	110.7	W223 V224 V230 E231 W237 T299 I302 Y303	W223-M227 HydrophobicContact CB-CE 4.42Å; W223-M227 HydrophobicContact CE3-CE 4.34Å; W223-M227 WeakPolarHBondContact O-CB 3.23Å; W223-M227 VanDerWaalsContact O-CG 3.23Å; W223-M227 WeakPolarHBondContact O-CG 3.49Å; W223-M227 PolarHBondContact O-N 2.79Å; V224-M227 PolarHBondContact O-N 3.02Å; M227-V230 PolarHBondContact O-N 3.39Å; M227-E231 VanDerWaalsContact O-CB 3.24Å; M227-E231 WeakPolarHBondContact O-CB 3.37Å; M227-E231 WeakPolarHBondContact O-CG 3.37Å; M227-E231 PolarHBondContact O-N 3.29Å; M227-W237 HydrophobicContact CE-CZ2 4.08Å; M227-W237 HydrophobicContact CG-CD2 3.76Å; M227-W237 HydrophobicContact CG-CE3 4.01Å; M227-W237 HydrophobicContact CG-CG 4.14Å; M227-W237 HydrophobicContact CG-CZ2 4.29Å; M227-W237 HydrophobicContact CG-CZ3 4.39Å; M227-T299 HydrophobicContact CE-CG2 4.26Å; M227-T299 WeakPolarHBondContact CE-O 3.29Å; M227-I302 HydrophobicContact CE-CB 4.19Å; M227-I302 HydrophobicContact CE-CG2 4.29Å; M227-I302 HydrophobicContact SD-CB 4.48Å; M227-I302 HydrophobicContact SD-CG2 4.12Å; M227-Y303 HydrophobicContact CG-CD2 4.25Å; M227-Y303 VanDerWaalsContact SD-CA 3.52Å; M227-Y303 HydrophobicContact SD-CD2 3.92Å; M227-Y303 HydrophobicContact SD-CG 4.34Å
228	H	82.2	Confident	77.7	Confident	12 Å²	12	33 Å²	33	6%	0.056	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-47.8	175.8	176.7	78.4	0	0	0	113.1	L58 E62 V224 V225 I226 E231 K232 Y306	L58-H228 HydrophobicContact CD1-CB 3.93Å; E62-H228 IonicContact OE1-CE1 3.4Å; E62-H228 PolarHBondContact OE1-CE1 3.4Å; E62-H228 IonicContact OE1-NE2 3.48Å; E62-H228 PolarHBondContact OE1-NE2 3.48Å; V224-H228 VanDerWaalsContact O-CB 3.31Å; V224-H228 WeakPolarHBondContact O-CB 3.22Å; V224-H228 PolarHBondContact O-N 3.3Å; V225-H228 WeakPolarHBondContact O-CB 3.15Å; V225-H228 PolarHBondContact O-N 3.18Å; I226-H228 PolarHBondContact O-N 3.16Å; H228-E231 PolarHBondContact O-N 3.03Å; H228-K232 WeakPolarHBondContact CE1-CE 3.5Å; H228-K232 PolarHBondContact CE1-NZ 3.31Å; H228-K232 WeakPolarHBondContact NE2-CE 3.46Å; H228-K232 PolarHBondContact NE2-NZ 3.28Å; H228-K232 PolarHBondContact O-N 3.18Å; H228-Y306 WeakPolarHBondContact CA-OH 3.3Å; H228-Y306 HydrophobicContact CB-CE2 3.64Å; H228-Y306 AromaticContact ND1-CE2 3.74Å; H228-Y306 AromaticContact ND1-CZ 3.97Å; H228-Y306 PolarHBondContact ND1-OH 2.89Å
229	F	80	Confident	78	Confident	16 Å²	16	39.9 Å²	39.9	7%	0.07	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-42.9	177.1	-83	-64.3	0	0	0	112.9	F61 L162 N166 L197 V225 I226 K232 T233	F61-F229 HydrophobicContact CE1-CE2 4.24Å; F61-F229 HydrophobicContact CE1-CZ 4.26Å; F61-F229 HydrophobicContact CZ-CE2 4.41Å; L162-F229 HydrophobicContact CB-CE2 4.49Å; N166-F229 HydrophobicContact CB-CE1 3.77Å; N166-F229 HydrophobicContact CB-CZ 3.66Å; N166-F229 VanDerWaalsContact CG-CE1 3.42Å; L197-F229 HydrophobicContact CD1-CB 3.82Å; L197-F229 HydrophobicContact CD1-CD2 4.1Å; L197-F229 HydrophobicContact CD1-CG 4.19Å; L197-F229 HydrophobicContact CD2-CB 4.42Å; V225-F229 HydrophobicContact CG1-CD2 3.69Å; V225-F229 HydrophobicContact CG1-CE2 3.51Å; V225-F229 WeakPolarHBondContact O-CD2 3.43Å; V225-F229 PolarHBondContact O-N 3.26Å; I226-F229 PolarHBondContact O-N 3.38Å; F229-K232 PolarHBondContact O-N 3Å; F229-T233 WeakPolarHBondContact O-CG2 3.43Å; F229-T233 PolarHBondContact O-N 3.04Å; F229-T233 PolarHBondContact O-OG1 3.36Å
230	V	79	Confident	78.2	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-41.3	178.3	173	0	0	0	0	111	L197 I226 M227 K232 T233 Q234 W237 F240	L197-V230 HydrophobicContact CD2-CG2 3.92Å; I226-V230 HydrophobicContact CG2-CG2 4.26Å; I226-V230 WeakPolarHBondContact O-CG2 3.18Å; I226-V230 PolarHBondContact O-N 3.07Å; M227-V230 PolarHBondContact O-N 3.39Å; V230-K232 PolarHBondContact O-N 3.34Å; V230-T233 PolarHBondContact O-N 3Å; V230-T233 VanDerWaalsContact O-N 3.15Å; V230-T233 PolarHBondContact O-OG1 3.15Å; V230-T233 VanDerWaalsContact O-OG1 3.05Å; V230-Q234 PolarHBondContact O-N 3.01Å; V230-W237 HydrophobicContact CB-CE3 3.92Å; V230-W237 HydrophobicContact CB-CZ3 4.29Å; V230-W237 HydrophobicContact CG1-CE3 3.92Å; V230-W237 HydrophobicContact CG2-CE3 4.07Å; V230-W237 HydrophobicContact CG2-CZ3 3.93Å; V230-F240 HydrophobicContact CB-CD1 4.32Å; V230-F240 HydrophobicContact CG1-CB 3.66Å; V230-F240 HydrophobicContact CG1-CD1 3.59Å; V230-F240 HydrophobicContact CG1-CD2 4.44Å; V230-F240 HydrophobicContact CG1-CE1 4.32Å; V230-F240 HydrophobicContact CG1-CG 3.64Å; V230-F240 HydrophobicContact CG2-CD1 3.71Å; V230-F240 HydrophobicContact CG2-CE1 3.62Å; V230-F240 HydrophobicContact CG2-CG 4.41Å; V230-F240 HydrophobicContact CG2-CZ 4.27Å
231	E	77.7	Confident	78.5	Confident	30 Å²	30	41.1 Å²	41.1	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-35.4	178.5	-74.3	-70.3	177	0	0	112	M227 H228 T233 K235 N236 W237 Y303 Y306	M227-E231 VanDerWaalsContact O-CB 3.24Å; M227-E231 WeakPolarHBondContact O-CB 3.37Å; M227-E231 WeakPolarHBondContact O-CG 3.37Å; M227-E231 PolarHBondContact O-N 3.29Å; H228-E231 PolarHBondContact O-N 3.03Å; E231-T233 PolarHBondContact O-N 3.05Å; E231-K235 WeakPolarHBondContact O-CA 3.48Å; E231-K235 PolarHBondContact O-N 2.78Å; E231-K235 VanDerWaalsContact O-N 3.16Å; E231-K235 VanDerWaalsContact OE2-CA 3.23Å; E231-K235 WeakPolarHBondContact OE2-CA 3.19Å; E231-N236 PolarHBondContact OE2-N 2.85Å; E231-N236 VanDerWaalsContact OE2-N 3.15Å; E231-W237 HydrophobicContact CG-CB 4.34Å; E231-W237 WeakPolarHBondContact OE1-CB 3.17Å; E231-W237 PolarHBondContact OE1-N 2.98Å; E231-Y303 HydrophobicContact CG-CE2 4.17Å; E231-Y303 VanDerWaalsContact OE1-CE2 3.23Å; E231-Y303 WeakPolarHBondContact OE1-CE2 3.48Å; E231-Y303 PolarHBondContact OE1-OH 3.32Å; E231-Y306 HydrophobicContact CB-CE1 4.15Å; E231-Y306 HydrophobicContact CG-CE1 3.92Å
232	K	75.6	Confident	78.8	Confident	125 Å²	125	42.4 Å²	42.4	54%	0.543	20%	0.2	S	C	.	.	H	α-helix	trans	-60.9	-32.4	171	-85	-176.8	169.7	165.1	0	112.9	E62 H228 F229 V230	E62-K232 IonicContact OE1-NZ 3.82Å; E62-K232 PolarHBondContact OE1-NZ 2.75Å; H228-K232 WeakPolarHBondContact CE1-CE 3.5Å; H228-K232 PolarHBondContact CE1-NZ 3.31Å; H228-K232 WeakPolarHBondContact NE2-CE 3.46Å; H228-K232 PolarHBondContact NE2-NZ 3.28Å; H228-K232 PolarHBondContact O-N 3.18Å; F229-K232 PolarHBondContact O-N 3Å; V230-K232 PolarHBondContact O-N 3.34Å
233	T	70.2	Confident	78.7	Confident	107 Å²	107	43.9 Å²	43.9	66%	0.656	22%	0.215	S	C	*	.	H	α-helix	trans	-98.1	-44.9	-172.8	52	0	0	0	0	114.2	F229 V230 E231	F229-T233 WeakPolarHBondContact O-CG2 3.43Å; F229-T233 PolarHBondContact O-N 3.04Å; F229-T233 PolarHBondContact O-OG1 3.36Å; V230-T233 PolarHBondContact O-N 3Å; V230-T233 VanDerWaalsContact O-N 3.15Å; V230-T233 PolarHBondContact O-OG1 3.15Å; V230-T233 VanDerWaalsContact O-OG1 3.05Å; E231-T233 PolarHBondContact O-N 3.05Å
234	Q	69.1	Low	78.5	Confident	111 Å²	111	44.8 Å²	44.8	52%	0.519	22%	0.219	S	C	.	.	H	α-helix	trans	-114.3	-7.8	-173.9	-61.3	-157.5	2.6	0	0	114.6	V230 N236	V230-Q234 PolarHBondContact O-N 3.01Å; Q234-N236 PolarHBondContact O-N 2.94Å; Q234-N236 VanDerWaalsContact O-N 3.09Å
235	K	69.6	Low	78.5	Confident	179 Å²	179	44.8 Å²	44.8	78%	0.778	22%	0.219	S	C	*	.	S	Bend	trans	55.4	18.2	-179.5	-59	-176.9	176.8	-177.9	0	115.8	E231	E231-K235 WeakPolarHBondContact O-CA 3.48Å; E231-K235 PolarHBondContact O-N 2.78Å; E231-K235 VanDerWaalsContact O-N 3.16Å; E231-K235 VanDerWaalsContact OE2-CA 3.23Å; E231-K235 WeakPolarHBondContact OE2-CA 3.19Å
236	N	73.6	Confident	78.3	Confident	71 Å²	71	47.5 Å²	47.5	38%	0.38	23%	0.233	S	C	.	.			trans	-159.9	92.1	176.2	-166.2	-38.6	0	0	0	111.7	E231 Q234 F238 K239 F240	E231-N236 PolarHBondContact OE2-N 2.85Å; E231-N236 VanDerWaalsContact OE2-N 3.15Å; Q234-N236 PolarHBondContact O-N 2.94Å; Q234-N236 VanDerWaalsContact O-N 3.09Å; N236-F238 VanDerWaalsContact C-N 3.32Å; N236-F238 PolarHBondContact O-N 3.26Å; N236-F238 PolarHBondContact OD1-N 3.33Å; N236-K239 HydrophobicContact CB-CB 4.02Å; N236-K239 PolarHBondContact O-N 3.4Å; N236-K239 PolarHBondContact OD1-N 3.33Å; N236-F240 PolarHBondContact O-N 3.09Å
237	W	79.6	Confident	77.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-50.6	-50.3	177.4	166.3	-113.2	0	0	0	112.6	L201 W223 I226 M227 V230 E231 K239 F240 F241 Y303	L201-W237 HydrophobicContact CD1-CH2 3.79Å; W223-W237 AromaticContact CE3-CH2 3.99Å; W223-W237 HydrophobicContact CE3-CH2 3.99Å; W223-W237 AromaticContact CE3-CZ2 3.91Å; W223-W237 HydrophobicContact CE3-CZ2 3.91Å; W223-W237 AromaticContact CZ3-CH2 3.61Å; W223-W237 HydrophobicContact CZ3-CH2 3.61Å; W223-W237 AromaticContact CZ3-CZ2 3.58Å; W223-W237 HydrophobicContact CZ3-CZ2 3.58Å; I226-W237 HydrophobicContact CG2-CH2 3.99Å; I226-W237 HydrophobicContact CG2-CZ3 3.7Å; M227-W237 HydrophobicContact CE-CZ2 4.08Å; M227-W237 HydrophobicContact CG-CD2 3.76Å; M227-W237 HydrophobicContact CG-CE3 4.01Å; M227-W237 HydrophobicContact CG-CG 4.14Å; M227-W237 HydrophobicContact CG-CZ2 4.29Å; M227-W237 HydrophobicContact CG-CZ3 4.39Å; V230-W237 HydrophobicContact CB-CE3 3.92Å; V230-W237 HydrophobicContact CB-CZ3 4.29Å; V230-W237 HydrophobicContact CG1-CE3 3.92Å; V230-W237 HydrophobicContact CG2-CE3 4.07Å; V230-W237 HydrophobicContact CG2-CZ3 3.93Å; E231-W237 HydrophobicContact CG-CB 4.34Å; E231-W237 WeakPolarHBondContact OE1-CB 3.17Å; E231-W237 PolarHBondContact OE1-N 2.98Å; W237-K239 PolarHBondContact O-N 3.42Å; W237-F240 HydrophobicContact CE3-CD1 4.41Å; W237-F240 HydrophobicContact CZ3-CD1 4.19Å; W237-F240 HydrophobicContact CZ3-CE1 4.49Å; W237-F240 PolarHBondContact O-N 3.24Å; W237-F241 HydrophobicContact CH2-CD2 4.44Å; W237-F241 HydrophobicContact CZ2-CB 4.25Å; W237-F241 HydrophobicContact CZ2-CD2 4.17Å; W237-F241 HydrophobicContact CZ2-CG 4.33Å; W237-F241 WeakPolarHBondContact O-CB 3.33Å; W237-F241 PolarHBondContact O-N 3.15Å; W237-Y303 HydrophobicContact CB-CD2 3.87Å; W237-Y303 HydrophobicContact CB-CE2 3.49Å; W237-Y303 VanDerWaalsContact CB-CE2 3.49Å; W237-Y303 AromaticContact CD1-CD2 3.71Å; W237-Y303 AromaticContact CG-CD2 3.9Å; W237-Y303 HydrophobicContact CG-CD2 3.9Å; W237-Y303 HydrophobicContact CG-CE2 4.06Å
238	F	77.2	Confident	77.5	Confident	15 Å²	15	54.4 Å²	54.4	7%	0.066	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-43	-174.2	-78.3	-62.3	0	0	0	112.1	N236 F241 H242 L296 T300 Y303 K322 I325	N236-F238 VanDerWaalsContact C-N 3.32Å; N236-F238 PolarHBondContact O-N 3.26Å; N236-F238 PolarHBondContact OD1-N 3.33Å; F238-F241 PolarHBondContact O-N 2.85Å; F238-H242 VanDerWaalsContact O-CB 3.27Å; F238-H242 WeakPolarHBondContact O-CB 3.43Å; F238-H242 PolarHBondContact O-N 3.37Å; F238-L296 HydrophobicContact CD1-CD1 4.2Å; F238-L296 HydrophobicContact CE1-CD1 4.08Å; F238-T300 HydrophobicContact CZ-CG2 4.42Å; F238-Y303 HydrophobicContact CD2-CD1 4.33Å; F238-Y303 HydrophobicContact CD2-CE1 4.09Å; F238-Y303 AromaticContact CE2-CD1 3.43Å; F238-Y303 HydrophobicContact CE2-CD1 3.43Å; F238-Y303 VanDerWaalsContact CE2-CD1 3.43Å; F238-Y303 AromaticContact CE2-CE1 3.52Å; F238-Y303 HydrophobicContact CE2-CE1 3.52Å; F238-Y303 HydrophobicContact CE2-CG 4.16Å; F238-Y303 AromaticContact CZ-CD1 3.87Å; F238-Y303 HydrophobicContact CZ-CD1 3.87Å; F238-Y303 HydrophobicContact CZ-CE1 4.41Å; F238-Y303 HydrophobicContact CZ-CG 4.32Å; F238-K322 HydrophobicContact CE2-CG 4.5Å; F238-I325 HydrophobicContact CB-CD1 3.55Å; F238-I325 HydrophobicContact CG-CD1 4.49Å; F238-I325 WeakPolarHBondContact O-CD1 3.37Å
239	K	75.9	Confident	76.9	Confident	150 Å²	150	55.9 Å²	55.9	65%	0.652	28%	0.276	S	S	*	.	H	α-helix	trans	-64.2	-42.2	176.9	-173.8	179.8	179.2	-177.5	0	111.9	N236 W237 H242 G243	N236-K239 HydrophobicContact CB-CB 4.02Å; N236-K239 PolarHBondContact O-N 3.4Å; N236-K239 PolarHBondContact OD1-N 3.33Å; W237-K239 PolarHBondContact O-N 3.42Å; K239-H242 PolarHBondContact O-N 3.37Å; K239-G243 PolarHBondContact O-N 3.12Å
240	F	79.3	Confident	76.4	Confident	39 Å²	39	57.7 Å²	57.7	17%	0.171	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-50.5	176.8	172.3	-100.2	0	0	0	111.5	L201 V230 N236 W237 H242 G243 K244	L201-F240 HydrophobicContact CD2-CE1 3.55Å; L201-F240 HydrophobicContact CD2-CZ 4.13Å; V230-F240 HydrophobicContact CB-CD1 4.32Å; V230-F240 HydrophobicContact CG1-CB 3.66Å; V230-F240 HydrophobicContact CG1-CD1 3.59Å; V230-F240 HydrophobicContact CG1-CD2 4.44Å; V230-F240 HydrophobicContact CG1-CE1 4.32Å; V230-F240 HydrophobicContact CG1-CG 3.64Å; V230-F240 HydrophobicContact CG2-CD1 3.71Å; V230-F240 HydrophobicContact CG2-CE1 3.62Å; V230-F240 HydrophobicContact CG2-CG 4.41Å; V230-F240 HydrophobicContact CG2-CZ 4.27Å; N236-F240 PolarHBondContact O-N 3.09Å; W237-F240 HydrophobicContact CE3-CD1 4.41Å; W237-F240 HydrophobicContact CZ3-CD1 4.19Å; W237-F240 HydrophobicContact CZ3-CE1 4.49Å; W237-F240 PolarHBondContact O-N 3.24Å; F240-H242 VanDerWaalsContact C-N 3.27Å; F240-H242 PolarHBondContact O-N 3.01Å; F240-G243 PolarHBondContact O-N 3.45Å; F240-K244 PolarHBondContact O-N 2.5Å
241	F	82.9	Confident	75.8	Confident	1 Å²	1	63.9 Å²	63.9	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-56.7	-43.5	177.4	179.4	-112.5	0	0	0	111.5	I205 W237 F238 K244 M245 Y292 V295 L296	I205-F241 HydrophobicContact CD1-CD2 4.46Å; I205-F241 HydrophobicContact CD1-CE2 3.85Å; I205-F241 HydrophobicContact CG1-CE2 3.9Å; W237-F241 HydrophobicContact CH2-CD2 4.44Å; W237-F241 HydrophobicContact CZ2-CB 4.25Å; W237-F241 HydrophobicContact CZ2-CD2 4.17Å; W237-F241 HydrophobicContact CZ2-CG 4.33Å; W237-F241 WeakPolarHBondContact O-CB 3.33Å; W237-F241 PolarHBondContact O-N 3.15Å; F238-F241 PolarHBondContact O-N 2.85Å; F241-K244 WeakPolarHBondContact O-CB 3.24Å; F241-K244 PolarHBondContact O-N 3.3Å; F241-K244 VanDerWaalsContact O-N 3.15Å; F241-M245 HydrophobicContact CD1-CG 4.42Å; F241-M245 HydrophobicContact CD2-CG 4.45Å; F241-M245 HydrophobicContact CE1-CG 3.93Å; F241-M245 HydrophobicContact CE2-CG 3.94Å; F241-M245 HydrophobicContact CE2-SD 4.01Å; F241-M245 HydrophobicContact CZ-CG 3.64Å; F241-M245 HydrophobicContact CZ-SD 3.85Å; F241-M245 WeakPolarHBondContact O-CG 3.49Å; F241-M245 PolarHBondContact O-N 3.39Å; F241-Y292 AromaticContact CD1-CE2 3.92Å; F241-Y292 HydrophobicContact CD1-CE2 3.92Å; F241-Y292 AromaticContact CE1-CD2 3.7Å; F241-Y292 HydrophobicContact CE1-CD2 3.7Å; F241-Y292 AromaticContact CE1-CE2 3.43Å; F241-Y292 HydrophobicContact CE1-CE2 3.43Å; F241-Y292 VanDerWaalsContact CE1-CE2 3.43Å; F241-Y292 HydrophobicContact CZ-CD2 4.25Å; F241-Y292 HydrophobicContact CZ-CE2 4.32Å; F241-V295 HydrophobicContact CE1-CG1 4.42Å; F241-V295 HydrophobicContact CE2-CG1 3.71Å; F241-V295 HydrophobicContact CZ-CB 3.86Å; F241-V295 HydrophobicContact CZ-CG1 3.43Å; F241-V295 VanDerWaalsContact CZ-CG1 3.43Å; F241-L296 HydrophobicContact CD1-CD1 4.47Å; F241-L296 HydrophobicContact CE1-CD1 4.39Å
242	H	82.1	Confident	74.8	Confident	30 Å²	30	69 Å²	69	14%	0.139	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-46.9	176.5	174.2	86.6	0	0	0	113.2	F238 K239 F240 K244 M245 I246 Y292 I325 W328	F238-H242 VanDerWaalsContact O-CB 3.27Å; F238-H242 WeakPolarHBondContact O-CB 3.43Å; F238-H242 PolarHBondContact O-N 3.37Å; K239-H242 PolarHBondContact O-N 3.37Å; F240-H242 VanDerWaalsContact C-N 3.27Å; F240-H242 PolarHBondContact O-N 3.01Å; H242-K244 PolarHBondContact O-N 3.39Å; H242-M245 PolarHBondContact O-N 3.24Å; H242-I246 WeakPolarHBondContact NE2-CD1 3.16Å; H242-I246 WeakPolarHBondContact O-CG1 3.4Å; H242-I246 PolarHBondContact O-N 3.29Å; H242-Y292 WeakPolarHBondContact CA-OH 3.32Å; H242-Y292 WeakPolarHBondContact CB-OH 3.1Å; H242-Y292 VanDerWaalsContact CG-OH 3.31Å; H242-Y292 AromaticContact ND1-CZ 3.92Å; H242-Y292 PolarHBondContact ND1-OH 3.44Å; H242-I325 HydrophobicContact CB-CD1 3.85Å; H242-I325 HydrophobicContact CB-CG1 4Å; H242-I325 HydrophobicContact CB-CG2 4.27Å; H242-W328 AromaticContact CE1-CD2 3.64Å; H242-W328 AromaticContact CE1-CE2 3.98Å; H242-W328 AromaticContact CE1-CE3 3.38Å; H242-W328 AromaticContact CE1-CH2 3.83Å; H242-W328 AromaticContact CE1-CZ3 3.48Å; H242-W328 VanDerWaalsContact CE1-CZ3 3.48Å; H242-W328 WeakPolarHBondContact CE1-CZ3 3.5Å
243	G	79.9	Confident	73.9	Confident	31 Å²	31	71.2 Å²	71.2	32%	0.32	35%	0.351	S	S	.	.	H	α-helix	trans	-58.8	-35.3	174.1	0	0	0	0	0	112.4	K239 F240 K247	K239-G243 PolarHBondContact O-N 3.12Å; F240-G243 PolarHBondContact O-N 3.45Å; G243-K247 WeakPolarHBondContact O-CG 3.48Å; G243-K247 PolarHBondContact O-N 3.3Å; G243-K247 VanDerWaalsContact O-N 3.16Å
244	K	82.3	Confident	73.1	Confident	20 Å²	20	69 Å²	69	9%	0.087	34%	0.344	C	S	.	.	H	α-helix	trans	-67.4	-48	176.6	-172	65.5	-178	175	0	112.2	D198 L201 E202 I205 F240 F241 H242 I246 K247 L248	D198-K244 WeakPolarHBondContact OD1-CD 3.31Å; D198-K244 WeakPolarHBondContact OD1-CE 3.23Å; D198-K244 IonicContact OD1-NZ 2.92Å; D198-K244 PolarHBondContact OD1-NZ 2.95Å; D198-K244 IonicContact OD2-NZ 3.02Å; D198-K244 PolarHBondContact OD2-NZ 3.1Å; L201-K244 HydrophobicContact CD2-CG 3.98Å; E202-K244 WeakPolarHBondContact OE1-CE 3.36Å; E202-K244 IonicContact OE1-NZ 2.74Å; E202-K244 PolarHBondContact OE1-NZ 2.99Å; I205-K244 HydrophobicContact CD1-CG 4.37Å; F240-K244 PolarHBondContact O-N 2.5Å; F241-K244 WeakPolarHBondContact O-CB 3.24Å; F241-K244 PolarHBondContact O-N 3.3Å; F241-K244 VanDerWaalsContact O-N 3.15Å; H242-K244 PolarHBondContact O-N 3.39Å; K244-I246 VanDerWaalsContact C-N 3.3Å; K244-I246 PolarHBondContact O-N 3.41Å; K244-K247 PolarHBondContact O-N 2.84Å; K244-L248 WeakPolarHBondContact O-CG 3.33Å; K244-L248 PolarHBondContact O-N 3.23Å
245	M	81.6	Confident	72	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-62.3	-36.8	177.8	-68.4	-57.5	-60.6	0	0	112.4	I205 F241 H242 L248 S249 V288 Y292	I205-M245 HydrophobicContact CD1-SD 4.09Å; I205-M245 HydrophobicContact CG2-SD 4.04Å; F241-M245 HydrophobicContact CD1-CG 4.42Å; F241-M245 HydrophobicContact CD2-CG 4.45Å; F241-M245 HydrophobicContact CE1-CG 3.93Å; F241-M245 HydrophobicContact CE2-CG 3.94Å; F241-M245 HydrophobicContact CE2-SD 4.01Å; F241-M245 HydrophobicContact CZ-CG 3.64Å; F241-M245 HydrophobicContact CZ-SD 3.85Å; F241-M245 WeakPolarHBondContact O-CG 3.49Å; F241-M245 PolarHBondContact O-N 3.39Å; H242-M245 PolarHBondContact O-N 3.24Å; M245-L248 PolarHBondContact O-N 2.99Å; M245-L248 HydrophobicContact SD-CD1 4.07Å; M245-S249 PolarHBondContact O-N 3.4Å; M245-V288 HydrophobicContact CE-CG1 4.33Å; M245-Y292 HydrophobicContact CB-CD1 3.52Å; M245-Y292 HydrophobicContact CB-CD2 4.39Å; M245-Y292 HydrophobicContact CB-CE1 3.33Å; M245-Y292 HydrophobicContact CB-CE2 4.28Å; M245-Y292 HydrophobicContact CB-CG 4.06Å; M245-Y292 HydrophobicContact CE-CD1 4.09Å; M245-Y292 HydrophobicContact CE-CD2 4.41Å; M245-Y292 HydrophobicContact CE-CG 3.78Å; M245-Y292 HydrophobicContact CG-CD1 3.87Å; M245-Y292 HydrophobicContact CG-CD2 3.85Å; M245-Y292 HydrophobicContact CG-CE1 3.86Å; M245-Y292 HydrophobicContact CG-CE2 3.88Å; M245-Y292 HydrophobicContact CG-CG 3.87Å
246	I	77.5	Confident	71.1	Confident	58 Å²	58	66.2 Å²	66.2	30%	0.297	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-47.3	173.6	-70.5	177.9	0	0	0	111	H242 K244 L248 S249 A250 W328	H242-I246 WeakPolarHBondContact NE2-CD1 3.16Å; H242-I246 WeakPolarHBondContact O-CG1 3.4Å; H242-I246 PolarHBondContact O-N 3.29Å; K244-I246 VanDerWaalsContact C-N 3.3Å; K244-I246 PolarHBondContact O-N 3.41Å; I246-L248 VanDerWaalsContact C-N 3.28Å; I246-L248 PolarHBondContact O-N 3.38Å; I246-S249 WeakPolarHBondContact CA-OG 3.38Å; I246-S249 PolarHBondContact O-N 2.53Å; I246-S249 VanDerWaalsContact O-N 3.13Å; I246-S249 PolarHBondContact O-OG 3.09Å; I246-A250 PolarHBondContact O-N 3.23Å; I246-W328 HydrophobicContact CD1-CH2 3.86Å; I246-W328 HydrophobicContact CD1-CZ2 4.1Å; I246-W328 HydrophobicContact CG1-CH2 4.19Å
247	K	76.5	Confident	69.8	Low	120 Å²	120	67.9 Å²	67.9	52%	0.522	35%	0.35	S	S	.	.	H	α-helix	trans	-58.4	-40.6	176.9	-72.8	177.5	179.3	-175.6	0	112.4	G243 K244 A250 Q251 Q252	G243-K247 WeakPolarHBondContact O-CG 3.48Å; G243-K247 PolarHBondContact O-N 3.3Å; G243-K247 VanDerWaalsContact O-N 3.16Å; K244-K247 PolarHBondContact O-N 2.84Å; K247-A250 PolarHBondContact O-N 3.16Å; K247-Q251 PolarHBondContact O-N 3.49Å; K247-Q252 PolarHBondContact O-N 3.19Å
248	L	74.9	Confident	68.5	Low	26 Å²	26	73 Å²	73	14%	0.136	37%	0.374	C	S	.	.	H	α-helix	trans	-63.3	-43.4	175.4	-69.3	175	0	0	0	111.8	E202 I205 K244 M245 I246 A250 Q251 F269	E202-L248 HydrophobicContact CG-CD2 4.49Å; I205-L248 HydrophobicContact CD1-CD1 4.26Å; K244-L248 WeakPolarHBondContact O-CG 3.33Å; K244-L248 PolarHBondContact O-N 3.23Å; M245-L248 PolarHBondContact O-N 2.99Å; M245-L248 HydrophobicContact SD-CD1 4.07Å; I246-L248 VanDerWaalsContact C-N 3.28Å; I246-L248 PolarHBondContact O-N 3.38Å; L248-A250 VanDerWaalsContact C-N 3.35Å; L248-A250 PolarHBondContact O-N 3.26Å; L248-Q251 PolarHBondContact O-N 2.88Å; L248-Q251 VanDerWaalsContact O-N 3.13Å; L248-F269 HydrophobicContact CD1-CE1 4.26Å; L248-F269 HydrophobicContact CD1-CE2 4.23Å; L248-F269 HydrophobicContact CD1-CZ 3.92Å; L248-F269 HydrophobicContact CD2-CD2 3.67Å; L248-F269 HydrophobicContact CD2-CE2 3.54Å; L248-F269 HydrophobicContact CD2-CG 4.31Å; L248-F269 HydrophobicContact CD2-CZ 4.09Å
249	S	70.1	Confident	67.2	Low	42 Å²	42	82.1 Å²	82.1	29%	0.294	41%	0.414	S	S	.	.	H	α-helix	trans	-63.5	-38.2	176.5	73.7	0	0	0	0	112.9	M245 I246 Q251	M245-S249 PolarHBondContact O-N 3.4Å; I246-S249 WeakPolarHBondContact CA-OG 3.38Å; I246-S249 PolarHBondContact O-N 2.53Å; I246-S249 VanDerWaalsContact O-N 3.13Å; I246-S249 PolarHBondContact O-OG 3.09Å; S249-Q251 PolarHBondContact O-N 3.11Å
250	A	69.7	Low	66.6	Low	54 Å²	54	75.3 Å²	75.3	45%	0.446	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-2.7	176.8	0	0	0	0	0	113.4	I246 K247 L248 Q252	I246-A250 PolarHBondContact O-N 3.23Å; K247-A250 PolarHBondContact O-N 3.16Å; L248-A250 VanDerWaalsContact C-N 3.35Å; L248-A250 PolarHBondContact O-N 3.26Å; A250-Q252 HydrophobicContact CB-CB 4.47Å; A250-Q252 HydrophobicContact CB-CG 3.9Å; A250-Q252 PolarHBondContact O-N 3.02Å
251	Q	66.4	Low	65.8	Low	132 Å²	132	77.2 Å²	77.2	62%	0.617	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	23.3	-172.9	-56.4	-176.5	1.9	0	0	113.5	K247 L248 S249 R253	K247-Q251 PolarHBondContact O-N 3.49Å; L248-Q251 PolarHBondContact O-N 2.88Å; L248-Q251 VanDerWaalsContact O-N 3.13Å; S249-Q251 PolarHBondContact O-N 3.11Å; Q251-R253 PolarHBondContact O-N 3.4Å; Q251-R253 VanDerWaalsContact O-N 3.15Å
252	Q	57.4	Low	65.2	Low	138 Å²	138	77.2 Å²	77.2	65%	0.645	40%	0.4	S	S	*	.			trans	-76.3	103.9	177.7	-73.6	-178.7	-3.8	0	0	108.5	K247 A250	K247-Q252 PolarHBondContact O-N 3.19Å; A250-Q252 HydrophobicContact CB-CB 4.47Å; A250-Q252 HydrophobicContact CB-CG 3.9Å; A250-Q252 PolarHBondContact O-N 3.02Å
253	R	55.8	Low	64.7	Low	171 Å²	171	78.3 Å²	78.3	65%	0.645	41%	0.405	S	S	*	.			trans	-78.1	147.8	166.9	-70.9	-175	179.3	177.2	-1.2	109	Q251 E255 N268	Q251-R253 PolarHBondContact O-N 3.4Å; Q251-R253 VanDerWaalsContact O-N 3.15Å; R253-E255 PolarHBondContact O-N 2.65Å; R253-N268 PolarHBondContact NH2-OD1 2.86Å
254	A	54	Low	64.3	Low	60 Å²	60	80.3 Å²	80.3	50%	0.496	41%	0.413	S	S	.	.			trans	-62.4	108.8	159.5	0	0	0	0	0	106.6	F256	A254-F256 HydrophobicContact CB-CE2 4.03Å; A254-F256 HydrophobicContact CB-CZ 4.47Å; A254-F256 WeakPolarHBondContact O-CD2 3.44Å; A254-F256 PolarHBondContact O-N 3.2Å
255	E	46.3	Very low	63.8	Low	192 Å²	192	79.4 Å²	79.4	90%	0.897	41%	0.409	S	S	*	.			trans	-67.9	100.6	174.3	-73.5	-177.6	169.5	0	0	108.1	R253	R253-E255 PolarHBondContact O-N 2.65Å
256	F	49.5	Very low	63.5	Low	40 Å²	40	80.7 Å²	80.7	18%	0.175	41%	0.414	C	S	.	.			trans	-77.4	132	161.6	-68.6	-79.9	0	0	0	108	L184 L190 Y195 A254 E258 E263	L184-F256 HydrophobicContact CD2-CE1 4.28Å; L190-F256 HydrophobicContact CD1-CE1 4.06Å; Y195-F256 HydrophobicContact CD2-CE1 4.45Å; Y195-F256 HydrophobicContact CD2-CE2 4.32Å; Y195-F256 AromaticContact CD2-CZ 3.61Å; Y195-F256 HydrophobicContact CD2-CZ 3.61Å; Y195-F256 HydrophobicContact CE2-CE1 4.21Å; Y195-F256 AromaticContact CE2-CE2 3.59Å; Y195-F256 HydrophobicContact CE2-CE2 3.59Å; Y195-F256 AromaticContact CE2-CZ 3.27Å; Y195-F256 HydrophobicContact CE2-CZ 3.27Å; A254-F256 HydrophobicContact CB-CE2 4.03Å; A254-F256 HydrophobicContact CB-CZ 4.47Å; A254-F256 WeakPolarHBondContact O-CD2 3.44Å; A254-F256 PolarHBondContact O-N 3.2Å; F256-E258 PolarHBondContact O-N 2.81Å; F256-E263 VanDerWaalsContact CE2-OE1 3.27Å; F256-E263 WeakPolarHBondContact CE2-OE1 3.19Å
257	S	46.9	Very low	63.3	Low	105 Å²	105	78.2 Å²	78.2	73%	0.734	40%	0.402	S	S	*	.	S	Bend	trans	-66.4	-19.7	177.2	56.2	0	0	0	0	113.1
258	E	52.7	Low	63	Low	109 Å²	109	75.8 Å²	75.8	51%	0.509	39%	0.394	S	S	.	.	S	Bend	trans	-128.4	143.1	-176.7	-73	172.9	171.9	0	0	110.4	K185 F256 N260	K185-E258 IonicContact NZ-OE1 2.7Å; K185-E258 PolarHBondContact NZ-OE1 3.3Å; K185-E258 IonicContact NZ-OE2 3.56Å; K185-E258 PolarHBondContact NZ-OE2 3.44Å; F256-E258 PolarHBondContact O-N 2.81Å; E258-N260 PolarHBondContact O-N 2.92Å
259	F	50.7	Low	62.8	Low	205 Å²	205	75.5 Å²	75.5	90%	0.899	39%	0.392	S	S	*	.			trans	-67.5	96.9	179.1	-155.3	-86	0	0	0	109.5	T261	F259-T261 PolarHBondContact O-N 3.3Å
260	N	61.9	Low	62.6	Low	8 Å²	8	78.5 Å²	78.5	4%	0.043	40%	0.4	C	S	.	.			trans	-80.5	119.1	174.1	-167.1	-16.3	0	0	0	109	L182 E258 L262 E263	L182-N260 PolarHBondContact O-ND2 2.55Å; E258-N260 PolarHBondContact O-N 2.92Å; N260-L262 PolarHBondContact O-N 3.17Å; N260-L262 PolarHBondContact OD1-N 3.47Å; N260-E263 HydrophobicContact CB-CG 4.34Å; N260-E263 WeakPolarHBondContact O-CB 3.31Å; N260-E263 PolarHBondContact O-N 3.31Å
261	T	63.9	Low	62.4	Low	79 Å²	79	78.5 Å²	78.5	49%	0.485	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-55.4	-24.7	178.6	59.3	0	0	0	0	112.4	R129 F259 E263 C264	R129-T261 PolarHBondContact NE-OG1 2.98Å; R129-T261 PolarHBondContact NH2-OG1 3.15Å; F259-T261 PolarHBondContact O-N 3.3Å; T261-E263 PolarHBondContact O-N 2.89Å; T261-C264 PolarHBondContact O-N 3.06Å; T261-C264 PolarHBondContact O-SG 3.27Å
262	L	68.6	Low	62.2	Low	1 Å²	1	74 Å²	74	1%	0.005	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-69.3	-16.1	177.3	-73.1	166	0	0	0	114.2	R129 L132 L182 F196 N260 C264 V265	R129-L262 HydrophobicContact CG-CD1 4.05Å; R129-L262 HydrophobicContact CG-CD2 3.94Å; R129-L262 HydrophobicContact CG-CG 4.04Å; L132-L262 HydrophobicContact CB-CD2 4.08Å; L182-L262 HydrophobicContact CD2-CD1 3.83Å; F196-L262 HydrophobicContact CE1-CD1 4.29Å; F196-L262 HydrophobicContact CE1-CD2 4.38Å; F196-L262 HydrophobicContact CZ-CD1 3.78Å; F196-L262 HydrophobicContact CZ-CD2 4.44Å; N260-L262 PolarHBondContact O-N 3.17Å; N260-L262 PolarHBondContact OD1-N 3.47Å; L262-C264 PolarHBondContact O-N 2.97Å; L262-C264 VanDerWaalsContact O-N 3.15Å; L262-V265 WeakPolarHBondContact O-CB 3.49Å; L262-V265 WeakPolarHBondContact O-CG2 3.47Å; L262-V265 PolarHBondContact O-N 2.99Å
263	E	72.9	Confident	62.4	Low	52 Å²	52	70.7 Å²	70.7	24%	0.243	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-63.3	-17.5	173.2	-72.2	-66	142	0	0	112.4	Y195 F256 N260 T261 V265 R266	Y195-E263 PolarHBondContact OH-OE1 2.99Å; F256-E263 VanDerWaalsContact CE2-OE1 3.27Å; F256-E263 WeakPolarHBondContact CE2-OE1 3.19Å; N260-E263 HydrophobicContact CB-CG 4.34Å; N260-E263 WeakPolarHBondContact O-CB 3.31Å; N260-E263 PolarHBondContact O-N 3.31Å; T261-E263 PolarHBondContact O-N 2.89Å; E263-V265 PolarHBondContact O-N 3.29Å; E263-R266 WeakPolarHBondContact O-CB 3.31Å; E263-R266 PolarHBondContact O-N 2.68Å; E263-R266 VanDerWaalsContact O-N 3.16Å; E263-R266 IonicContact OE1-CZ 3.2Å; E263-R266 IonicContact OE1-NH1 3.52Å; E263-R266 PolarHBondContact OE1-NH1 3.1Å; E263-R266 WeakPolarHBondContact OE2-CD 3.28Å; E263-R266 IonicContact OE2-CZ 2.81Å; E263-R266 IonicContact OE2-NE 2.68Å; E263-R266 IonicContact OE2-NH1 2.59Å; E263-R266 PolarHBondContact OE2-NH1 3.03Å
264	C	70	Confident	62.5	Low	73 Å²	73	68.8 Å²	68.8	49%	0.493	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-64.6	-22.1	172.8	74	0	0	0	0	113.4	P137 T261 L262 R266	P137-C264 WeakPolarHBondContact CD-O 3.18Å; T261-C264 PolarHBondContact O-N 3.06Å; T261-C264 PolarHBondContact O-SG 3.27Å; L262-C264 PolarHBondContact O-N 2.97Å; L262-C264 VanDerWaalsContact O-N 3.15Å; C264-R266 VanDerWaalsContact C-N 3.31Å
265	V	72.4	Confident	62.3	Low	1 Å²	1	68 Å²	68	1%	0.006	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-81.1	-17.7	179.1	-170.1	0	0	0	0	111.1	L132 P137 W158 I199 N203 L262 E263	L132-V265 VanDerWaalsContact O-CG2 3.23Å; L132-V265 WeakPolarHBondContact O-CG2 3.48Å; P137-V265 WeakPolarHBondContact CA-O 3.16Å; W158-V265 HydrophobicContact CH2-CG1 3.85Å; W158-V265 HydrophobicContact CZ2-CG1 3.45Å; W158-V265 VanDerWaalsContact CZ2-CG1 3.45Å; I199-V265 HydrophobicContact CG2-CG1 4.23Å; N203-V265 PolarHBondContact ND2-O 3.41Å; L262-V265 WeakPolarHBondContact O-CB 3.49Å; L262-V265 WeakPolarHBondContact O-CG2 3.47Å; L262-V265 PolarHBondContact O-N 2.99Å; E263-V265 PolarHBondContact O-N 3.29Å
266	R	75.3	Confident	62	Low	29 Å²	29	64.4 Å²	64.4	11%	0.109	34%	0.343	C	S	.	.	S	Bend	trans	-77	135.6	179.2	-167.8	177.7	-105.7	144.1	1.6	110.3	D198 E202 E263 C264	D198-R266 IonicContact OD2-NH2 3.07Å; D198-R266 PolarHBondContact OD2-NH2 3.4Å; E202-R266 IonicContact OE1-NE 3.31Å; E202-R266 WeakPolarHBondContact OE2-CD 3.38Å; E202-R266 WeakPolarHBondContact OE2-CG 3.45Å; E202-R266 IonicContact OE2-NE 2.96Å; E202-R266 PolarHBondContact OE2-NE 3.12Å; E263-R266 WeakPolarHBondContact O-CB 3.31Å; E263-R266 PolarHBondContact O-N 2.68Å; E263-R266 VanDerWaalsContact O-N 3.16Å; E263-R266 IonicContact OE1-CZ 3.2Å; E263-R266 IonicContact OE1-NH1 3.52Å; E263-R266 PolarHBondContact OE1-NH1 3.1Å; E263-R266 WeakPolarHBondContact OE2-CD 3.28Å; E263-R266 IonicContact OE2-CZ 2.81Å; E263-R266 IonicContact OE2-NE 2.68Å; E263-R266 IonicContact OE2-NH1 2.59Å; E263-R266 PolarHBondContact OE2-NH1 3.03Å; C264-R266 VanDerWaalsContact C-N 3.31Å
267	P	72.6	Confident	61.4	Low	6 Å²	6	67 Å²	67	4%	0.039	37%	0.367	C	S	.	.			trans	-68	141.1	178.7	27.6	-34.2	0	0	0	111.5	E202 L206 F269	E202-P267 HydrophobicContact CB-CG 3.78Å; L206-P267 HydrophobicContact CD2-CB 3.82Å; P267-F269 HydrophobicContact CB-CE2 4.46Å; P267-F269 HydrophobicContact CG-CD2 4.42Å; P267-F269 HydrophobicContact CG-CE2 3.73Å; P267-F269 HydrophobicContact CG-CZ 4.06Å; P267-F269 PolarHBondContact O-N 2.84Å
268	N	72.1	Confident	61.2	Low	68 Å²	68	64.4 Å²	64.4	36%	0.364	34%	0.344	S	S	.	.			trans	-89.9	86.8	175.9	-173.1	7.5	0	0	0	111.2	R253 K270 S271 Y272	R253-N268 PolarHBondContact NH2-OD1 2.86Å; N268-K270 PolarHBondContact O-N 3.46Å; N268-K270 VanDerWaalsContact O-N 3.17Å; N268-K270 PolarHBondContact OD1-N 2.9Å; N268-S271 WeakPolarHBondContact CB-OG 3.42Å; N268-S271 PolarHBondContact ND2-OG 3.5Å; N268-S271 PolarHBondContact O-N 3.28Å; N268-S271 PolarHBondContact O-OG 3.24Å; N268-Y272 WeakPolarHBondContact O-CD2 3.44Å; N268-Y272 PolarHBondContact O-N 2.97Å
269	F	69.8	Low	60.3	Low	21 Å²	21	67 Å²	67	9%	0.092	36%	0.362	C	S	.	.	H	α-helix	trans	-55.8	-33.6	177.5	-70.6	-83.7	0	0	0	113.5	E202 I205 L206 L248 P267 S271 Y272 F273 L291	E202-F269 HydrophobicContact CB-CE2 3.93Å; E202-F269 HydrophobicContact CB-CZ 4.12Å; E202-F269 HydrophobicContact CG-CE2 4.01Å; E202-F269 HydrophobicContact CG-CZ 4.38Å; I205-F269 HydrophobicContact CG2-CE1 4.24Å; I205-F269 HydrophobicContact CG2-CZ 4.36Å; L206-F269 HydrophobicContact CB-CE1 4.09Å; L206-F269 HydrophobicContact CB-CZ 4.42Å; L206-F269 HydrophobicContact CD1-CD1 4.11Å; L206-F269 HydrophobicContact CD1-CE1 3.96Å; L206-F269 HydrophobicContact CD2-CE1 4.44Å; L206-F269 HydrophobicContact CG-CE1 4.39Å; L248-F269 HydrophobicContact CD1-CE1 4.26Å; L248-F269 HydrophobicContact CD1-CE2 4.23Å; L248-F269 HydrophobicContact CD1-CZ 3.92Å; L248-F269 HydrophobicContact CD2-CD2 3.67Å; L248-F269 HydrophobicContact CD2-CE2 3.54Å; L248-F269 HydrophobicContact CD2-CG 4.31Å; L248-F269 HydrophobicContact CD2-CZ 4.09Å; P267-F269 HydrophobicContact CB-CE2 4.46Å; P267-F269 HydrophobicContact CG-CD2 4.42Å; P267-F269 HydrophobicContact CG-CE2 3.73Å; P267-F269 HydrophobicContact CG-CZ 4.06Å; P267-F269 PolarHBondContact O-N 2.84Å; F269-S271 PolarHBondContact O-N 2.72Å; F269-Y272 PolarHBondContact O-N 2.87Å; F269-F273 HydrophobicContact CB-CD2 4.17Å; F269-F273 HydrophobicContact CB-CE2 3.94Å; F269-F273 AromaticContact CD1-CE2 3.91Å; F269-F273 HydrophobicContact CD1-CE2 3.91Å; F269-F273 HydrophobicContact CD1-CZ 4.47Å; F269-F273 HydrophobicContact CG-CE2 4.41Å; F269-F273 WeakPolarHBondContact O-CD2 3.39Å; F269-F273 PolarHBondContact O-N 3.4Å; F269-F273 VanDerWaalsContact O-N 3.08Å; F269-L291 HydrophobicContact CD1-CD2 4.27Å; F269-L291 HydrophobicContact CE1-CD2 3.86Å
270	K	66.1	Low	59.8	Low	105 Å²	105	61.6 Å²	61.6	46%	0.457	34%	0.341	S	S	.	.	H	α-helix	trans	-64.7	-41.2	-177.6	-172.2	177.6	179.3	178.5	0	112.1	N268 Q274	N268-K270 PolarHBondContact O-N 3.46Å; N268-K270 VanDerWaalsContact O-N 3.17Å; N268-K270 PolarHBondContact OD1-N 2.9Å; K270-Q274 HydrophobicContact CG-CG 4.41Å; K270-Q274 WeakPolarHBondContact O-CB 3.31Å; K270-Q274 VanDerWaalsContact O-CG 3.27Å; K270-Q274 WeakPolarHBondContact O-CG 3.27Å; K270-Q274 PolarHBondContact O-N 3.4Å; K270-Q274 VanDerWaalsContact O-N 3.15Å
271	S	65.2	Low	58.7	Low	54 Å²	54	66.3 Å²	66.3	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-66.4	-39.8	177.9	53.3	0	0	0	0	111.4	N268 F269 Q274 S275	N268-S271 WeakPolarHBondContact CB-OG 3.42Å; N268-S271 PolarHBondContact ND2-OG 3.5Å; N268-S271 PolarHBondContact O-N 3.28Å; N268-S271 PolarHBondContact O-OG 3.24Å; F269-S271 PolarHBondContact O-N 2.72Å; S271-Q274 PolarHBondContact O-N 3.14Å; S271-S275 WeakPolarHBondContact O-CB 3.42Å; S271-S275 PolarHBondContact O-N 3.28Å; S271-S275 PolarHBondContact O-OG 3.16Å; S271-S275 VanDerWaalsContact O-OG 3.1Å
272	Y	62.1	Low	57.6	Low	38 Å²	38	71.1 Å²	71.1	15%	0.149	39%	0.391	C	S	.	.	H	α-helix	trans	-64.5	-42.9	178.5	-85.8	-78.2	0	0	0	113.3	T139 E143 L206 L210 N268 F269 S275 L278	T139-Y272 VanDerWaalsContact CB-OH 3.29Å; T139-Y272 WeakPolarHBondContact CB-OH 3.45Å; T139-Y272 PolarHBondContact O-OH 2.9Å; T139-Y272 WeakPolarHBondContact OG1-CE2 3.46Å; T139-Y272 PolarHBondContact OG1-OH 3.34Å; E143-Y272 PolarHBondContact OE1-OH 2.78Å; L206-Y272 HydrophobicContact CD2-CD2 3.57Å; L206-Y272 HydrophobicContact CD2-CE2 3.69Å; L206-Y272 HydrophobicContact CD2-CG 4.15Å; L210-Y272 HydrophobicContact CD1-CE1 4.36Å; N268-Y272 WeakPolarHBondContact O-CD2 3.44Å; N268-Y272 PolarHBondContact O-N 2.97Å; F269-Y272 PolarHBondContact O-N 2.87Å; Y272-S275 PolarHBondContact O-OG 3.06Å; Y272-L278 HydrophobicContact CD1-CD1 4.23Å; Y272-L278 HydrophobicContact CE1-CD1 4.37Å
273	F	61.4	Low	56.4	Low	68 Å²	68	73.7 Å²	73.7	30%	0.298	40%	0.403	S	S	.	.	H	α-helix	trans	-78.1	-18.9	-179.8	-66.1	-58.5	0	0	0	113.8	F269 L286 V288 L291	F269-F273 HydrophobicContact CB-CD2 4.17Å; F269-F273 HydrophobicContact CB-CE2 3.94Å; F269-F273 AromaticContact CD1-CE2 3.91Å; F269-F273 HydrophobicContact CD1-CE2 3.91Å; F269-F273 HydrophobicContact CD1-CZ 4.47Å; F269-F273 HydrophobicContact CG-CE2 4.41Å; F269-F273 WeakPolarHBondContact O-CD2 3.39Å; F269-F273 PolarHBondContact O-N 3.4Å; F269-F273 VanDerWaalsContact O-N 3.08Å; F273-L286 WeakPolarHBondContact CD1-O 3.34Å; F273-L286 VanDerWaalsContact CE1-O 3.27Å; F273-L286 WeakPolarHBondContact CE1-O 3.23Å; F273-V288 HydrophobicContact CD1-CG2 4.33Å; F273-V288 HydrophobicContact CD2-CG2 3.76Å; F273-V288 HydrophobicContact CE1-CB 4.46Å; F273-V288 HydrophobicContact CE1-CG2 4Å; F273-V288 VanDerWaalsContact CE1-N 3.35Å; F273-V288 HydrophobicContact CE2-CB 4.35Å; F273-V288 HydrophobicContact CE2-CG2 3.39Å; F273-V288 HydrophobicContact CG-CG2 4.24Å; F273-V288 HydrophobicContact CZ-CB 4.05Å; F273-V288 HydrophobicContact CZ-CG2 3.53Å; F273-L291 HydrophobicContact CZ-CB 4.47Å; F273-L291 HydrophobicContact CZ-CD2 4.01Å
274	Q	58.2	Low	54.9	Low	131 Å²	131	76.3 Å²	76.3	61%	0.612	43%	0.427	S	S	*	.	H	α-helix	trans	-94.9	-21.3	178.8	-70.4	-174.9	-27.7	0	0	113.6	K270 S271 S276	K270-Q274 HydrophobicContact CG-CG 4.41Å; K270-Q274 WeakPolarHBondContact O-CB 3.31Å; K270-Q274 VanDerWaalsContact O-CG 3.27Å; K270-Q274 WeakPolarHBondContact O-CG 3.27Å; K270-Q274 PolarHBondContact O-N 3.4Å; K270-Q274 VanDerWaalsContact O-N 3.15Å; S271-Q274 PolarHBondContact O-N 3.14Å; Q274-S276 PolarHBondContact O-N 3.48Å
275	S	49.3	Very low	53.9	Low	43 Å²	43	75.9 Å²	75.9	30%	0.301	43%	0.425	S	S	.	.			trans	-75.5	95.1	179.5	57.3	0	0	0	0	110.9	S271 Y272 S277	S271-S275 WeakPolarHBondContact O-CB 3.42Å; S271-S275 PolarHBondContact O-N 3.28Å; S271-S275 PolarHBondContact O-OG 3.16Å; S271-S275 VanDerWaalsContact O-OG 3.1Å; Y272-S275 PolarHBondContact O-OG 3.06Å; S275-S277 PolarHBondContact O-N 3.11Å
276	S	40.5	Very low	53.1	Low	116 Å²	116	77.7 Å²	77.7	81%	0.811	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.7	168.3	51.9	0	0	0	0	113.8	Q274	Q274-S276 PolarHBondContact O-N 3.48Å
277	S	37.2	Very low	52.7	Low	96 Å²	96	78.3 Å²	78.3	67%	0.671	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	11.1	-170.6	67	0	0	0	0	115.5	S275 D279	S275-S277 PolarHBondContact O-N 3.11Å; S277-D279 VanDerWaalsContact C-N 3.26Å; S277-D279 PolarHBondContact O-N 3.35Å
278	L	41.4	Very low	52.6	Low	49 Å²	49	79.3 Å²	79.3	26%	0.257	45%	0.447	S	S	.	.			trans	-77	84.4	170.4	-94.6	147.4	0	0	0	109.1	Y272 I280	Y272-L278 HydrophobicContact CD1-CD1 4.23Å; Y272-L278 HydrophobicContact CE1-CD1 4.37Å; L278-I280 HydrophobicContact CD2-CD1 3.84Å; L278-I280 HydrophobicContact CD2-CG1 4.18Å; L278-I280 PolarHBondContact O-N 3.38Å
279	D	34.8	Very low	52.7	Low	165 Å²	165	79.7 Å²	79.7	88%	0.882	44%	0.444	S	S	*	.			trans	-66.7	41.9	169.9	-100.5	-19.3	0	0	0	112.4	S277	S277-D279 VanDerWaalsContact C-N 3.26Å; S277-D279 PolarHBondContact O-N 3.35Å
280	I	39.1	Very low	52.9	Low	90 Å²	90	79.1 Å²	79.1	46%	0.462	44%	0.443	S	S	.	.			trans	-89.1	111.8	159.8	-55.4	175.8	0	0	0	104.1	L278 H282 Q283	L278-I280 HydrophobicContact CD2-CD1 3.84Å; L278-I280 HydrophobicContact CD2-CG1 4.18Å; L278-I280 PolarHBondContact O-N 3.38Å; I280-H282 PolarHBondContact O-N 3.07Å; I280-Q283 PolarHBondContact O-N 2.71Å
281	S	39.9	Very low	53.4	Low	108 Å²	108	74.3 Å²	74.3	76%	0.755	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	11.4	-162.2	58.4	0	0	0	0	118.2
282	H	41	Very low	54.2	Low	180 Å²	180	71.8 Å²	71.8	83%	0.833	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.8	14.2	172.8	-71	-68.2	0	0	0	115.1	I280	I280-H282 PolarHBondContact O-N 3.07Å
283	Q	43.3	Very low	55.1	Low	54 Å²	54	70 Å²	70	25%	0.252	40%	0.397	S	S	.	.			trans	-120.3	9.1	-170.6	-73.1	-169.2	-17.1	0	0	116.6	L210 I280 S285 L286	L210-Q283 PolarHBondContact O-NE2 3.15Å; I280-Q283 PolarHBondContact O-N 2.71Å; Q283-S285 PolarHBondContact O-N 3.32Å; Q283-L286 HydrophobicContact CB-CD1 3.82Å; Q283-L286 HydrophobicContact CG-CD1 3.7Å
284	S	41.2	Very low	55.9	Low	107 Å²	107	67.4 Å²	67.4	75%	0.748	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	11.7	-170.3	53.7	0	0	0	0	116.9
285	S	48.8	Very low	57.1	Low	64 Å²	64	61.1 Å²	61.1	45%	0.448	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.3	38.9	171.3	73.8	0	0	0	0	114.6	Q283 T287	Q283-S285 PolarHBondContact O-N 3.32Å; S285-T287 PolarHBondContact O-N 3.42Å
286	L	55	Low	58.7	Low	39 Å²	39	59.3 Å²	59.3	20%	0.204	34%	0.343	C	S	.	.			trans	-64.1	102.8	172.7	-91.2	132.6	0	0	0	109.2	L210 F273 Q283 S290 F347	L210-L286 HydrophobicContact CD2-CD1 3.92Å; F273-L286 WeakPolarHBondContact CD1-O 3.34Å; F273-L286 VanDerWaalsContact CE1-O 3.27Å; F273-L286 WeakPolarHBondContact CE1-O 3.23Å; Q283-L286 HydrophobicContact CB-CD1 3.82Å; Q283-L286 HydrophobicContact CG-CD1 3.7Å; L286-S290 VanDerWaalsContact CA-OG 3.23Å; L286-S290 WeakPolarHBondContact CA-OG 3.34Å; L286-S290 WeakPolarHBondContact CD2-OG 3.18Å; L286-F347 HydrophobicContact CD2-CE2 4.45Å; L286-F347 HydrophobicContact CD2-CZ 4.31Å
287	T	67.6	Low	60.5	Low	42 Å²	42	54 Å²	54	26%	0.258	31%	0.307	S	S	.	.			trans	-78.2	159.4	169.8	57.1	0	0	0	0	110.4	S285 W289 S290 L291 E344	S285-T287 PolarHBondContact O-N 3.42Å; T287-W289 PolarHBondContact O-N 3.32Å; T287-S290 PolarHBondContact N-OG 3.24Å; T287-S290 PolarHBondContact O-N 3.27Å; T287-S290 PolarHBondContact O-OG 3.36Å; T287-S290 PolarHBondContact OG1-N 3.13Å; T287-L291 PolarHBondContact O-N 3.35Å; T287-L291 VanDerWaalsContact O-N 3.08Å; T287-E344 WeakPolarHBondContact CG2-OE1 3.44Å; T287-E344 PolarHBondContact OG1-OE1 3.16Å
288	V	71	Confident	62.5	Low	27 Å²	27	50.6 Å²	50.6	16%	0.164	28%	0.28	C	S	.	.	H	α-helix	trans	-49.5	-32.7	173.8	178.6	0	0	0	0	111.3	M245 F273 L291 Y292	M245-V288 HydrophobicContact CE-CG1 4.33Å; F273-V288 HydrophobicContact CD1-CG2 4.33Å; F273-V288 HydrophobicContact CD2-CG2 3.76Å; F273-V288 HydrophobicContact CE1-CB 4.46Å; F273-V288 HydrophobicContact CE1-CG2 4Å; F273-V288 VanDerWaalsContact CE1-N 3.35Å; F273-V288 HydrophobicContact CE2-CB 4.35Å; F273-V288 HydrophobicContact CE2-CG2 3.39Å; F273-V288 HydrophobicContact CG-CG2 4.24Å; F273-V288 HydrophobicContact CZ-CB 4.05Å; F273-V288 HydrophobicContact CZ-CG2 3.53Å; V288-L291 WeakPolarHBondContact O-CB 3.31Å; V288-L291 PolarHBondContact O-N 3.47Å; V288-Y292 PolarHBondContact O-N 3Å
289	W	74.8	Confident	64.3	Low	77 Å²	77	48.3 Å²	48.3	29%	0.292	27%	0.267	S	S	.	.	H	α-helix	trans	-68.7	-43.4	177.1	-65.2	126.7	0	0	0	114.1	T287 L291 Y292 W293 W328 L329 Q333	T287-W289 PolarHBondContact O-N 3.32Å; W289-L291 VanDerWaalsContact C-N 3.32Å; W289-Y292 HydrophobicContact CE3-CD1 4.02Å; W289-Y292 AromaticContact CZ3-CD1 3.97Å; W289-Y292 HydrophobicContact CZ3-CD1 3.97Å; W289-Y292 HydrophobicContact CZ3-CE1 4.35Å; W289-Y292 VanDerWaalsContact O-CB 3.28Å; W289-Y292 WeakPolarHBondContact O-CB 3.24Å; W289-Y292 PolarHBondContact O-N 3.14Å; W289-W293 VanDerWaalsContact O-CD1 3.25Å; W289-W293 PolarHBondContact O-N 3.11Å; W289-W328 HydrophobicContact CH2-CH2 4.4Å; W289-W328 HydrophobicContact CH2-CZ3 4.31Å; W289-W328 HydrophobicContact CZ3-CZ3 4.26Å; W289-L329 HydrophobicContact CE3-CD2 3.94Å; W289-L329 HydrophobicContact CZ3-CD2 3.68Å; W289-Q333 VanDerWaalsContact CB-NE2 3.25Å; W289-Q333 HydrophobicContact CD2-CG 4.42Å; W289-Q333 VanDerWaalsContact CD2-NE2 3.28Å; W289-Q333 HydrophobicContact CG-CG 4.44Å; W289-Q333 VanDerWaalsContact CG-NE2 3.33Å
290	S	73.4	Confident	66.4	Low	9 Å²	9	40.8 Å²	40.8	6%	0.063	23%	0.228	C	C	.	.	H	α-helix	trans	-62.2	-41.9	171.9	66.9	0	0	0	0	111	L286 T287 Y292 W293 N294 F347	L286-S290 VanDerWaalsContact CA-OG 3.23Å; L286-S290 WeakPolarHBondContact CA-OG 3.34Å; L286-S290 WeakPolarHBondContact CD2-OG 3.18Å; T287-S290 PolarHBondContact N-OG 3.24Å; T287-S290 PolarHBondContact O-N 3.27Å; T287-S290 PolarHBondContact O-OG 3.36Å; T287-S290 PolarHBondContact OG1-N 3.13Å; S290-Y292 VanDerWaalsContact C-N 3.28Å; S290-Y292 PolarHBondContact O-N 3.08Å; S290-W293 PolarHBondContact O-N 3.18Å; S290-N294 PolarHBondContact O-N 2.81Å; S290-F347 WeakPolarHBondContact O-CE1 3.33Å; S290-F347 WeakPolarHBondContact O-CZ 3.24Å
291	L	76.9	Confident	68.2	Low	3 Å²	3	36.9 Å²	36.9	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-58	-43.3	173.6	-170.4	73.1	0	0	0	111.4	I205 L206 F269 F273 T287 V288 W289 N294 V295	I205-L291 HydrophobicContact CG2-CD2 3.76Å; I205-L291 HydrophobicContact CG2-CG 4.19Å; L206-L291 HydrophobicContact CD1-CD1 4.19Å; L206-L291 HydrophobicContact CD1-CD2 4Å; F269-L291 HydrophobicContact CD1-CD2 4.27Å; F269-L291 HydrophobicContact CE1-CD2 3.86Å; F273-L291 HydrophobicContact CZ-CB 4.47Å; F273-L291 HydrophobicContact CZ-CD2 4.01Å; T287-L291 PolarHBondContact O-N 3.35Å; T287-L291 VanDerWaalsContact O-N 3.08Å; V288-L291 WeakPolarHBondContact O-CB 3.31Å; V288-L291 PolarHBondContact O-N 3.47Å; W289-L291 VanDerWaalsContact C-N 3.32Å; L291-N294 PolarHBondContact O-N 3.23Å; L291-V295 VanDerWaalsContact O-CG2 3.31Å; L291-V295 WeakPolarHBondContact O-CG2 3.4Å; L291-V295 PolarHBondContact O-N 3.13Å
292	Y	81.9	Confident	70.1	Confident	1 Å²	1	31.9 Å²	31.9	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-56.6	-54.2	175.7	-157.7	155.9	0	0	0	111.3	F241 H242 M245 V288 W289 S290 N294 V295 L296 I325 L329	F241-Y292 AromaticContact CD1-CE2 3.92Å; F241-Y292 HydrophobicContact CD1-CE2 3.92Å; F241-Y292 AromaticContact CE1-CD2 3.7Å; F241-Y292 HydrophobicContact CE1-CD2 3.7Å; F241-Y292 AromaticContact CE1-CE2 3.43Å; F241-Y292 HydrophobicContact CE1-CE2 3.43Å; F241-Y292 VanDerWaalsContact CE1-CE2 3.43Å; F241-Y292 HydrophobicContact CZ-CD2 4.25Å; F241-Y292 HydrophobicContact CZ-CE2 4.32Å; H242-Y292 WeakPolarHBondContact CA-OH 3.32Å; H242-Y292 WeakPolarHBondContact CB-OH 3.1Å; H242-Y292 VanDerWaalsContact CG-OH 3.31Å; H242-Y292 AromaticContact ND1-CZ 3.92Å; H242-Y292 PolarHBondContact ND1-OH 3.44Å; M245-Y292 HydrophobicContact CB-CD1 3.52Å; M245-Y292 HydrophobicContact CB-CD2 4.39Å; M245-Y292 HydrophobicContact CB-CE1 3.33Å; M245-Y292 HydrophobicContact CB-CE2 4.28Å; M245-Y292 HydrophobicContact CB-CG 4.06Å; M245-Y292 HydrophobicContact CE-CD1 4.09Å; M245-Y292 HydrophobicContact CE-CD2 4.41Å; M245-Y292 HydrophobicContact CE-CG 3.78Å; M245-Y292 HydrophobicContact CG-CD1 3.87Å; M245-Y292 HydrophobicContact CG-CD2 3.85Å; M245-Y292 HydrophobicContact CG-CE1 3.86Å; M245-Y292 HydrophobicContact CG-CE2 3.88Å; M245-Y292 HydrophobicContact CG-CG 3.87Å; V288-Y292 PolarHBondContact O-N 3Å; W289-Y292 HydrophobicContact CE3-CD1 4.02Å; W289-Y292 AromaticContact CZ3-CD1 3.97Å; W289-Y292 HydrophobicContact CZ3-CD1 3.97Å; W289-Y292 HydrophobicContact CZ3-CE1 4.35Å; W289-Y292 VanDerWaalsContact O-CB 3.28Å; W289-Y292 WeakPolarHBondContact O-CB 3.24Å; W289-Y292 PolarHBondContact O-N 3.14Å; S290-Y292 VanDerWaalsContact C-N 3.28Å; S290-Y292 PolarHBondContact O-N 3.08Å; Y292-N294 VanDerWaalsContact C-N 3.31Å; Y292-N294 PolarHBondContact O-N 2.63Å; Y292-V295 PolarHBondContact O-N 3.48Å; Y292-L296 HydrophobicContact CD2-CB 4.49Å; Y292-L296 VanDerWaalsContact O-CB 3.31Å; Y292-L296 WeakPolarHBondContact O-CB 3.43Å; Y292-L296 PolarHBondContact O-N 3.13Å; Y292-I325 HydrophobicContact CE2-CG2 4.45Å; Y292-I325 VanDerWaalsContact OH-CG2 3.29Å; Y292-I325 WeakPolarHBondContact OH-CG2 2.91Å; Y292-L329 HydrophobicContact CD1-CD1 4.36Å; Y292-L329 HydrophobicContact CD1-CD2 3.68Å; Y292-L329 HydrophobicContact CD2-CD1 4.13Å; Y292-L329 HydrophobicContact CE1-CD1 4.18Å; Y292-L329 HydrophobicContact CE1-CD2 3.57Å; Y292-L329 HydrophobicContact CE1-CG 4.32Å; Y292-L329 HydrophobicContact CE2-CD1 3.89Å; Y292-L329 HydrophobicContact CG-CD1 4.34Å; Y292-L329 HydrophobicContact CG-CD2 4.35Å
293	W	81.5	Confident	71.9	Confident	2 Å²	2	25 Å²	25	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-57.6	-42.3	-178.7	-80.3	117.3	0	0	0	112.8	W289 S290 L296 A297 V326 L329 I330 F347 C348 L352 L355	W289-W293 VanDerWaalsContact O-CD1 3.25Å; W289-W293 PolarHBondContact O-N 3.11Å; S290-W293 PolarHBondContact O-N 3.18Å; W293-L296 HydrophobicContact CE3-CD2 4.3Å; W293-L296 HydrophobicContact CZ3-CD2 4.24Å; W293-L296 PolarHBondContact O-N 3.34Å; W293-A297 WeakPolarHBondContact O-CB 3.32Å; W293-A297 PolarHBondContact O-N 2.8Å; W293-V326 HydrophobicContact CH2-CG1 3.82Å; W293-V326 HydrophobicContact CZ3-CG1 3.99Å; W293-L329 HydrophobicContact CH2-CB 4.1Å; W293-L329 HydrophobicContact CH2-CD1 4.37Å; W293-L329 HydrophobicContact CZ2-CB 3.7Å; W293-L329 HydrophobicContact CZ2-CD1 4.31Å; W293-I330 HydrophobicContact CH2-CD1 4.35Å; W293-I330 HydrophobicContact CH2-CG1 3.93Å; W293-I330 HydrophobicContact CZ2-CG1 4.02Å; W293-F347 HydrophobicContact CB-CD1 4.09Å; W293-F347 HydrophobicContact CB-CE1 3.97Å; W293-C348 HydrophobicContact CD2-CB 4.43Å; W293-C348 HydrophobicContact CG-CB 4.48Å; W293-C348 WeakPolarHBondContact CZ2-SG 2.94Å; W293-L352 HydrophobicContact CH2-CD1 4.45Å; W293-L352 HydrophobicContact CH2-CD2 3.96Å; W293-L352 HydrophobicContact CH2-CG 4.22Å; W293-L352 HydrophobicContact CZ3-CD2 3.6Å; W293-L352 HydrophobicContact CZ3-CG 3.9Å; W293-L355 HydrophobicContact CZ3-CD1 4.34Å
294	N	78.3	Confident	73.4	Confident	12 Å²	12	23.6 Å²	23.6	6%	0.064	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-50.4	178.3	-95.6	2	0	0	0	112.4	G209 S290 L291 Y292 L296 A297 Y298 F347	G209-N294 PolarHBondContact O-ND2 2.93Å; S290-N294 PolarHBondContact O-N 2.81Å; L291-N294 PolarHBondContact O-N 3.23Å; Y292-N294 VanDerWaalsContact C-N 3.31Å; Y292-N294 PolarHBondContact O-N 2.63Å; N294-L296 VanDerWaalsContact C-N 3.27Å; N294-L296 PolarHBondContact O-N 3.35Å; N294-A297 PolarHBondContact O-N 3.17Å; N294-Y298 VanDerWaalsContact O-CB 3.29Å; N294-Y298 WeakPolarHBondContact O-CB 3.48Å; N294-Y298 PolarHBondContact O-N 3.22Å; N294-F347 HydrophobicContact CB-CE1 4.25Å; N294-F347 HydrophobicContact CB-CZ 4.11Å; N294-F347 WeakPolarHBondContact ND2-CZ 3.47Å; N294-F347 VanDerWaalsContact OD1-CE1 3.25Å; N294-F347 WeakPolarHBondContact OD1-CE1 3.31Å; N294-F347 WeakPolarHBondContact OD1-CZ 3.31Å
295	V	82.4	Confident	75.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.8	-36.3	-178.5	179.5	0	0	0	0	110.5	I205 W223 F241 L291 Y292 Y298 T299	I205-V295 HydrophobicContact CB-CG2 4.48Å; I205-V295 HydrophobicContact CG1-CG1 4.29Å; I205-V295 HydrophobicContact CG2-CG2 4.17Å; I205-V295 WeakPolarHBondContact O-CG2 3.46Å; W223-V295 HydrophobicContact CH2-CG1 3.7Å; W223-V295 HydrophobicContact CZ2-CG1 4.01Å; F241-V295 HydrophobicContact CE1-CG1 4.42Å; F241-V295 HydrophobicContact CE2-CG1 3.71Å; F241-V295 HydrophobicContact CZ-CB 3.86Å; F241-V295 HydrophobicContact CZ-CG1 3.43Å; F241-V295 VanDerWaalsContact CZ-CG1 3.43Å; L291-V295 VanDerWaalsContact O-CG2 3.31Å; L291-V295 WeakPolarHBondContact O-CG2 3.4Å; L291-V295 PolarHBondContact O-N 3.13Å; Y292-V295 PolarHBondContact O-N 3.48Å; V295-Y298 PolarHBondContact O-N 3.4Å; V295-T299 HydrophobicContact CG1-CG2 3.85Å; V295-T299 WeakPolarHBondContact O-CB 3.33Å; V295-T299 VanDerWaalsContact O-CG2 3.24Å; V295-T299 WeakPolarHBondContact O-CG2 3.46Å; V295-T299 PolarHBondContact O-N 2.85Å; V295-T299 PolarHBondContact O-OG1 3.18Å
296	L	82.6	Confident	76.5	Confident	4 Å²	4	20 Å²	20	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-62.3	-47.7	174.8	-171	68.1	0	0	0	111.3	F238 F241 Y292 W293 N294 Y298 T299 T300 V326 L329 L355	F238-L296 HydrophobicContact CD1-CD1 4.2Å; F238-L296 HydrophobicContact CE1-CD1 4.08Å; F241-L296 HydrophobicContact CD1-CD1 4.47Å; F241-L296 HydrophobicContact CE1-CD1 4.39Å; Y292-L296 HydrophobicContact CD2-CB 4.49Å; Y292-L296 VanDerWaalsContact O-CB 3.31Å; Y292-L296 WeakPolarHBondContact O-CB 3.43Å; Y292-L296 PolarHBondContact O-N 3.13Å; W293-L296 HydrophobicContact CE3-CD2 4.3Å; W293-L296 HydrophobicContact CZ3-CD2 4.24Å; W293-L296 PolarHBondContact O-N 3.34Å; N294-L296 VanDerWaalsContact C-N 3.27Å; N294-L296 PolarHBondContact O-N 3.35Å; L296-Y298 VanDerWaalsContact C-N 3.27Å; L296-Y298 PolarHBondContact O-N 3.42Å; L296-T299 PolarHBondContact O-OG1 3.04Å; L296-T300 WeakPolarHBondContact O-CB 3.46Å; L296-T300 PolarHBondContact O-N 2.89Å; L296-T300 VanDerWaalsContact O-N 3.12Å; L296-T300 PolarHBondContact O-OG1 3.11Å; L296-V326 HydrophobicContact CD2-CG2 3.78Å; L296-L329 HydrophobicContact CD2-CD1 4.22Å; L296-L355 HydrophobicContact CD2-CD1 4.1Å; L296-L355 HydrophobicContact CG-CD1 4.25Å; L296-L355 HydrophobicContact CG-CD2 4.49Å
297	A	78.5	Confident	77.4	Confident	6 Å²	6	18.4 Å²	18.4	5%	0.05	10%	0.095	C	C	.	.	H	α-helix	trans	-63.1	-33.1	175.6	0	0	0	0	0	112.9	W293 N294 P301 R354 L355	W293-A297 WeakPolarHBondContact O-CB 3.32Å; W293-A297 PolarHBondContact O-N 2.8Å; N294-A297 PolarHBondContact O-N 3.17Å; A297-P301 VanDerWaalsContact O-CD 3.28Å; A297-P301 WeakPolarHBondContact O-CD 3.44Å; A297-R354 HydrophobicContact CB-CB 4.29Å; A297-L355 HydrophobicContact CB-CD2 4.41Å; A297-L355 HydrophobicContact CB-CG 4.04Å
298	Y	78.4	Confident	77.6	Confident	24 Å²	24	19.6 Å²	19.6	9%	0.094	10%	0.099	C	C	.	.	H	α-helix	trans	-73.1	-45.5	178.9	-170.8	-96.1	0	0	0	113	R215 D219 W223 N294 V295 L296 P301 I302	R215-Y298 HydrophobicContact CG-CE2 3.76Å; D219-Y298 WeakPolarHBondContact OD2-CE1 3.48Å; D219-Y298 PolarHBondContact OD2-OH 3.45Å; W223-Y298 AromaticContact CD1-CE1 3.71Å; W223-Y298 AromaticContact NE1-CD1 3.86Å; W223-Y298 AromaticContact NE1-CE1 3.55Å; N294-Y298 VanDerWaalsContact O-CB 3.29Å; N294-Y298 WeakPolarHBondContact O-CB 3.48Å; N294-Y298 PolarHBondContact O-N 3.22Å; V295-Y298 PolarHBondContact O-N 3.4Å; L296-Y298 VanDerWaalsContact C-N 3.27Å; L296-Y298 PolarHBondContact O-N 3.42Å; Y298-P301 WeakPolarHBondContact O-CD 3.47Å; Y298-I302 HydrophobicContact CD1-CD1 4.07Å; Y298-I302 HydrophobicContact CE1-CD1 3.81Å
299	T	80.7	Confident	77.7	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-84.7	-27.3	-171.1	55.4	0	0	0	0	113.6	W223 M227 V295 L296 I302 Y303	W223-T299 HydrophobicContact CD2-CG2 3.61Å; W223-T299 HydrophobicContact CE3-CG2 3.51Å; W223-T299 HydrophobicContact CG-CG2 4.4Å; W223-T299 HydrophobicContact CH2-CG2 3.62Å; W223-T299 HydrophobicContact CZ2-CG2 3.72Å; W223-T299 HydrophobicContact CZ3-CG2 3.51Å; M227-T299 HydrophobicContact CE-CG2 4.26Å; M227-T299 WeakPolarHBondContact CE-O 3.29Å; V295-T299 HydrophobicContact CG1-CG2 3.85Å; V295-T299 WeakPolarHBondContact O-CB 3.33Å; V295-T299 VanDerWaalsContact O-CG2 3.24Å; V295-T299 WeakPolarHBondContact O-CG2 3.46Å; V295-T299 PolarHBondContact O-N 2.85Å; V295-T299 PolarHBondContact O-OG1 3.18Å; L296-T299 PolarHBondContact O-OG1 3.04Å; T299-I302 WeakPolarHBondContact O-CB 3.34Å; T299-I302 PolarHBondContact O-N 3.28Å; T299-I302 VanDerWaalsContact O-N 3.1Å; T299-Y303 PolarHBondContact O-N 3.5Å
300	T	78.4	Confident	77.6	Confident	8 Å²	8	21.8 Å²	21.8	5%	0.049	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-45.9	-177.5	-63.9	0	0	0	0	114	F238 L296 I302 Y303 S304 L355 C359	F238-T300 HydrophobicContact CZ-CG2 4.42Å; L296-T300 WeakPolarHBondContact O-CB 3.46Å; L296-T300 PolarHBondContact O-N 2.89Å; L296-T300 VanDerWaalsContact O-N 3.12Å; L296-T300 PolarHBondContact O-OG1 3.11Å; T300-I302 VanDerWaalsContact C-N 3.28Å; T300-I302 PolarHBondContact O-N 2.96Å; T300-Y303 PolarHBondContact O-N 3.48Å; T300-S304 PolarHBondContact O-N 3.49Å; T300-L355 VanDerWaalsContact CB-CD2 3.47Å; T300-L355 HydrophobicContact CG2-CD2 3.79Å; T300-L355 VanDerWaalsContact OG1-CD2 3.24Å; T300-L355 WeakPolarHBondContact OG1-CD2 3.43Å; T300-C359 WeakPolarHBondContact CG2-SG 3.18Å
301	P	77.2	Confident	77.2	Confident	8 Å²	8	25.8 Å²	25.8	5%	0.052	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-39	174.4	-23.4	34.8	0	0	0	112.5	A297 Y298 S304 L305 T358	A297-P301 VanDerWaalsContact O-CD 3.28Å; A297-P301 WeakPolarHBondContact O-CD 3.44Å; Y298-P301 WeakPolarHBondContact O-CD 3.47Å; P301-S304 PolarHBondContact O-N 2.93Å; P301-S304 PolarHBondContact O-OG 2.95Å; P301-L305 PolarHBondContact O-N 2.94Å; P301-T358 HydrophobicContact CB-CG2 3.89Å; P301-T358 HydrophobicContact CG-CG2 3.56Å
302	I	78.7	Confident	76.2	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-44.6	179.7	-53.5	177.1	0	0	0	110.1	T220 W223 V224 M227 Y298 T299 T300 S304 L305 Y306	T220-I302 HydrophobicContact CG2-CD1 3.98Å; T220-I302 HydrophobicContact CG2-CG1 3.94Å; T220-I302 HydrophobicContact CG2-CG2 3.95Å; W223-I302 HydrophobicContact CB-CD1 4.03Å; W223-I302 HydrophobicContact CB-CG2 4.03Å; W223-I302 HydrophobicContact CG-CD1 4.15Å; V224-I302 HydrophobicContact CG2-CG2 3.4Å; V224-I302 VanDerWaalsContact CG2-CG2 3.4Å; M227-I302 HydrophobicContact CE-CB 4.19Å; M227-I302 HydrophobicContact CE-CG2 4.29Å; M227-I302 HydrophobicContact SD-CB 4.48Å; M227-I302 HydrophobicContact SD-CG2 4.12Å; Y298-I302 HydrophobicContact CD1-CD1 4.07Å; Y298-I302 HydrophobicContact CE1-CD1 3.81Å; T299-I302 WeakPolarHBondContact O-CB 3.34Å; T299-I302 PolarHBondContact O-N 3.28Å; T299-I302 VanDerWaalsContact O-N 3.1Å; T300-I302 VanDerWaalsContact C-N 3.28Å; T300-I302 PolarHBondContact O-N 2.96Å; I302-S304 VanDerWaalsContact C-N 3.3Å; I302-S304 PolarHBondContact O-N 3.5Å; I302-L305 WeakPolarHBondContact O-CB 3.29Å; I302-L305 PolarHBondContact O-N 2.69Å; I302-Y306 PolarHBondContact O-N 3.26Å; I302-Y306 VanDerWaalsContact O-N 3.11Å
303	Y	79.8	Confident	74.7	Confident	35 Å²	35	38.1 Å²	38.1	14%	0.137	20%	0.201	C	C	.	.	H	α-helix	trans	-62.3	-37.6	175.3	-177.2	-100.3	0	0	0	112.1	M227 E231 W237 F238 T299 T300 L305 Y306 A307	M227-Y303 HydrophobicContact CG-CD2 4.25Å; M227-Y303 VanDerWaalsContact SD-CA 3.52Å; M227-Y303 HydrophobicContact SD-CD2 3.92Å; M227-Y303 HydrophobicContact SD-CG 4.34Å; E231-Y303 HydrophobicContact CG-CE2 4.17Å; E231-Y303 VanDerWaalsContact OE1-CE2 3.23Å; E231-Y303 WeakPolarHBondContact OE1-CE2 3.48Å; E231-Y303 PolarHBondContact OE1-OH 3.32Å; W237-Y303 HydrophobicContact CB-CD2 3.87Å; W237-Y303 HydrophobicContact CB-CE2 3.49Å; W237-Y303 VanDerWaalsContact CB-CE2 3.49Å; W237-Y303 AromaticContact CD1-CD2 3.71Å; W237-Y303 AromaticContact CG-CD2 3.9Å; W237-Y303 HydrophobicContact CG-CD2 3.9Å; W237-Y303 HydrophobicContact CG-CE2 4.06Å; F238-Y303 HydrophobicContact CD2-CD1 4.33Å; F238-Y303 HydrophobicContact CD2-CE1 4.09Å; F238-Y303 AromaticContact CE2-CD1 3.43Å; F238-Y303 HydrophobicContact CE2-CD1 3.43Å; F238-Y303 VanDerWaalsContact CE2-CD1 3.43Å; F238-Y303 AromaticContact CE2-CE1 3.52Å; F238-Y303 HydrophobicContact CE2-CE1 3.52Å; F238-Y303 HydrophobicContact CE2-CG 4.16Å; F238-Y303 AromaticContact CZ-CD1 3.87Å; F238-Y303 HydrophobicContact CZ-CD1 3.87Å; F238-Y303 HydrophobicContact CZ-CE1 4.41Å; F238-Y303 HydrophobicContact CZ-CG 4.32Å; T299-Y303 PolarHBondContact O-N 3.5Å; T300-Y303 PolarHBondContact O-N 3.48Å; Y303-L305 VanDerWaalsContact C-N 3.33Å; Y303-L305 PolarHBondContact O-N 3.26Å; Y303-Y306 HydrophobicContact CD2-CD1 4.41Å; Y303-Y306 HydrophobicContact CE2-CD1 4.3Å; Y303-Y306 PolarHBondContact O-N 3.41Å; Y303-A307 HydrophobicContact CE1-CB 4.2Å; Y303-A307 WeakPolarHBondContact O-CB 3.49Å; Y303-A307 PolarHBondContact O-N 3.19Å
304	S	75	Confident	73.3	Confident	25 Å²	25	47 Å²	47	18%	0.175	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-42.2	176.7	71.1	0	0	0	0	112.1	T300 P301 I302 Y306 A307 D308	T300-S304 PolarHBondContact O-N 3.49Å; P301-S304 PolarHBondContact O-N 2.93Å; P301-S304 PolarHBondContact O-OG 2.95Å; I302-S304 VanDerWaalsContact C-N 3.3Å; I302-S304 PolarHBondContact O-N 3.5Å; S304-Y306 VanDerWaalsContact C-N 3.34Å; S304-Y306 PolarHBondContact O-N 3.42Å; S304-A307 PolarHBondContact O-N 2.73Å; S304-D308 WeakPolarHBondContact O-CB 3.5Å; S304-D308 VanDerWaalsContact O-CG 3.31Å; S304-D308 PolarHBondContact O-N 3.19Å
305	L	75.3	Confident	72	Confident	82 Å²	82	48.7 Å²	48.7	43%	0.429	25%	0.251	S	S	.	.	H	α-helix	trans	-60.5	-44.1	174	-66.4	169.2	0	0	0	111.5	I55 P301 I302 Y303 H309	I55-L305 HydrophobicContact CD1-CB 4.05Å; I55-L305 WeakPolarHBondContact CD1-O 3.48Å; I55-L305 HydrophobicContact CG1-CB 4.13Å; P301-L305 PolarHBondContact O-N 2.94Å; I302-L305 WeakPolarHBondContact O-CB 3.29Å; I302-L305 PolarHBondContact O-N 2.69Å; Y303-L305 VanDerWaalsContact C-N 3.33Å; Y303-L305 PolarHBondContact O-N 3.26Å; L305-H309 PolarHBondContact O-N 3.35Å
306	Y	78.2	Confident	70.6	Confident	15 Å²	15	50.8 Å²	50.8	6%	0.059	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-46.2	178	172.9	-95.9	0	0	0	112.4	L58 V224 H228 E231 I302 Y303 S304 H309 T310	L58-Y306 HydrophobicContact CD2-CD2 3.65Å; L58-Y306 HydrophobicContact CD2-CE2 3.52Å; V224-Y306 HydrophobicContact CG1-CD2 4.1Å; H228-Y306 WeakPolarHBondContact CA-OH 3.3Å; H228-Y306 HydrophobicContact CB-CE2 3.64Å; H228-Y306 AromaticContact ND1-CE2 3.74Å; H228-Y306 AromaticContact ND1-CZ 3.97Å; H228-Y306 PolarHBondContact ND1-OH 2.89Å; E231-Y306 HydrophobicContact CB-CE1 4.15Å; E231-Y306 HydrophobicContact CG-CE1 3.92Å; I302-Y306 PolarHBondContact O-N 3.26Å; I302-Y306 VanDerWaalsContact O-N 3.11Å; Y303-Y306 HydrophobicContact CD2-CD1 4.41Å; Y303-Y306 HydrophobicContact CE2-CD1 4.3Å; Y303-Y306 PolarHBondContact O-N 3.41Å; S304-Y306 VanDerWaalsContact C-N 3.34Å; S304-Y306 PolarHBondContact O-N 3.42Å; Y306-H309 PolarHBondContact O-N 3.26Å; Y306-T310 HydrophobicContact CD2-CG2 4.34Å; Y306-T310 HydrophobicContact CE1-CG2 4Å; Y306-T310 HydrophobicContact CE2-CG2 3.79Å; Y306-T310 PolarHBondContact O-N 2.76Å; Y306-T310 PolarHBondContact O-OG1 2.82Å
307	A	75.1	Confident	69.3	Low	5 Å²	5	57 Å²	57	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-64.3	-40.7	180	0	0	0	0	0	111.9	Y303 S304 H309 T310 N311	Y303-A307 HydrophobicContact CE1-CB 4.2Å; Y303-A307 WeakPolarHBondContact O-CB 3.49Å; Y303-A307 PolarHBondContact O-N 3.19Å; S304-A307 PolarHBondContact O-N 2.73Å; A307-H309 VanDerWaalsContact C-N 3.31Å; A307-H309 PolarHBondContact O-N 3.44Å; A307-T310 WeakPolarHBondContact CA-OG1 3.43Å; A307-T310 PolarHBondContact O-N 3.48Å; A307-T310 PolarHBondContact O-OG1 3.28Å; A307-N311 WeakPolarHBondContact O-CB 3.48Å; A307-N311 PolarHBondContact O-N 3.47Å
308	D	71.2	Confident	68.1	Low	67 Å²	67	57.6 Å²	57.6	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-64.2	-36.8	176.6	-76	-12.2	0	0	0	111.7	S304	S304-D308 WeakPolarHBondContact O-CB 3.5Å; S304-D308 VanDerWaalsContact O-CG 3.31Å; S304-D308 PolarHBondContact O-N 3.19Å
309	H	72.7	Confident	67.3	Low	87 Å²	87	58.7 Å²	58.7	40%	0.403	32%	0.321	S	S	.	.	H	α-helix	trans	-67.6	-42.1	175	-176.1	60	0	0	0	112.9	I55 L305 Y306 A307	I55-H309 HydrophobicContact CD1-CB 4.1Å; I55-H309 HydrophobicContact CG1-CB 4.45Å; I55-H309 HydrophobicContact CG2-CB 3.55Å; I55-H309 WeakPolarHBondContact CG2-ND1 3.2Å; L305-H309 PolarHBondContact O-N 3.35Å; Y306-H309 PolarHBondContact O-N 3.26Å; A307-H309 VanDerWaalsContact C-N 3.31Å; A307-H309 PolarHBondContact O-N 3.44Å
310	T	72.4	Confident	66.1	Low	62 Å²	62	63.7 Å²	63.7	38%	0.38	35%	0.347	S	S	.	.	H	α-helix	trans	-82	-38.6	-173.2	45.7	0	0	0	0	113.8	Y306 A307	Y306-T310 HydrophobicContact CD2-CG2 4.34Å; Y306-T310 HydrophobicContact CE1-CG2 4Å; Y306-T310 HydrophobicContact CE2-CG2 3.79Å; Y306-T310 PolarHBondContact O-N 2.76Å; Y306-T310 PolarHBondContact O-OG1 2.82Å; A307-T310 WeakPolarHBondContact CA-OG1 3.43Å; A307-T310 PolarHBondContact O-N 3.48Å; A307-T310 PolarHBondContact O-OG1 3.28Å
311	N	66.3	Low	65.3	Low	94 Å²	94	71.3 Å²	71.3	50%	0.503	38%	0.382	S	S	.	.	H	α-helix	trans	-91.3	-9.5	-172.8	-70.9	-35.7	0	0	0	114.3	A307 S313	A307-N311 WeakPolarHBondContact O-CB 3.48Å; A307-N311 PolarHBondContact O-N 3.47Å; N311-S313 PolarHBondContact O-N 3.22Å; N311-S313 PolarHBondContact O-OG 3.4Å
312	Q	54.9	Low	64.7	Low	191 Å²	191	72.5 Å²	72.5	89%	0.893	39%	0.386	S	S	*	.	S	Bend	trans	52.7	-12.1	-173.1	-66.4	-172.9	-1.6	0	0	116.4
313	S	51.1	Low	64.4	Low	72 Å²	72	72.8 Å²	72.8	50%	0.503	39%	0.387	S	S	.	.	S	Bend	trans	-102.8	121.5	170.4	61.7	0	0	0	0	109	N311 V315	N311-S313 PolarHBondContact O-N 3.22Å; N311-S313 PolarHBondContact O-OG 3.4Å; S313-V315 PolarHBondContact O-N 2.88Å
314	K	51.4	Low	64.1	Low	187 Å²	187	74.2 Å²	74.2	81%	0.813	40%	0.402	S	S	*	.			trans	-54.3	113.8	168.6	-79.5	-176.3	174.9	-178.7	0	108.7	G316	K314-G316 PolarHBondContact O-N 3.33Å
315	V	50.9	Low	64.2	Low	49 Å²	49	73.7 Å²	73.7	30%	0.297	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-68.4	121.9	175.4	-179.7	0	0	0	0	107.5	S313 T319	S313-V315 PolarHBondContact O-N 2.88Å; V315-T319 HydrophobicContact CG1-CG2 4.42Å
316	G	53.2	Low	64.5	Low	44 Å²	44	70 Å²	70	45%	0.454	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-49.7	141.3	-176.8	0	0	0	0	0	113.5	K314 T319	K314-G316 PolarHBondContact O-N 3.33Å; G316-T319 WeakPolarHBondContact O-CG2 3.28Å
317	L	55.7	Low	64.6	Low	134 Å²	134	69.8 Å²	69.8	70%	0.702	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	140.6	170.2	-71.3	154.4	0	0	0	109.1	T319 T358 C359	L317-T319 PolarHBondContact O-N 2.95Å; L317-T358 WeakPolarHBondContact CD2-O 3.48Å; L317-C359 CarbonylContact C-O 3.52Å; L317-C359 WeakPolarHBondContact CA-O 3.34Å; L317-C359 VanDerWaalsContact CD2-C 3.42Å; L317-C359 WeakPolarHBondContact CD2-O 3.48Å
318	G	53.7	Low	64.8	Low	18 Å²	18	73.6 Å²	73.6	19%	0.186	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	7.7	173	0	0	0	0	0	116.7	L320 C359 N362	G318-L320 PolarHBondContact O-N 3.49Å; G318-C359 PolarHBondContact N-O 3.45Å; G318-N362 PolarHBondContact O-ND2 3.36Å
319	T	60.9	Low	65.3	Low	48 Å²	48	70.4 Å²	70.4	29%	0.294	38%	0.375	S	S	.	.			trans	-60.9	130.5	-179.4	53.6	0	0	0	0	112.9	V315 G316 L317 Q321 K322	V315-T319 HydrophobicContact CG1-CG2 4.42Å; G316-T319 WeakPolarHBondContact O-CG2 3.28Å; L317-T319 PolarHBondContact O-N 2.95Å; T319-Q321 PolarHBondContact O-N 2.95Å; T319-Q321 VanDerWaalsContact O-N 3.08Å; T319-K322 PolarHBondContact O-N 3.3Å
320	L	56	Low	65.7	Low	104 Å²	104	66.2 Å²	66.2	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-53.8	-32.3	-177.8	-164.7	85.1	0	0	0	113.4	G318 K322 Y323 S324 E364	G318-L320 PolarHBondContact O-N 3.49Å; L320-K322 VanDerWaalsContact C-N 3.28Å; L320-K322 PolarHBondContact O-N 3.43Å; L320-Y323 CarbonylContact O-C 3.35Å; L320-Y323 PolarHBondContact O-N 3.1Å; L320-S324 PolarHBondContact O-N 3.28Å; L320-E364 HydrophobicContact CD1-CB 3.93Å; L320-E364 HydrophobicContact CD1-CG 4.36Å
321	Q	62.2	Low	66	Low	169 Å²	169	69 Å²	69	79%	0.79	36%	0.359	S	S	*	.	H	α-helix	trans	-55.5	-42.6	178.1	-72.8	-178.2	-9.6	0	0	112	T319 Y323 S324	T319-Q321 PolarHBondContact O-N 2.95Å; T319-Q321 VanDerWaalsContact O-N 3.08Å; Q321-Y323 VanDerWaalsContact C-N 3.34Å; Q321-Y323 PolarHBondContact O-N 3.29Å; Q321-S324 PolarHBondContact O-OG 3.5Å
322	K	64.9	Low	66.5	Low	33 Å²	33	69.5 Å²	69.5	14%	0.143	36%	0.358	C	S	.	.	H	α-helix	trans	-67.6	-33	177.6	-65.9	-178.4	-180	174.9	0	112.6	F238 T319 L320	F238-K322 HydrophobicContact CE2-CG 4.5Å; T319-K322 PolarHBondContact O-N 3.3Å; L320-K322 VanDerWaalsContact C-N 3.28Å; L320-K322 PolarHBondContact O-N 3.43Å
323	Y	72.1	Confident	67.6	Low	8 Å²	8	61.6 Å²	61.6	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-95.9	-5.6	-174.7	-78.2	-76.3	0	0	0	115	L320 Q321 I325 V326 V327 C359 G360 N362 V365	L320-Y323 CarbonylContact O-C 3.35Å; L320-Y323 PolarHBondContact O-N 3.1Å; Q321-Y323 VanDerWaalsContact C-N 3.34Å; Q321-Y323 PolarHBondContact O-N 3.29Å; Y323-I325 VanDerWaalsContact C-N 3.3Å; Y323-I325 PolarHBondContact O-N 3.38Å; Y323-V326 HydrophobicContact CD1-CB 3.79Å; Y323-V326 HydrophobicContact CD1-CG1 3.88Å; Y323-V326 HydrophobicContact CD1-CG2 3.8Å; Y323-V326 HydrophobicContact CE1-CG1 4.38Å; Y323-V326 HydrophobicContact CE1-CG2 4.27Å; Y323-V326 WeakPolarHBondContact O-CA 3.49Å; Y323-V326 WeakPolarHBondContact O-CB 3.46Å; Y323-V326 PolarHBondContact O-N 3.09Å; Y323-V327 WeakPolarHBondContact O-CG2 3.45Å; Y323-V327 PolarHBondContact O-N 3.37Å; Y323-C359 HydrophobicContact CE2-CB 4.08Å; Y323-C359 WeakPolarHBondContact OH-CB 3.38Å; Y323-G360 WeakPolarHBondContact CE2-O 3.27Å; Y323-G360 PolarHBondContact OH-O 3.49Å; Y323-N362 HydrophobicContact CD2-CB 3.55Å; Y323-N362 HydrophobicContact CE2-CB 4.18Å; Y323-N362 HydrophobicContact CG-CB 3.77Å; Y323-V365 HydrophobicContact CD1-CG2 3.34Å; Y323-V365 HydrophobicContact CE1-CG2 4.07Å; Y323-V365 HydrophobicContact CG-CG2 3.83Å
324	S	73.9	Confident	68.7	Low	64 Å²	64	58.4 Å²	58.4	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-52.5	-44.1	179.4	58.8	0	0	0	0	113.6	L320 Q321 W328	L320-S324 PolarHBondContact O-N 3.28Å; Q321-S324 PolarHBondContact O-OG 3.5Å; S324-W328 WeakPolarHBondContact O-CB 3.29Å; S324-W328 PolarHBondContact O-N 3.06Å
325	I	77	Confident	69.6	Low	15 Å²	15	53 Å²	53	8%	0.077	28%	0.278	C	S	.	.	H	α-helix	trans	-71.6	-39	176.3	-70.2	153.2	0	0	0	111.6	F238 H242 Y292 Y323 V327 W328 L329	F238-I325 HydrophobicContact CB-CD1 3.55Å; F238-I325 HydrophobicContact CG-CD1 4.49Å; F238-I325 WeakPolarHBondContact O-CD1 3.37Å; H242-I325 HydrophobicContact CB-CD1 3.85Å; H242-I325 HydrophobicContact CB-CG1 4Å; H242-I325 HydrophobicContact CB-CG2 4.27Å; Y292-I325 HydrophobicContact CE2-CG2 4.45Å; Y292-I325 VanDerWaalsContact OH-CG2 3.29Å; Y292-I325 WeakPolarHBondContact OH-CG2 2.91Å; Y323-I325 VanDerWaalsContact C-N 3.3Å; Y323-I325 PolarHBondContact O-N 3.38Å; I325-V327 VanDerWaalsContact C-N 3.34Å; I325-W328 WeakPolarHBondContact O-CB 3.29Å; I325-W328 PolarHBondContact O-N 2.69Å; I325-L329 HydrophobicContact CG2-CD1 3.98Å; I325-L329 HydrophobicContact CG2-CG 4.31Å; I325-L329 WeakPolarHBondContact O-CB 3.47Å; I325-L329 WeakPolarHBondContact O-CG 3.43Å; I325-L329 PolarHBondContact O-N 3.45Å
326	V	81	Confident	70.3	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.024	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-46.9	176.5	175.6	0	0	0	0	110.2	W293 L296 Y323 W328 L329 I330 L352 V365	W293-V326 HydrophobicContact CH2-CG1 3.82Å; W293-V326 HydrophobicContact CZ3-CG1 3.99Å; L296-V326 HydrophobicContact CD2-CG2 3.78Å; Y323-V326 HydrophobicContact CD1-CB 3.79Å; Y323-V326 HydrophobicContact CD1-CG1 3.88Å; Y323-V326 HydrophobicContact CD1-CG2 3.8Å; Y323-V326 HydrophobicContact CE1-CG1 4.38Å; Y323-V326 HydrophobicContact CE1-CG2 4.27Å; Y323-V326 WeakPolarHBondContact O-CA 3.49Å; Y323-V326 WeakPolarHBondContact O-CB 3.46Å; Y323-V326 PolarHBondContact O-N 3.09Å; V326-W328 VanDerWaalsContact C-N 3.35Å; V326-W328 PolarHBondContact O-N 3.31Å; V326-L329 PolarHBondContact O-N 3.33Å; V326-I330 HydrophobicContact CG1-CD1 3.88Å; V326-I330 WeakPolarHBondContact O-CD1 3.34Å; V326-I330 VanDerWaalsContact O-CG1 3.3Å; V326-I330 WeakPolarHBondContact O-CG1 3.39Å; V326-I330 PolarHBondContact O-N 2.72Å; V326-L352 HydrophobicContact CG1-CD2 3.52Å; V326-V365 HydrophobicContact CB-CG2 4.5Å; V326-V365 HydrophobicContact CG1-CG1 4.18Å; V326-V365 HydrophobicContact CG1-CG2 3.9Å
327	V	79.2	Confident	70.6	Confident	10 Å²	10	59.9 Å²	59.9	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-44.1	175.4	170.9	0	0	0	0	110.6	Y323 I325 L329 I330 R331 E364 V365	Y323-V327 WeakPolarHBondContact O-CG2 3.45Å; Y323-V327 PolarHBondContact O-N 3.37Å; I325-V327 VanDerWaalsContact C-N 3.34Å; V327-L329 PolarHBondContact O-N 3.03Å; V327-I330 PolarHBondContact O-N 3.02Å; V327-R331 HydrophobicContact CG1-CG 4.48Å; V327-R331 WeakPolarHBondContact O-CB 3.46Å; V327-R331 VanDerWaalsContact O-CG 3.29Å; V327-R331 WeakPolarHBondContact O-CG 3.41Å; V327-R331 PolarHBondContact O-N 3.22Å; V327-E364 HydrophobicContact CG1-CG 4.11Å; V327-E364 HydrophobicContact CG2-CB 4.06Å; V327-E364 HydrophobicContact CG2-CG 3.88Å; V327-V365 HydrophobicContact CG2-CG2 3.98Å
328	W	81	Confident	70.9	Confident	85 Å²	85	59.1 Å²	59.1	32%	0.322	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-45.2	175.2	-177.6	96	0	0	0	111.9	H242 I246 W289 S324 I325 V326 I330 R331 Q332	H242-W328 AromaticContact CE1-CD2 3.64Å; H242-W328 AromaticContact CE1-CE2 3.98Å; H242-W328 AromaticContact CE1-CE3 3.38Å; H242-W328 AromaticContact CE1-CH2 3.83Å; H242-W328 AromaticContact CE1-CZ3 3.48Å; H242-W328 VanDerWaalsContact CE1-CZ3 3.48Å; H242-W328 WeakPolarHBondContact CE1-CZ3 3.5Å; I246-W328 HydrophobicContact CD1-CH2 3.86Å; I246-W328 HydrophobicContact CD1-CZ2 4.1Å; I246-W328 HydrophobicContact CG1-CH2 4.19Å; W289-W328 HydrophobicContact CH2-CH2 4.4Å; W289-W328 HydrophobicContact CH2-CZ3 4.31Å; W289-W328 HydrophobicContact CZ3-CZ3 4.26Å; S324-W328 WeakPolarHBondContact O-CB 3.29Å; S324-W328 PolarHBondContact O-N 3.06Å; I325-W328 WeakPolarHBondContact O-CB 3.29Å; I325-W328 PolarHBondContact O-N 2.69Å; V326-W328 VanDerWaalsContact C-N 3.35Å; V326-W328 PolarHBondContact O-N 3.31Å; W328-I330 PolarHBondContact O-N 3.41Å; W328-R331 PolarHBondContact O-N 3.34Å; W328-Q332 HydrophobicContact CD2-CG 3.79Å; W328-Q332 HydrophobicContact CE3-CG 3.92Å; W328-Q332 HydrophobicContact CH2-CG 3.88Å; W328-Q332 HydrophobicContact CZ2-CG 3.71Å; W328-Q332 HydrophobicContact CZ3-CB 4.47Å; W328-Q332 HydrophobicContact CZ3-CG 3.98Å; W328-Q332 WeakPolarHBondContact O-CG 3.42Å; W328-Q332 PolarHBondContact O-N 3.09Å
329	L	79.7	Confident	71.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-45.5	179.4	-77.4	169.2	0	0	0	111.6	W289 Y292 W293 L296 I325 V326 V327 R331 Q332 Q333	W289-L329 HydrophobicContact CE3-CD2 3.94Å; W289-L329 HydrophobicContact CZ3-CD2 3.68Å; Y292-L329 HydrophobicContact CD1-CD1 4.36Å; Y292-L329 HydrophobicContact CD1-CD2 3.68Å; Y292-L329 HydrophobicContact CD2-CD1 4.13Å; Y292-L329 HydrophobicContact CE1-CD1 4.18Å; Y292-L329 HydrophobicContact CE1-CD2 3.57Å; Y292-L329 HydrophobicContact CE1-CG 4.32Å; Y292-L329 HydrophobicContact CE2-CD1 3.89Å; Y292-L329 HydrophobicContact CG-CD1 4.34Å; Y292-L329 HydrophobicContact CG-CD2 4.35Å; W293-L329 HydrophobicContact CH2-CB 4.1Å; W293-L329 HydrophobicContact CH2-CD1 4.37Å; W293-L329 HydrophobicContact CZ2-CB 3.7Å; W293-L329 HydrophobicContact CZ2-CD1 4.31Å; L296-L329 HydrophobicContact CD2-CD1 4.22Å; I325-L329 HydrophobicContact CG2-CD1 3.98Å; I325-L329 HydrophobicContact CG2-CG 4.31Å; I325-L329 WeakPolarHBondContact O-CB 3.47Å; I325-L329 WeakPolarHBondContact O-CG 3.43Å; I325-L329 PolarHBondContact O-N 3.45Å; V326-L329 PolarHBondContact O-N 3.33Å; V327-L329 PolarHBondContact O-N 3.03Å; L329-R331 PolarHBondContact O-N 3.3Å; L329-Q332 PolarHBondContact O-N 2.82Å; L329-Q333 WeakPolarHBondContact O-CB 3.33Å; L329-Q333 WeakPolarHBondContact O-CG 3.44Å; L329-Q333 PolarHBondContact O-N 3.1Å
330	I	82	Confident	71.8	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.3	-46.9	177	-67.2	161.7	0	0	0	110	W293 V326 V327 W328 Q332 Q333 F334 L352 V365 L369	W293-I330 HydrophobicContact CH2-CD1 4.35Å; W293-I330 HydrophobicContact CH2-CG1 3.93Å; W293-I330 HydrophobicContact CZ2-CG1 4.02Å; V326-I330 HydrophobicContact CG1-CD1 3.88Å; V326-I330 WeakPolarHBondContact O-CD1 3.34Å; V326-I330 VanDerWaalsContact O-CG1 3.3Å; V326-I330 WeakPolarHBondContact O-CG1 3.39Å; V326-I330 PolarHBondContact O-N 2.72Å; V327-I330 PolarHBondContact O-N 3.02Å; W328-I330 PolarHBondContact O-N 3.41Å; I330-Q332 VanDerWaalsContact C-N 3.33Å; I330-Q332 PolarHBondContact O-N 3.29Å; I330-Q333 PolarHBondContact O-N 2.85Å; I330-F334 HydrophobicContact CB-CD2 4.42Å; I330-F334 HydrophobicContact CG2-CB 4.26Å; I330-F334 HydrophobicContact CG2-CD2 4.06Å; I330-F334 HydrophobicContact CG2-CG 4.25Å; I330-F334 WeakPolarHBondContact O-CA 3.43Å; I330-F334 VanDerWaalsContact O-CB 3.27Å; I330-F334 WeakPolarHBondContact O-CB 3.15Å; I330-F334 PolarHBondContact O-N 3.41Å; I330-L352 HydrophobicContact CD1-CD1 4.22Å; I330-V365 HydrophobicContact CD1-CB 4.46Å; I330-V365 HydrophobicContact CD1-CG1 3.59Å; I330-L369 HydrophobicContact CD1-CD2 4.26Å; I330-L369 HydrophobicContact CD1-CG 4.11Å; I330-L369 HydrophobicContact CG1-CD2 4.31Å; I330-L369 HydrophobicContact CG2-CD2 3.9Å; I330-L369 HydrophobicContact CG2-CG 4.23Å
331	R	79	Confident	72.5	Confident	121 Å²	121	60.2 Å²	60.2	46%	0.457	31%	0.309	S	S	.	.	H	α-helix	trans	-61.9	-39.9	179.3	-71.2	177.4	-178	-176.6	1.8	112.3	V327 W328 L329 L335 E364	V327-R331 HydrophobicContact CG1-CG 4.48Å; V327-R331 WeakPolarHBondContact O-CB 3.46Å; V327-R331 VanDerWaalsContact O-CG 3.29Å; V327-R331 WeakPolarHBondContact O-CG 3.41Å; V327-R331 PolarHBondContact O-N 3.22Å; W328-R331 PolarHBondContact O-N 3.34Å; L329-R331 PolarHBondContact O-N 3.3Å; R331-L335 HydrophobicContact CG-CD1 4.17Å; R331-L335 CarbonylContact O-C 3.57Å; R331-L335 WeakPolarHBondContact O-CB 3.2Å; R331-L335 PolarHBondContact O-N 3.33Å; R331-E364 IonicContact NH2-OE1 3.75Å; R331-E364 PolarHBondContact NH2-OE1 2.88Å
332	Q	77.3	Confident	72.9	Confident	104 Å²	104	55.1 Å²	55.1	49%	0.486	29%	0.288	S	S	.	.	H	α-helix	trans	-69.7	-42.3	178.2	-71.3	-63.8	-24.6	0	0	112.8	W328 L329 I330	W328-Q332 HydrophobicContact CD2-CG 3.79Å; W328-Q332 HydrophobicContact CE3-CG 3.92Å; W328-Q332 HydrophobicContact CH2-CG 3.88Å; W328-Q332 HydrophobicContact CZ2-CG 3.71Å; W328-Q332 HydrophobicContact CZ3-CB 4.47Å; W328-Q332 HydrophobicContact CZ3-CG 3.98Å; W328-Q332 WeakPolarHBondContact O-CG 3.42Å; W328-Q332 PolarHBondContact O-N 3.09Å; L329-Q332 PolarHBondContact O-N 2.82Å; I330-Q332 VanDerWaalsContact C-N 3.33Å; I330-Q332 PolarHBondContact O-N 3.29Å
333	Q	77.2	Confident	73	Confident	24 Å²	24	56 Å²	56	11%	0.112	30%	0.298	C	S	.	.	H	α-helix	trans	-85.2	-44.6	-174.6	-70.5	172.9	7.5	0	0	113.1	W289 L329 I330 P340	W289-Q333 VanDerWaalsContact CB-NE2 3.25Å; W289-Q333 HydrophobicContact CD2-CG 4.42Å; W289-Q333 VanDerWaalsContact CD2-NE2 3.28Å; W289-Q333 HydrophobicContact CG-CG 4.44Å; W289-Q333 VanDerWaalsContact CG-NE2 3.33Å; L329-Q333 WeakPolarHBondContact O-CB 3.33Å; L329-Q333 WeakPolarHBondContact O-CG 3.44Å; L329-Q333 PolarHBondContact O-N 3.1Å; I330-Q333 PolarHBondContact O-N 2.85Å; Q333-P340 VanDerWaalsContact O-CD 3.3Å; Q333-P340 WeakPolarHBondContact O-CD 3.38Å
334	F	74.3	Confident	73	Confident	5 Å²	5	57.8 Å²	57.8	2%	0.022	31%	0.307	C	S	.	.	H	α-helix	trans	-90.6	-26.2	-171.9	-70.5	-107.2	0	0	0	113	I330 P340 V345 C348 L369 Y372	I330-F334 HydrophobicContact CB-CD2 4.42Å; I330-F334 HydrophobicContact CG2-CB 4.26Å; I330-F334 HydrophobicContact CG2-CD2 4.06Å; I330-F334 HydrophobicContact CG2-CG 4.25Å; I330-F334 WeakPolarHBondContact O-CA 3.43Å; I330-F334 VanDerWaalsContact O-CB 3.27Å; I330-F334 WeakPolarHBondContact O-CB 3.15Å; I330-F334 PolarHBondContact O-N 3.41Å; F334-P340 HydrophobicContact CD1-CG 4.18Å; F334-P340 HydrophobicContact CE1-CG 4.4Å; F334-P340 HydrophobicContact CG-CG 4.32Å; F334-V345 HydrophobicContact CD1-CG2 4.46Å; F334-V345 HydrophobicContact CE1-CB 4.21Å; F334-V345 HydrophobicContact CE1-CG1 3.86Å; F334-V345 HydrophobicContact CE1-CG2 3.73Å; F334-V345 HydrophobicContact CZ-CB 4.45Å; F334-V345 HydrophobicContact CZ-CG1 4.34Å; F334-V345 HydrophobicContact CZ-CG2 4.19Å; F334-C348 HydrophobicContact CE2-CB 4.05Å; F334-C348 VanDerWaalsContact CE2-SG 3.51Å; F334-C348 HydrophobicContact CZ-CB 3.82Å; F334-C348 VanDerWaalsContact CZ-SG 3.58Å; F334-L369 HydrophobicContact CD1-CD2 4.36Å; F334-L369 HydrophobicContact CE1-CD2 4.16Å; F334-L369 HydrophobicContact CZ-CD2 4.31Å; F334-Y372 HydrophobicContact CB-CD2 4.27Å; F334-Y372 HydrophobicContact CB-CG 4.42Å; F334-Y372 AromaticContact CD1-CD1 3.95Å; F334-Y372 HydrophobicContact CD1-CD1 3.95Å; F334-Y372 AromaticContact CD1-CD2 3.91Å; F334-Y372 HydrophobicContact CD1-CD2 3.91Å; F334-Y372 HydrophobicContact CD1-CE1 4.32Å; F334-Y372 HydrophobicContact CD1-CE2 4.28Å; F334-Y372 AromaticContact CD1-CG 3.73Å; F334-Y372 HydrophobicContact CD1-CG 3.73Å; F334-Y372 HydrophobicContact CE1-CD1 4.4Å
335	L	69.7	Low	73.2	Confident	73 Å²	73	54.7 Å²	54.7	38%	0.382	29%	0.285	S	S	.	.	S	Bend	trans	-114	11.6	-177.5	-51.8	174.1	0	0	0	112.7	R331 L371	R331-L335 HydrophobicContact CG-CD1 4.17Å; R331-L335 CarbonylContact O-C 3.57Å; R331-L335 WeakPolarHBondContact O-CB 3.2Å; R331-L335 PolarHBondContact O-N 3.33Å; L335-L371 HydrophobicContact CD1-CB 4.26Å; L335-L371 HydrophobicContact CD1-CD1 3.74Å; L335-L371 HydrophobicContact CD2-CB 3.74Å
336	G	66.5	Low	73.2	Confident	31 Å²	31	57 Å²	57	32%	0.32	30%	0.295	S	S	.	.	S	Bend	trans	-76	177.9	172.4	0	0	0	0	0	113.2	T338	G336-T338 VanDerWaalsContact C-N 3.26Å; G336-T338 PolarHBondContact O-N 3.17Å
337	E	59.1	Low	72.9	Confident	208 Å²	208	59 Å²	59	97%	0.972	30%	0.304	S	S	*	.	S	Bend	trans	-63.1	-31.5	-178.9	-68.5	-174.8	169.1	0	0	113.1
338	T	61.2	Low	73	Confident	118 Å²	118	58.5 Å²	58.5	72%	0.724	30%	0.301	S	S	*	.	S	Bend	trans	-106.4	117.6	176.2	53.9	0	0	0	0	109.8	G336	G336-T338 VanDerWaalsContact C-N 3.26Å; G336-T338 PolarHBondContact O-N 3.17Å
339	T	66.6	Low	73.2	Confident	107 Å²	107	54.4 Å²	54.4	66%	0.656	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-67.7	140.1	173.9	46.8	0	0	0	0	110.3
340	P	68.7	Low	73.2	Confident	15 Å²	15	56.4 Å²	56.4	10%	0.097	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-69.1	151.9	-178	27.2	-29.6	0	0	0	110.2	Q333 F334 E344 V345	Q333-P340 VanDerWaalsContact O-CD 3.3Å; Q333-P340 WeakPolarHBondContact O-CD 3.38Å; F334-P340 HydrophobicContact CD1-CG 4.18Å; F334-P340 HydrophobicContact CE1-CG 4.4Å; F334-P340 HydrophobicContact CG-CG 4.32Å; P340-E344 HydrophobicContact CB-CB 4.26Å; P340-V345 HydrophobicContact CB-CG2 4.11Å; P340-V345 HydrophobicContact CG-CG2 3.63Å
341	N	70	Confident	73.2	Confident	70 Å²	70	56.4 Å²	56.4	37%	0.374	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-69.1	160.4	175.2	68.5	26.6	0	0	0	110.6	S343 E344 V345	N341-S343 PolarHBondContact O-N 2.76Å; N341-S343 PolarHBondContact OD1-N 2.63Å; N341-S343 PolarHBondContact OD1-OG 3.31Å; N341-E344 PolarHBondContact N-OE2 2.97Å; N341-E344 PolarHBondContact O-N 3.06Å; N341-E344 WeakPolarHBondContact OD1-CB 3.4Å; N341-E344 WeakPolarHBondContact OD1-CG 3.47Å; N341-E344 PolarHBondContact OD1-N 3.11Å; N341-V345 WeakPolarHBondContact O-CG2 3.22Å; N341-V345 PolarHBondContact O-N 3Å; N341-V345 VanDerWaalsContact O-N 3.08Å
342	N	69.5	Low	73.4	Confident	62 Å²	62	50.9 Å²	50.9	33%	0.332	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-29.5	-174.6	-72.3	-48.3	0	0	0	113.5	H346 V410 N413	N342-H346 WeakPolarHBondContact O-CB 3.49Å; N342-H346 PolarHBondContact O-N 2.99Å; N342-V410 HydrophobicContact CB-CG2 4.24Å; N342-V410 VanDerWaalsContact ND2-CG2 3.27Å; N342-V410 WeakPolarHBondContact ND2-CG2 3.23Å; N342-N413 PolarHBondContact O-ND2 3.13Å
343	S	68.5	Low	73.6	Confident	51 Å²	51	47.2 Å²	47.2	36%	0.357	26%	0.261	S	S	.	.	H	α-helix	trans	-71.6	-37.5	177.3	52.7	0	0	0	0	112.2	N341 H346 F347	N341-S343 PolarHBondContact O-N 2.76Å; N341-S343 PolarHBondContact OD1-N 2.63Å; N341-S343 PolarHBondContact OD1-OG 3.31Å; S343-H346 WeakPolarHBondContact O-CB 3.39Å; S343-H346 PolarHBondContact O-N 3.43Å; S343-F347 VanDerWaalsContact O-CB 3.31Å; S343-F347 WeakPolarHBondContact O-CB 3.47Å; S343-F347 PolarHBondContact O-N 3.21Å
344	E	71.7	Confident	73.6	Confident	46 Å²	46	51 Å²	51	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-41.2	172.7	-77.3	176.6	154.6	0	0	111.7	T287 P340 N341 H346 F347 C348	T287-E344 WeakPolarHBondContact CG2-OE1 3.44Å; T287-E344 PolarHBondContact OG1-OE1 3.16Å; P340-E344 HydrophobicContact CB-CB 4.26Å; N341-E344 PolarHBondContact N-OE2 2.97Å; N341-E344 PolarHBondContact O-N 3.06Å; N341-E344 WeakPolarHBondContact OD1-CB 3.4Å; N341-E344 WeakPolarHBondContact OD1-CG 3.47Å; N341-E344 PolarHBondContact OD1-N 3.11Å; E344-H346 VanDerWaalsContact C-N 3.34Å; E344-F347 PolarHBondContact O-N 3.19Å; E344-C348 WeakPolarHBondContact O-CB 3.49Å; E344-C348 PolarHBondContact O-N 3.35Å
345	V	76.9	Confident	73.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-47	173.5	174	0	0	0	0	110.4	F334 P340 N341 F347 C348 L349 Y372 N413	F334-V345 HydrophobicContact CD1-CG2 4.46Å; F334-V345 HydrophobicContact CE1-CB 4.21Å; F334-V345 HydrophobicContact CE1-CG1 3.86Å; F334-V345 HydrophobicContact CE1-CG2 3.73Å; F334-V345 HydrophobicContact CZ-CB 4.45Å; F334-V345 HydrophobicContact CZ-CG1 4.34Å; F334-V345 HydrophobicContact CZ-CG2 4.19Å; P340-V345 HydrophobicContact CB-CG2 4.11Å; P340-V345 HydrophobicContact CG-CG2 3.63Å; N341-V345 WeakPolarHBondContact O-CG2 3.22Å; N341-V345 PolarHBondContact O-N 3Å; N341-V345 VanDerWaalsContact O-N 3.08Å; V345-F347 VanDerWaalsContact C-N 3.29Å; V345-F347 PolarHBondContact O-N 3.14Å; V345-C348 PolarHBondContact O-N 2.83Å; V345-L349 HydrophobicContact CG1-CD1 3.7Å; V345-L349 HydrophobicContact CG1-CG 4.33Å; V345-L349 WeakPolarHBondContact O-CB 3.47Å; V345-L349 VanDerWaalsContact O-CG 3.26Å; V345-L349 WeakPolarHBondContact O-CG 3.01Å; V345-L349 PolarHBondContact O-N 3.34Å; V345-Y372 HydrophobicContact CG1-CE1 4.47Å; V345-N413 HydrophobicContact CG1-CB 3.94Å; V345-N413 WeakPolarHBondContact CG1-ND2 3.47Å
346	H	78.2	Confident	74.4	Confident	62 Å²	62	47.8 Å²	47.8	29%	0.287	26%	0.258	S	S	.	.	H	α-helix	trans	-57.5	-45.3	177.3	-172	74.2	0	0	0	111.8	N342 S343 E344 L349 T350 N413 M416	N342-H346 WeakPolarHBondContact O-CB 3.49Å; N342-H346 PolarHBondContact O-N 2.99Å; S343-H346 WeakPolarHBondContact O-CB 3.39Å; S343-H346 PolarHBondContact O-N 3.43Å; E344-H346 VanDerWaalsContact C-N 3.34Å; H346-L349 PolarHBondContact O-N 3Å; H346-T350 WeakPolarHBondContact O-CB 3.39Å; H346-T350 PolarHBondContact O-N 3.33Å; H346-T350 PolarHBondContact O-OG1 3.4Å; H346-N413 WeakPolarHBondContact CA-OD1 3.33Å; H346-N413 WeakPolarHBondContact CB-OD1 3.37Å; H346-N413 PolarHBondContact N-OD1 2.9Å; H346-N413 PolarHBondContact ND1-OD1 2.85Å; H346-M416 PolarHBondContact CE1-SD 2.95Å; H346-M416 PolarHBondContact ND1-SD 2.66Å; H346-M416 VanDerWaalsContact ND1-SD 3.35Å
347	F	74.9	Confident	74.8	Confident	46 Å²	46	52.4 Å²	52.4	20%	0.202	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-45.6	-179.8	-167.2	-77.1	0	0	0	112.5	L286 S290 W293 N294 S343 E344 V345 T350 S351	L286-F347 HydrophobicContact CD2-CE2 4.45Å; L286-F347 HydrophobicContact CD2-CZ 4.31Å; S290-F347 WeakPolarHBondContact O-CE1 3.33Å; S290-F347 WeakPolarHBondContact O-CZ 3.24Å; W293-F347 HydrophobicContact CB-CD1 4.09Å; W293-F347 HydrophobicContact CB-CE1 3.97Å; N294-F347 HydrophobicContact CB-CE1 4.25Å; N294-F347 HydrophobicContact CB-CZ 4.11Å; N294-F347 WeakPolarHBondContact ND2-CZ 3.47Å; N294-F347 VanDerWaalsContact OD1-CE1 3.25Å; N294-F347 WeakPolarHBondContact OD1-CE1 3.31Å; N294-F347 WeakPolarHBondContact OD1-CZ 3.31Å; S343-F347 VanDerWaalsContact O-CB 3.31Å; S343-F347 WeakPolarHBondContact O-CB 3.47Å; S343-F347 PolarHBondContact O-N 3.21Å; E344-F347 PolarHBondContact O-N 3.19Å; V345-F347 VanDerWaalsContact C-N 3.29Å; V345-F347 PolarHBondContact O-N 3.14Å; F347-T350 PolarHBondContact O-N 2.85Å; F347-S351 WeakPolarHBondContact O-CB 3.37Å; F347-S351 PolarHBondContact O-N 3.22Å; F347-S351 PolarHBondContact O-OG 3.31Å
348	C	81.2	Confident	75.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.2	-50.5	174.4	171.5	0	0	0	0	110.9	W293 F334 E344 V345 T350 S351 L352	W293-C348 HydrophobicContact CD2-CB 4.43Å; W293-C348 HydrophobicContact CG-CB 4.48Å; W293-C348 WeakPolarHBondContact CZ2-SG 2.94Å; F334-C348 HydrophobicContact CE2-CB 4.05Å; F334-C348 VanDerWaalsContact CE2-SG 3.51Å; F334-C348 HydrophobicContact CZ-CB 3.82Å; F334-C348 VanDerWaalsContact CZ-SG 3.58Å; E344-C348 WeakPolarHBondContact O-CB 3.49Å; E344-C348 PolarHBondContact O-N 3.35Å; V345-C348 PolarHBondContact O-N 2.83Å; C348-T350 VanDerWaalsContact C-N 3.33Å; C348-T350 PolarHBondContact O-N 3.06Å; C348-S351 WeakPolarHBondContact O-CB 3.35Å; C348-S351 PolarHBondContact O-N 3.01Å; C348-L352 WeakPolarHBondContact O-CG 3.38Å; C348-L352 PolarHBondContact O-N 2.96Å
349	L	84.5	Confident	75.7	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-36.8	-179.1	-67.2	168.9	0	0	0	112.3	V345 H346 S351 L352 L353 L369 F373 N413 M416 L420	V345-L349 HydrophobicContact CG1-CD1 3.7Å; V345-L349 HydrophobicContact CG1-CG 4.33Å; V345-L349 WeakPolarHBondContact O-CB 3.47Å; V345-L349 VanDerWaalsContact O-CG 3.26Å; V345-L349 WeakPolarHBondContact O-CG 3.01Å; V345-L349 PolarHBondContact O-N 3.34Å; H346-L349 PolarHBondContact O-N 3Å; L349-S351 VanDerWaalsContact C-N 3.32Å; L349-S351 PolarHBondContact O-N 2.88Å; L349-L352 HydrophobicContact CD2-CD1 4.47Å; L349-L352 PolarHBondContact O-N 3.22Å; L349-L353 WeakPolarHBondContact O-CG 3.37Å; L349-L353 PolarHBondContact O-N 3.08Å; L349-L369 HydrophobicContact CD2-CD1 4.12Å; L349-L369 HydrophobicContact CD2-CD2 4.36Å; L349-F373 HydrophobicContact CD1-CZ 4.12Å; L349-N413 HydrophobicContact CD1-CB 3.7Å; L349-N413 VanDerWaalsContact CD1-O 3.29Å; L349-N413 WeakPolarHBondContact CD1-O 3.49Å; L349-M416 VanDerWaalsContact C-CE 3.5Å; L349-M416 HydrophobicContact CB-CB 4.1Å; L349-M416 HydrophobicContact CB-CE 3.63Å; L349-M416 HydrophobicContact CB-SD 4.33Å; L349-M416 HydrophobicContact CD1-CB 4.27Å; L349-L420 HydrophobicContact CD2-CD1 3.6Å
350	T	80.9	Confident	76	Confident	41 Å²	41	34.8 Å²	34.8	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-62.4	-44.5	175.5	-59.1	0	0	0	0	110.3	H346 F347 C348 L353 R354 M416	H346-T350 WeakPolarHBondContact O-CB 3.39Å; H346-T350 PolarHBondContact O-N 3.33Å; H346-T350 PolarHBondContact O-OG1 3.4Å; F347-T350 PolarHBondContact O-N 2.85Å; C348-T350 VanDerWaalsContact C-N 3.33Å; C348-T350 PolarHBondContact O-N 3.06Å; T350-L353 PolarHBondContact O-N 3.45Å; T350-R354 WeakPolarHBondContact O-CG 3.11Å; T350-R354 PolarHBondContact O-N 3.32Å; T350-R354 VanDerWaalsContact O-N 3.1Å; T350-M416 VanDerWaalsContact CA-CE 3.45Å; T350-M416 WeakPolarHBondContact OG1-CE 3.39Å
351	S	80.4	Confident	76.6	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-66	-40.2	178	-58.6	0	0	0	0	111.5	F347 C348 L349 R354 L355	F347-S351 WeakPolarHBondContact O-CB 3.37Å; F347-S351 PolarHBondContact O-N 3.22Å; F347-S351 PolarHBondContact O-OG 3.31Å; C348-S351 WeakPolarHBondContact O-CB 3.35Å; C348-S351 PolarHBondContact O-N 3.01Å; L349-S351 VanDerWaalsContact C-N 3.32Å; L349-S351 PolarHBondContact O-N 2.88Å; S351-R354 PolarHBondContact O-N 3.47Å; S351-L355 WeakPolarHBondContact O-CB 3.5Å; S351-L355 VanDerWaalsContact O-CG 3.31Å; S351-L355 WeakPolarHBondContact O-CG 3.45Å; S351-L355 PolarHBondContact O-N 2.86Å
352	L	83.8	Confident	77.2	Confident	5 Å²	5	32.1 Å²	32.1	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-64.5	-38.5	174.6	-75.4	173.5	0	0	0	112.8	W293 V326 I330 C348 L349 L355 S356 V365 L369 L420	W293-L352 HydrophobicContact CH2-CD1 4.45Å; W293-L352 HydrophobicContact CH2-CD2 3.96Å; W293-L352 HydrophobicContact CH2-CG 4.22Å; W293-L352 HydrophobicContact CZ3-CD2 3.6Å; W293-L352 HydrophobicContact CZ3-CG 3.9Å; V326-L352 HydrophobicContact CG1-CD2 3.52Å; I330-L352 HydrophobicContact CD1-CD1 4.22Å; C348-L352 WeakPolarHBondContact O-CG 3.38Å; C348-L352 PolarHBondContact O-N 2.96Å; L349-L352 HydrophobicContact CD2-CD1 4.47Å; L349-L352 PolarHBondContact O-N 3.22Å; L352-L355 HydrophobicContact CD2-CD1 4.29Å; L352-L355 PolarHBondContact O-N 3.27Å; L352-S356 WeakPolarHBondContact O-CB 3.38Å; L352-S356 PolarHBondContact O-N 3.42Å; L352-S356 PolarHBondContact O-OG 3.34Å; L352-V365 HydrophobicContact CD1-CG1 4.48Å; L352-V365 HydrophobicContact CD2-CG1 4.19Å; L352-L369 HydrophobicContact CD1-CD1 3.88Å; L352-L420 HydrophobicContact CB-CD1 4.09Å; L352-L420 HydrophobicContact CB-CD2 4.02Å; L352-L420 HydrophobicContact CD1-CD1 4.4Å
353	L	81.3	Confident	77.8	Confident	27 Å²	27	29.9 Å²	29.9	14%	0.141	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-48.7	174	-77.5	168	0	0	0	109.7	L349 T350 L355 S356 E357 M416 L420 R423	L349-L353 WeakPolarHBondContact O-CG 3.37Å; L349-L353 PolarHBondContact O-N 3.08Å; T350-L353 PolarHBondContact O-N 3.45Å; L353-L355 VanDerWaalsContact C-N 3.32Å; L353-L355 PolarHBondContact O-N 3.36Å; L353-S356 WeakPolarHBondContact CA-OG 3.31Å; L353-S356 PolarHBondContact O-N 3.17Å; L353-S356 VanDerWaalsContact O-N 3.17Å; L353-S356 PolarHBondContact O-OG 3.32Å; L353-E357 PolarHBondContact O-N 2.93Å; L353-M416 HydrophobicContact CD1-CB 4.07Å; L353-M416 HydrophobicContact CD1-CE 3.84Å; L353-M416 HydrophobicContact CD1-CG 4.1Å; L353-L420 HydrophobicContact CB-CD2 4.41Å; L353-L420 HydrophobicContact CD2-CD2 3.56Å; L353-L420 HydrophobicContact CD2-CG 3.7Å; L353-L420 HydrophobicContact CG-CD2 3.79Å; L353-L420 HydrophobicContact CG-CG 3.98Å; L353-R423 PolarHBondContact O-NH1 3.08Å
354	R	78.1	Confident	78.4	Confident	103 Å²	103	29.5 Å²	29.5	39%	0.389	15%	0.147	S	C	.	.	H	α-helix	trans	-59.3	-41	175.1	-68.3	175.5	178.7	176.1	-0.9	112.8	N212 A297 T350 S351 E357	N212-R354 PolarHBondContact OD1-NH1 3.49Å; N212-R354 VanDerWaalsContact OD1-NH1 3.08Å; A297-R354 HydrophobicContact CB-CB 4.29Å; T350-R354 WeakPolarHBondContact O-CG 3.11Å; T350-R354 PolarHBondContact O-N 3.32Å; T350-R354 VanDerWaalsContact O-N 3.1Å; S351-R354 PolarHBondContact O-N 3.47Å; R354-E357 PolarHBondContact O-N 3.45Å
355	L	79.9	Confident	79	Confident	3 Å²	3	27.3 Å²	27.3	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-43.8	175.9	-77	168.4	0	0	0	111.9	W293 L296 A297 T300 S351 L352 L353 E357 T358 C359	W293-L355 HydrophobicContact CZ3-CD1 4.34Å; L296-L355 HydrophobicContact CD2-CD1 4.1Å; L296-L355 HydrophobicContact CG-CD1 4.25Å; L296-L355 HydrophobicContact CG-CD2 4.49Å; A297-L355 HydrophobicContact CB-CD2 4.41Å; A297-L355 HydrophobicContact CB-CG 4.04Å; T300-L355 VanDerWaalsContact CB-CD2 3.47Å; T300-L355 HydrophobicContact CG2-CD2 3.79Å; T300-L355 VanDerWaalsContact OG1-CD2 3.24Å; T300-L355 WeakPolarHBondContact OG1-CD2 3.43Å; S351-L355 WeakPolarHBondContact O-CB 3.5Å; S351-L355 VanDerWaalsContact O-CG 3.31Å; S351-L355 WeakPolarHBondContact O-CG 3.45Å; S351-L355 PolarHBondContact O-N 2.86Å; L352-L355 HydrophobicContact CD2-CD1 4.29Å; L352-L355 PolarHBondContact O-N 3.27Å; L353-L355 VanDerWaalsContact C-N 3.32Å; L353-L355 PolarHBondContact O-N 3.36Å; L355-E357 PolarHBondContact O-N 2.92Å; L355-T358 PolarHBondContact O-N 3.35Å; L355-T358 VanDerWaalsContact O-N 3.1Å; L355-T358 PolarHBondContact O-OG1 3.09Å; L355-C359 PolarHBondContact O-N 3.21Å
356	S	80.1	Confident	79.5	Confident	8 Å²	8	27.3 Å²	27.3	6%	0.056	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-28.1	-179.5	68	0	0	0	0	113.1	L352 L353 T358 G360 R423	L352-S356 WeakPolarHBondContact O-CB 3.38Å; L352-S356 PolarHBondContact O-N 3.42Å; L352-S356 PolarHBondContact O-OG 3.34Å; L353-S356 WeakPolarHBondContact CA-OG 3.31Å; L353-S356 PolarHBondContact O-N 3.17Å; L353-S356 VanDerWaalsContact O-N 3.17Å; L353-S356 PolarHBondContact O-OG 3.32Å; S356-T358 PolarHBondContact O-N 2.94Å; S356-G360 VanDerWaalsContact O-CA 3.23Å; S356-G360 WeakPolarHBondContact O-CA 3.28Å; S356-G360 PolarHBondContact O-N 2.99Å; S356-R423 VanDerWaalsContact OG-CD 3.22Å; S356-R423 WeakPolarHBondContact OG-CD 3.41Å; S356-R423 PolarHBondContact OG-NH1 3.15Å
357	E	75.5	Confident	79.9	Confident	127 Å²	127	28.7 Å²	28.7	59%	0.593	14%	0.139	S	C	*	.	H	α-helix	trans	-65.2	-26.1	175.7	-71.7	164.6	-167.8	0	0	112.8	L353 R354 L355 R423	L353-E357 PolarHBondContact O-N 2.93Å; R354-E357 PolarHBondContact O-N 3.45Å; L355-E357 PolarHBondContact O-N 2.92Å; E357-R423 VanDerWaalsContact CG-NH1 3.31Å; E357-R423 IonicContact OE1-CZ 3.61Å; E357-R423 IonicContact OE1-NH1 2.73Å; E357-R423 PolarHBondContact OE1-NH1 3.07Å; E357-R423 IonicContact OE1-NH2 3.94Å; E357-R423 PolarHBondContact OE1-NH2 3.06Å
358	T	69.7	Low	80.3	Confident	44 Å²	44	26.6 Å²	26.6	27%	0.27	13%	0.13	S	C	.	.	H	α-helix	trans	-106.4	-37.8	-174.3	59.1	0	0	0	0	113.3	P301 L317 L355 S356	P301-T358 HydrophobicContact CB-CG2 3.89Å; P301-T358 HydrophobicContact CG-CG2 3.56Å; L317-T358 WeakPolarHBondContact CD2-O 3.48Å; L355-T358 PolarHBondContact O-N 3.35Å; L355-T358 VanDerWaalsContact O-N 3.1Å; L355-T358 PolarHBondContact O-OG1 3.09Å; S356-T358 PolarHBondContact O-N 2.94Å
359	C	69.7	Low	80.6	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.014	13%	0.13	C	C	.	.	H	α-helix	trans	-106.6	-8.7	-177.6	-74	0	0	0	0	114.1	T300 L317 G318 Y323 L355	T300-C359 WeakPolarHBondContact CG2-SG 3.18Å; L317-C359 CarbonylContact C-O 3.52Å; L317-C359 WeakPolarHBondContact CA-O 3.34Å; L317-C359 VanDerWaalsContact CD2-C 3.42Å; L317-C359 WeakPolarHBondContact CD2-O 3.48Å; G318-C359 PolarHBondContact N-O 3.45Å; Y323-C359 HydrophobicContact CE2-CB 4.08Å; Y323-C359 WeakPolarHBondContact OH-CB 3.38Å; L355-C359 PolarHBondContact O-N 3.21Å
360	G	73.1	Confident	80.8	Confident	18 Å²	18	26.9 Å²	26.9	19%	0.186	13%	0.131	C	C	.	.			trans	68.1	149.5	-166.1	0	0	0	0	0	111.5	Y323 S356	Y323-G360 WeakPolarHBondContact CE2-O 3.27Å; Y323-G360 PolarHBondContact OH-O 3.49Å; S356-G360 VanDerWaalsContact O-CA 3.23Å; S356-G360 WeakPolarHBondContact O-CA 3.28Å; S356-G360 PolarHBondContact O-N 2.99Å
361	I	81	Confident	80.9	Confident	8 Å²	8	29.3 Å²	29.3	4%	0.041	14%	0.143	C	C	.	.			trans	-83.8	140	-178.5	-168	166.7	0	0	0	111.8	V366 L420 R423 L424	I361-V366 HydrophobicContact CD1-CG2 3.67Å; I361-V366 HydrophobicContact CG1-CG2 4.07Å; I361-L420 HydrophobicContact CD1-CB 3.69Å; I361-L420 HydrophobicContact CD1-CD2 3.8Å; I361-L420 HydrophobicContact CD1-CG 4.25Å; I361-R423 VanDerWaalsContact CG2-C 3.47Å; I361-R423 HydrophobicContact CG2-CB 4.16Å; I361-R423 WeakPolarHBondContact CG2-O 3.28Å; I361-L424 HydrophobicContact CG2-CB 4.17Å; I361-L424 HydrophobicContact CG2-CD2 3.69Å; I361-L424 HydrophobicContact CG2-CG 3.62Å
362	N	82.5	Confident	80.9	Confident	21 Å²	21	30.9 Å²	30.9	11%	0.112	15%	0.148	C	C	.	.			trans	-95.9	140.8	175.9	-178.1	-74.3	0	0	0	111.2	G318 Y323 E364 V365 V366	G318-N362 PolarHBondContact O-ND2 3.36Å; Y323-N362 HydrophobicContact CD2-CB 3.55Å; Y323-N362 HydrophobicContact CE2-CB 4.18Å; Y323-N362 HydrophobicContact CG-CB 3.77Å; N362-E364 PolarHBondContact O-N 2.79Å; N362-E364 VanDerWaalsContact OD1-CB 3.23Å; N362-E364 WeakPolarHBondContact OD1-CB 3.49Å; N362-E364 PolarHBondContact OD1-N 3.13Å; N362-V365 HydrophobicContact CB-CG2 4.29Å; N362-V365 VanDerWaalsContact O-CB 3.32Å; N362-V365 WeakPolarHBondContact O-CB 3.49Å; N362-V365 PolarHBondContact O-N 3.26Å; N362-V365 VanDerWaalsContact O-N 3.11Å; N362-V366 PolarHBondContact O-N 3.47Å
363	L	82.1	Confident	81	Confident	15 Å²	15	30.9 Å²	30.9	8%	0.079	15%	0.148	C	C	.	.	H	α-helix	trans	-54.8	-33.7	179.2	-177.9	66.1	0	0	0	114.2	V365 V366 R367 A431 L432	L363-V365 VanDerWaalsContact C-N 3.32Å; L363-V365 PolarHBondContact O-N 2.83Å; L363-V366 WeakPolarHBondContact O-CB 3.42Å; L363-V366 PolarHBondContact O-N 2.82Å; L363-R367 WeakPolarHBondContact O-CG 3.32Å; L363-R367 PolarHBondContact O-N 3.24Å; L363-A431 HydrophobicContact CD2-CB 3.38Å; L363-L432 HydrophobicContact CD1-CB 4.1Å; L363-L432 HydrophobicContact CD1-CD1 4.21Å
364	E	81.8	Confident	81.1	Confident	42 Å²	42	33.4 Å²	33.4	20%	0.196	16%	0.158	C	C	.	.	H	α-helix	trans	-70.5	-29	-178.5	-165.2	60.1	-157.8	0	0	112.8	L320 V327 R331 N362 R367 S368	L320-E364 HydrophobicContact CD1-CB 3.93Å; L320-E364 HydrophobicContact CD1-CG 4.36Å; V327-E364 HydrophobicContact CG1-CG 4.11Å; V327-E364 HydrophobicContact CG2-CB 4.06Å; V327-E364 HydrophobicContact CG2-CG 3.88Å; R331-E364 IonicContact NH2-OE1 3.75Å; R331-E364 PolarHBondContact NH2-OE1 2.88Å; N362-E364 PolarHBondContact O-N 2.79Å; N362-E364 VanDerWaalsContact OD1-CB 3.23Å; N362-E364 WeakPolarHBondContact OD1-CB 3.49Å; N362-E364 PolarHBondContact OD1-N 3.13Å; E364-R367 WeakPolarHBondContact OE2-CD 3.33Å; E364-R367 IonicContact OE2-CZ 3.51Å; E364-R367 IonicContact OE2-NH1 3.67Å; E364-R367 PolarHBondContact OE2-NH1 3.34Å; E364-S368 PolarHBondContact O-N 3.44Å; E364-S368 VanDerWaalsContact O-N 3.11Å; E364-S368 PolarHBondContact O-OG 2.99Å
365	V	84.5	Confident	81	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-63.9	-47.4	170	176.8	0	0	0	0	109.2	Y323 V326 V327 I330 L352 N362 L363 S368 L369	Y323-V365 HydrophobicContact CD1-CG2 3.34Å; Y323-V365 HydrophobicContact CE1-CG2 4.07Å; Y323-V365 HydrophobicContact CG-CG2 3.83Å; V326-V365 HydrophobicContact CB-CG2 4.5Å; V326-V365 HydrophobicContact CG1-CG1 4.18Å; V326-V365 HydrophobicContact CG1-CG2 3.9Å; V327-V365 HydrophobicContact CG2-CG2 3.98Å; I330-V365 HydrophobicContact CD1-CB 4.46Å; I330-V365 HydrophobicContact CD1-CG1 3.59Å; L352-V365 HydrophobicContact CD1-CG1 4.48Å; L352-V365 HydrophobicContact CD2-CG1 4.19Å; N362-V365 HydrophobicContact CB-CG2 4.29Å; N362-V365 VanDerWaalsContact O-CB 3.32Å; N362-V365 WeakPolarHBondContact O-CB 3.49Å; N362-V365 PolarHBondContact O-N 3.26Å; N362-V365 VanDerWaalsContact O-N 3.11Å; L363-V365 VanDerWaalsContact C-N 3.32Å; L363-V365 PolarHBondContact O-N 2.83Å; V365-S368 PolarHBondContact O-N 3.37Å; V365-L369 HydrophobicContact CG1-CD1 4.25Å; V365-L369 PolarHBondContact O-N 3.23Å
366	V	85.8	Confident	80.8	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-43.7	179.1	169.8	0	0	0	0	111.3	I361 N362 L363 S368 L369 W370 F417 L421 L424 L432	I361-V366 HydrophobicContact CD1-CG2 3.67Å; I361-V366 HydrophobicContact CG1-CG2 4.07Å; N362-V366 PolarHBondContact O-N 3.47Å; L363-V366 WeakPolarHBondContact O-CB 3.42Å; L363-V366 PolarHBondContact O-N 2.82Å; V366-S368 VanDerWaalsContact C-N 3.29Å; V366-S368 PolarHBondContact O-N 3.37Å; V366-L369 PolarHBondContact O-N 2.77Å; V366-W370 WeakPolarHBondContact O-CB 3.04Å; V366-W370 PolarHBondContact O-N 2.8Å; V366-F417 HydrophobicContact CG1-CE2 4.5Å; V366-L421 HydrophobicContact CB-CD2 4.36Å; V366-L421 HydrophobicContact CG1-CD2 3.29Å; V366-L421 HydrophobicContact CG2-CD2 4.16Å; V366-L424 HydrophobicContact CB-CD1 4.48Å; V366-L424 HydrophobicContact CG1-CD1 4.34Å; V366-L424 HydrophobicContact CG2-CD1 3.99Å; V366-L424 HydrophobicContact CG2-CD2 4.27Å; V366-L424 HydrophobicContact CG2-CG 4.27Å; V366-L432 HydrophobicContact CG1-CD1 3.67Å
367	R	86.2	Confident	80.6	Confident	91 Å²	91	33.1 Å²	33.1	34%	0.343	17%	0.166	S	C	.	.	H	α-helix	trans	-55.5	-44.4	173.5	-78.9	170	174.6	169.1	1.8	112.5	L363 E364 W370 L371 T435	L363-R367 WeakPolarHBondContact O-CG 3.32Å; L363-R367 PolarHBondContact O-N 3.24Å; E364-R367 WeakPolarHBondContact OE2-CD 3.33Å; E364-R367 IonicContact OE2-CZ 3.51Å; E364-R367 IonicContact OE2-NH1 3.67Å; E364-R367 PolarHBondContact OE2-NH1 3.34Å; R367-W370 PolarHBondContact O-N 3.4Å; R367-L371 PolarHBondContact O-N 3.38Å; R367-T435 HydrophobicContact CB-CG2 4.25Å; R367-T435 HydrophobicContact CG-CG2 3.46Å; R367-T435 VanDerWaalsContact CG-CG2 3.46Å; R367-T435 PolarHBondContact NE-OG1 3.34Å
368	S	84.2	Confident	80.4	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.014	16%	0.156	C	C	.	.	H	α-helix	trans	-68.7	-42.8	-178.3	-57.3	0	0	0	0	111.7	E364 V365 V366 W370 L371	E364-S368 PolarHBondContact O-N 3.44Å; E364-S368 VanDerWaalsContact O-N 3.11Å; E364-S368 PolarHBondContact O-OG 2.99Å; V365-S368 PolarHBondContact O-N 3.37Å; V366-S368 VanDerWaalsContact C-N 3.29Å; V366-S368 PolarHBondContact O-N 3.37Å; S368-W370 VanDerWaalsContact C-N 3.33Å; S368-L371 PolarHBondContact O-N 3.34Å
369	L	87.4	Confident	80.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67	-35.7	173.8	-71.2	173.4	0	0	0	112.3	I330 F334 L349 L352 V365 V366 L371 Y372 F373 F417 L420	I330-L369 HydrophobicContact CD1-CD2 4.26Å; I330-L369 HydrophobicContact CD1-CG 4.11Å; I330-L369 HydrophobicContact CG1-CD2 4.31Å; I330-L369 HydrophobicContact CG2-CD2 3.9Å; I330-L369 HydrophobicContact CG2-CG 4.23Å; F334-L369 HydrophobicContact CD1-CD2 4.36Å; F334-L369 HydrophobicContact CE1-CD2 4.16Å; F334-L369 HydrophobicContact CZ-CD2 4.31Å; L349-L369 HydrophobicContact CD2-CD1 4.12Å; L349-L369 HydrophobicContact CD2-CD2 4.36Å; L352-L369 HydrophobicContact CD1-CD1 3.88Å; V365-L369 HydrophobicContact CG1-CD1 4.25Å; V365-L369 PolarHBondContact O-N 3.23Å; V366-L369 PolarHBondContact O-N 2.77Å; L369-L371 VanDerWaalsContact C-N 3.27Å; L369-L371 PolarHBondContact O-N 3.03Å; L369-Y372 WeakPolarHBondContact O-CB 3.48Å; L369-Y372 PolarHBondContact O-N 3.37Å; L369-Y372 VanDerWaalsContact O-N 3.11Å; L369-F373 HydrophobicContact CB-CD2 4.47Å; L369-F373 WeakPolarHBondContact O-CD2 3.36Å; L369-F373 PolarHBondContact O-N 3.31Å; L369-F417 HydrophobicContact CB-CD2 4.06Å; L369-F417 HydrophobicContact CB-CE2 3.74Å; L369-F417 HydrophobicContact CD1-CD2 4.17Å; L369-F417 HydrophobicContact CD1-CE2 4.38Å; L369-L420 HydrophobicContact CD1-CD1 4.15Å
370	W	87.9	Confident	79.5	Confident	5 Å²	5	33.2 Å²	33.2	2%	0.019	18%	0.18	C	C	.	.	H	α-helix	trans	-61.8	-36.3	179.4	176	-123.6	0	0	0	112	V366 R367 S368 Y372 F373 K374 L377 F417 T435 L436 I438 Y451 I454	V366-W370 WeakPolarHBondContact O-CB 3.04Å; V366-W370 PolarHBondContact O-N 2.8Å; R367-W370 PolarHBondContact O-N 3.4Å; S368-W370 VanDerWaalsContact C-N 3.33Å; W370-Y372 PolarHBondContact O-N 3.38Å; W370-F373 HydrophobicContact CE3-CB 4.2Å; W370-F373 HydrophobicContact CZ3-CB 4.46Å; W370-F373 PolarHBondContact O-N 2.93Å; W370-K374 HydrophobicContact CD2-CB 4.21Å; W370-K374 HydrophobicContact CZ2-CB 4.36Å; W370-K374 WeakPolarHBondContact O-CA 3.26Å; W370-K374 WeakPolarHBondContact O-CB 3.19Å; W370-K374 PolarHBondContact O-N 2.89Å; W370-L377 HydrophobicContact CH2-CD1 3.81Å; W370-L377 HydrophobicContact CZ3-CD1 3.96Å; W370-F417 HydrophobicContact CB-CZ 4.42Å; W370-F417 HydrophobicContact CE3-CE1 4Å; W370-F417 HydrophobicContact CE3-CZ 4.08Å; W370-F417 HydrophobicContact CZ3-CE1 4.4Å; W370-T435 HydrophobicContact CB-CG2 4.44Å; W370-T435 HydrophobicContact CG-CG2 4.32Å; W370-T435 PolarHBondContact NE1-O 3.34Å; W370-L436 HydrophobicContact CD2-CD2 3.53Å; W370-L436 HydrophobicContact CE3-CD2 3.66Å; W370-L436 HydrophobicContact CG-CD2 3.99Å; W370-L436 HydrophobicContact CH2-CD2 4.1Å; W370-L436 HydrophobicContact CZ2-CB 4.32Å; W370-L436 HydrophobicContact CZ2-CD2 3.97Å; W370-L436 WeakPolarHBondContact CZ2-O 3.21Å; W370-L436 HydrophobicContact CZ3-CD2 3.97Å; W370-I438 HydrophobicContact CH2-CD1 3.47Å; W370-I438 VanDerWaalsContact CH2-CD1 3.47Å; W370-I438 HydrophobicContact CH2-CG1 4.34Å; W370-I438 HydrophobicContact CZ2-CD1 3.22Å; W370-I438 HydrophobicContact CZ2-CG1 3.64Å; W370-Y451 HydrophobicContact CH2-CD2 4.09Å; W370-Y451 HydrophobicContact CH2-CE2 4.02Å; W370-Y451 HydrophobicContact CZ2-CE2 4.24Å; W370-I454 HydrophobicContact CH2-CD1 3.97Å; W370-I454 HydrophobicContact CZ3-CD1 3.56Å
371	L	83.3	Confident	78.6	Confident	93 Å²	93	34.1 Å²	34.1	49%	0.487	18%	0.179	S	C	.	.	H	α-helix	trans	-57.8	-39.6	175.1	-69.9	172.4	0	0	0	112.2	L335 R367 S368 L369 S375	L335-L371 HydrophobicContact CD1-CB 4.26Å; L335-L371 HydrophobicContact CD1-CD1 3.74Å; L335-L371 HydrophobicContact CD2-CB 3.74Å; R367-L371 PolarHBondContact O-N 3.38Å; S368-L371 PolarHBondContact O-N 3.34Å; L369-L371 VanDerWaalsContact C-N 3.27Å; L369-L371 PolarHBondContact O-N 3.03Å; L371-S375 PolarHBondContact O-N 2.64Å
372	Y	82	Confident	76.8	Confident	33 Å²	33	40.5 Å²	40.5	13%	0.129	21%	0.214	C	C	.	.	H	α-helix	trans	-67.2	-53.1	175	174.3	-96.8	0	0	0	111.7	F334 V345 L369 W370 K374 S375 W376	F334-Y372 HydrophobicContact CB-CD2 4.27Å; F334-Y372 HydrophobicContact CB-CG 4.42Å; F334-Y372 AromaticContact CD1-CD1 3.95Å; F334-Y372 HydrophobicContact CD1-CD1 3.95Å; F334-Y372 AromaticContact CD1-CD2 3.91Å; F334-Y372 HydrophobicContact CD1-CD2 3.91Å; F334-Y372 HydrophobicContact CD1-CE1 4.32Å; F334-Y372 HydrophobicContact CD1-CE2 4.28Å; F334-Y372 AromaticContact CD1-CG 3.73Å; F334-Y372 HydrophobicContact CD1-CG 3.73Å; F334-Y372 HydrophobicContact CE1-CD1 4.4Å; V345-Y372 HydrophobicContact CG1-CE1 4.47Å; L369-Y372 WeakPolarHBondContact O-CB 3.48Å; L369-Y372 PolarHBondContact O-N 3.37Å; L369-Y372 VanDerWaalsContact O-N 3.11Å; W370-Y372 PolarHBondContact O-N 3.38Å; Y372-K374 VanDerWaalsContact C-N 3.31Å; Y372-K374 PolarHBondContact O-N 3.33Å; Y372-S375 WeakPolarHBondContact O-CB 3.31Å; Y372-S375 PolarHBondContact O-N 3.38Å; Y372-W376 PolarHBondContact O-N 3.37Å
373	F	84.1	Confident	74.8	Confident	5 Å²	5	44.5 Å²	44.5	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-67.6	-29.1	-179	-74.1	-69.3	0	0	0	113.5	L349 L369 W370 W376 L377 F414 F417	L349-F373 HydrophobicContact CD1-CZ 4.12Å; L369-F373 HydrophobicContact CB-CD2 4.47Å; L369-F373 WeakPolarHBondContact O-CD2 3.36Å; L369-F373 PolarHBondContact O-N 3.31Å; W370-F373 HydrophobicContact CE3-CB 4.2Å; W370-F373 HydrophobicContact CZ3-CB 4.46Å; W370-F373 PolarHBondContact O-N 2.93Å; F373-W376 WeakPolarHBondContact O-CB 3.46Å; F373-W376 PolarHBondContact O-N 3.39Å; F373-L377 WeakPolarHBondContact O-CG 3.3Å; F373-L377 PolarHBondContact O-N 3.48Å; F373-F414 AromaticContact CD1-CD2 3.85Å; F373-F414 HydrophobicContact CD1-CD2 3.85Å; F373-F414 HydrophobicContact CE1-CB 4.43Å; F373-F414 HydrophobicContact CE1-CD2 4.18Å; F373-F417 HydrophobicContact CB-CE1 4.43Å; F373-F417 HydrophobicContact CD2-CB 4.04Å; F373-F417 AromaticContact CD2-CD1 3.73Å; F373-F417 HydrophobicContact CD2-CD1 3.73Å; F373-F417 AromaticContact CD2-CD2 3.71Å; F373-F417 HydrophobicContact CD2-CD2 3.71Å; F373-F417 HydrophobicContact CD2-CE1 4.08Å; F373-F417 HydrophobicContact CD2-CE2 4.07Å; F373-F417 AromaticContact CD2-CG 3.53Å; F373-F417 HydrophobicContact CD2-CG 3.53Å; F373-F417 HydrophobicContact CD2-CZ 4.24Å; F373-F417 HydrophobicContact CE1-CB 4.39Å; F373-F417 HydrophobicContact CE2-CB 3.46Å; F373-F417 VanDerWaalsContact CE2-CB 3.46Å; F373-F417 HydrophobicContact CE2-CD1 4.07Å; F373-F417 AromaticContact CE2-CD2 3.63Å; F373-F417 HydrophobicContact CE2-CD2 3.63Å; F373-F417 HydrophobicContact CE2-CE2 4.4Å; F373-F417 AromaticContact CE2-CG 3.43Å; F373-F417 HydrophobicContact CE2-CG 3.43Å; F373-F417 VanDerWaalsContact CE2-CG 3.43Å; F373-F417 HydrophobicContact CG-CD1 4.09Å; F373-F417 HydrophobicContact CG-CE1 4.4Å; F373-F417 HydrophobicContact CG-CG 4.29Å; F373-F417 HydrophobicContact CZ-CB 3.65Å; F373-F417 HydrophobicContact CZ-CG 4.1Å
374	K	83.6	Confident	72.9	Confident	80 Å²	80	48.4 Å²	48.4	35%	0.348	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-45.5	172.6	173.7	171.9	178.5	174.2	0	111.2	W370 Y372 W376 L377 S378 I438	W370-K374 HydrophobicContact CD2-CB 4.21Å; W370-K374 HydrophobicContact CZ2-CB 4.36Å; W370-K374 WeakPolarHBondContact O-CA 3.26Å; W370-K374 WeakPolarHBondContact O-CB 3.19Å; W370-K374 PolarHBondContact O-N 2.89Å; Y372-K374 VanDerWaalsContact C-N 3.31Å; Y372-K374 PolarHBondContact O-N 3.33Å; K374-W376 VanDerWaalsContact C-N 3.31Å; K374-L377 PolarHBondContact O-N 3.36Å; K374-S378 PolarHBondContact O-N 2.71Å; K374-S378 PolarHBondContact O-OG 2.83Å; K374-I438 HydrophobicContact CB-CD1 4.24Å; K374-I438 HydrophobicContact CD-CD1 4.31Å; K374-I438 HydrophobicContact CD-CG1 4.11Å; K374-I438 HydrophobicContact CG-CD1 3.79Å; K374-I438 HydrophobicContact CG-CG1 4.11Å
375	S	77.2	Confident	70.9	Confident	65 Å²	65	52.4 Å²	52.4	46%	0.455	29%	0.29	S	S	.	.	H	α-helix	trans	-59.2	-47.3	174.3	-176.2	0	0	0	0	110.3	L371 Y372 L377 S378 T379	L371-S375 PolarHBondContact O-N 2.64Å; Y372-S375 WeakPolarHBondContact O-CB 3.31Å; Y372-S375 PolarHBondContact O-N 3.38Å; S375-L377 PolarHBondContact O-N 3.31Å; S375-S378 WeakPolarHBondContact CA-OG 3.49Å; S375-S378 WeakPolarHBondContact O-CA 3.49Å; S375-S378 PolarHBondContact O-N 2.74Å; S375-S378 PolarHBondContact O-OG 3.16Å; S375-T379 PolarHBondContact O-N 3.04Å; S375-T379 PolarHBondContact O-OG1 3.25Å
376	W	75.8	Confident	68.8	Low	42 Å²	42	62.4 Å²	62.4	16%	0.159	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-41.3	177	-174.8	85.1	0	0	0	113.7	Y372 F373 K374 S378 T379 F381 V410 F414	Y372-W376 PolarHBondContact O-N 3.37Å; F373-W376 WeakPolarHBondContact O-CB 3.46Å; F373-W376 PolarHBondContact O-N 3.39Å; K374-W376 VanDerWaalsContact C-N 3.31Å; W376-S378 VanDerWaalsContact C-N 3.31Å; W376-S378 PolarHBondContact O-N 3.12Å; W376-T379 PolarHBondContact O-OG1 3.43Å; W376-F381 HydrophobicContact CH2-CD1 4.3Å; W376-F381 AromaticContact CH2-CE1 3.33Å; W376-F381 HydrophobicContact CH2-CE1 3.33Å; W376-F381 AromaticContact CH2-CE2 3.73Å; W376-F381 HydrophobicContact CH2-CE2 3.73Å; W376-F381 AromaticContact CH2-CZ 3Å; W376-F381 HydrophobicContact CH2-CZ 3Å; W376-F381 AromaticContact CZ2-CD1 3.89Å; W376-F381 HydrophobicContact CZ2-CD1 3.89Å; W376-F381 AromaticContact CZ2-CE1 3.25Å; W376-F381 HydrophobicContact CZ2-CE1 3.25Å; W376-F381 HydrophobicContact CZ2-CE2 4.2Å; W376-F381 AromaticContact CZ2-CZ 3.46Å; W376-F381 HydrophobicContact CZ2-CZ 3.46Å; W376-F381 VanDerWaalsContact CZ2-CZ 3.46Å; W376-F381 HydrophobicContact CZ3-CE1 4.41Å; W376-F381 HydrophobicContact CZ3-CE2 4.06Å; W376-F381 AromaticContact CZ3-CZ 3.75Å; W376-F381 HydrophobicContact CZ3-CZ 3.75Å; W376-V410 HydrophobicContact CZ2-CG1 4.23Å; W376-F414 HydrophobicContact CE3-CD2 4.4Å; W376-F414 HydrophobicContact CH2-CB 4.36Å; W376-F414 HydrophobicContact CH2-CD2 4.39Å; W376-F414 HydrophobicContact CH2-CG 4.37Å; W376-F414 AromaticContact CZ3-CD2 3.78Å; W376-F414 HydrophobicContact CZ3-CD2 3.78Å; W376-F414 HydrophobicContact CZ3-CE2 4.1Å; W376-F414 HydrophobicContact CZ3-CG 4.17Å
377	L	76	Confident	66.6	Low	1 Å²	1	67.9 Å²	67.9	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-65.2	-34.4	173.1	-74.6	172.1	0	0	0	112.1	W370 F373 K374 S375 I438 L443 S447 H450 Y451 I454	W370-L377 HydrophobicContact CH2-CD1 3.81Å; W370-L377 HydrophobicContact CZ3-CD1 3.96Å; F373-L377 WeakPolarHBondContact O-CG 3.3Å; F373-L377 PolarHBondContact O-N 3.48Å; K374-L377 PolarHBondContact O-N 3.36Å; S375-L377 PolarHBondContact O-N 3.31Å; L377-I438 HydrophobicContact CD1-CD1 4.17Å; L377-L443 HydrophobicContact CB-CD2 4.31Å; L377-S447 WeakPolarHBondContact O-CB 3.02Å; L377-S447 PolarHBondContact O-OG 3.16Å; L377-H450 HydrophobicContact CD2-CB 3.71Å; L377-Y451 HydrophobicContact CD1-CD2 4.29Å; L377-I454 HydrophobicContact CD1-CD1 4.27Å
378	S	70.5	Confident	64.3	Low	57 Å²	57	67.2 Å²	67.2	40%	0.399	38%	0.375	S	S	.	.	H	α-helix	trans	-78	-37	-177.9	72	0	0	0	0	114	K374 S375 W376 G380	K374-S378 PolarHBondContact O-N 2.71Å; K374-S378 PolarHBondContact O-OG 2.83Å; S375-S378 WeakPolarHBondContact CA-OG 3.49Å; S375-S378 WeakPolarHBondContact O-CA 3.49Å; S375-S378 PolarHBondContact O-N 2.74Å; S375-S378 PolarHBondContact O-OG 3.16Å; W376-S378 VanDerWaalsContact C-N 3.31Å; W376-S378 PolarHBondContact O-N 3.12Å; S378-G380 PolarHBondContact O-N 2.64Å
379	T	64.6	Low	62.6	Low	105 Å²	105	69 Å²	69	64%	0.644	39%	0.394	S	S	*	.	H	α-helix	trans	-75.3	-14.4	-179.1	52.4	0	0	0	0	112.9	S375 W376	S375-T379 PolarHBondContact O-N 3.04Å; S375-T379 PolarHBondContact O-OG1 3.25Å; W376-T379 PolarHBondContact O-OG1 3.43Å
380	G	55.8	Low	61	Low	14 Å²	14	74.9 Å²	74.9	14%	0.144	42%	0.424	C	S	.	.			trans	78	152.2	-175	0	0	0	0	0	111.4	S378 D382	S378-G380 PolarHBondContact O-N 2.64Å; G380-D382 PolarHBondContact O-N 2.61Å
381	F	55.1	Low	59.6	Low	36 Å²	36	76.5 Å²	76.5	16%	0.158	43%	0.432	C	S	.	.	S	Bend	trans	-56.8	127.9	167	-76.4	-97	0	0	0	108	W376 T383 R411 Q446 H450	W376-F381 HydrophobicContact CH2-CD1 4.3Å; W376-F381 AromaticContact CH2-CE1 3.33Å; W376-F381 HydrophobicContact CH2-CE1 3.33Å; W376-F381 AromaticContact CH2-CE2 3.73Å; W376-F381 HydrophobicContact CH2-CE2 3.73Å; W376-F381 AromaticContact CH2-CZ 3Å; W376-F381 HydrophobicContact CH2-CZ 3Å; W376-F381 AromaticContact CZ2-CD1 3.89Å; W376-F381 HydrophobicContact CZ2-CD1 3.89Å; W376-F381 AromaticContact CZ2-CE1 3.25Å; W376-F381 HydrophobicContact CZ2-CE1 3.25Å; W376-F381 HydrophobicContact CZ2-CE2 4.2Å; W376-F381 AromaticContact CZ2-CZ 3.46Å; W376-F381 HydrophobicContact CZ2-CZ 3.46Å; W376-F381 VanDerWaalsContact CZ2-CZ 3.46Å; W376-F381 HydrophobicContact CZ3-CE1 4.41Å; W376-F381 HydrophobicContact CZ3-CE2 4.06Å; W376-F381 AromaticContact CZ3-CZ 3.75Å; W376-F381 HydrophobicContact CZ3-CZ 3.75Å; F381-T383 PolarHBondContact O-N 3.13Å; F381-R411 HydrophobicContact CE1-CG 4.45Å; F381-Q446 HydrophobicContact CD2-CB 4.45Å; F381-H450 AromaticContact CE2-CD2 3.78Å; F381-H450 AromaticContact CE2-CE1 3.18Å; F381-H450 WeakPolarHBondContact CE2-CE1 3.23Å; F381-H450 AromaticContact CE2-CG 3.73Å; F381-H450 AromaticContact CE2-ND1 3.37Å; F381-H450 WeakPolarHBondContact CE2-ND1 3.3Å; F381-H450 AromaticContact CE2-NE2 3.45Å; F381-H450 WeakPolarHBondContact CE2-NE2 3.14Å; F381-H450 AromaticContact CZ-CD2 3.55Å; F381-H450 AromaticContact CZ-CE1 3.43Å; F381-H450 VanDerWaalsContact CZ-CE1 3.43Å; F381-H450 WeakPolarHBondContact CZ-CE1 3.47Å; F381-H450 AromaticContact CZ-CG 3.99Å; F381-H450 AromaticContact CZ-ND1 3.92Å; F381-H450 AromaticContact CZ-NE2 3.17Å; F381-H450 WeakPolarHBondContact CZ-NE2 3.49Å
382	D	42.5	Very low	58.9	Low	143 Å²	143	74.8 Å²	74.8	77%	0.765	43%	0.425	S	S	*	.			trans	-44.5	113.5	172	-98.8	-34.9	0	0	0	109	G380 S384	G380-D382 PolarHBondContact O-N 2.61Å; D382-S384 PolarHBondContact O-N 2.95Å
383	T	40.6	Very low	58.1	Low	104 Å²	104	74.7 Å²	74.7	64%	0.638	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	15.6	-173.1	55.9	0	0	0	0	113.2	F381 R386	F381-T383 PolarHBondContact O-N 3.13Å; T383-R386 WeakPolarHBondContact O-CG 3.45Å
384	S	41.2	Very low	57.4	Low	97 Å²	97	77.7 Å²	77.7	68%	0.678	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-31.8	177.3	55.7	0	0	0	0	112.2	D382 R386	D382-S384 PolarHBondContact O-N 2.95Å; S384-R386 VanDerWaalsContact C-N 3.26Å; S384-R386 PolarHBondContact O-N 3.43Å
385	N	41.6	Very low	57.2	Low	126 Å²	126	74.2 Å²	74.2	67%	0.674	44%	0.435	S	S	*	.			trans	-86.3	65.8	172.8	-78.1	-11.6	0	0	0	111.2	S387	N385-S387 PolarHBondContact O-N 3.35Å; N385-S387 VanDerWaalsContact O-N 3.1Å
386	R	39.9	Very low	57.5	Low	211 Å²	211	72.8 Å²	72.8	80%	0.796	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	0.7	-175.5	-107.9	175.3	-161.7	-154	4.7	116	T383 S384	T383-R386 WeakPolarHBondContact O-CG 3.45Å; S384-R386 VanDerWaalsContact C-N 3.26Å; S384-R386 PolarHBondContact O-N 3.43Å
387	S	38.9	Very low	57.8	Low	115 Å²	115	71.3 Å²	71.3	80%	0.804	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-13.8	-170.1	51.5	0	0	0	0	117.1	N385 G389	N385-S387 PolarHBondContact O-N 3.35Å; N385-S387 VanDerWaalsContact O-N 3.1Å; S387-G389 PolarHBondContact O-N 2.79Å
388	S	37.7	Very low	57.9	Low	77 Å²	77	75.9 Å²	75.9	54%	0.538	44%	0.438	S	S	.	.	S	Bend	trans	-103.3	86.4	-177.8	56	0	0	0	0	113.1
389	G	47.9	Very low	58.3	Low	39 Å²	39	74.8 Å²	74.8	40%	0.402	43%	0.43	S	S	.	.			trans	97.8	52.8	155.3	0	0	0	0	0	116.6	S387 F391	S387-G389 PolarHBondContact O-N 2.79Å; G389-F391 PolarHBondContact O-N 3.32Å
390	L	53.7	Low	58.9	Low	124 Å²	124	69.9 Å²	69.9	65%	0.649	40%	0.399	S	S	*	.			trans	-51.7	129.4	162.5	-84.6	108.6	0	0	0	109.8	T392	L390-T392 PolarHBondContact O-N 3.44Å
391	F	59.5	Low	59.9	Low	39 Å²	39	71.5 Å²	71.5	17%	0.171	40%	0.401	C	S	.	.			trans	-58.1	108.9	169.2	-67.9	-88	0	0	0	107.8	G389 M395 W400 V404 Q446 S449 H450	G389-F391 PolarHBondContact O-N 3.32Å; F391-M395 HydrophobicContact CB-CE 4.38Å; F391-M395 HydrophobicContact CD1-CE 3.28Å; F391-M395 HydrophobicContact CD1-SD 4.47Å; F391-M395 HydrophobicContact CE1-CE 3.87Å; F391-M395 HydrophobicContact CG-CE 4.23Å; F391-W400 AromaticContact CD1-CD1 3.89Å; F391-W400 AromaticContact CE1-CD1 3.54Å; F391-W400 AromaticContact CE1-NE1 3.89Å; F391-V404 HydrophobicContact CE1-CG2 4.07Å; F391-V404 HydrophobicContact CZ-CG2 4.1Å; F391-Q446 HydrophobicContact CD2-CG 4.16Å; F391-Q446 HydrophobicContact CE2-CB 4.43Å; F391-Q446 HydrophobicContact CE2-CG 4.21Å; F391-S449 WeakPolarHBondContact CD1-OG 3.32Å; F391-S449 WeakPolarHBondContact CE1-OG 3.48Å; F391-S449 WeakPolarHBondContact CZ-OG 3.42Å; F391-H450 AromaticContact CE2-CE1 3.97Å; F391-H450 AromaticContact CZ-CE1 3.97Å
392	T	67.7	Low	60.6	Low	57 Å²	57	73 Å²	73	35%	0.35	42%	0.416	S	S	.	.			trans	-90.3	147.8	177.6	55.3	0	0	0	0	110.3	L390 S394 M395 Q518	L390-T392 PolarHBondContact O-N 3.44Å; T392-S394 PolarHBondContact O-N 2.8Å; T392-S394 VanDerWaalsContact O-N 3.13Å; T392-S394 PolarHBondContact OG1-OG 2.98Å; T392-M395 VanDerWaalsContact O-CB 3.27Å; T392-M395 WeakPolarHBondContact O-CB 3.06Å; T392-M395 PolarHBondContact O-N 3.37Å; T392-M395 PolarHBondContact OG1-N 3.12Å; T392-Q518 PolarHBondContact O-NE2 3.08Å
393	P	66.1	Low	61.7	Low	31 Å²	31	70.2 Å²	70.2	20%	0.201	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-28.6	172.9	-25.8	32.9	0	0	0	113.8	D595 I599	P393-D595 HydrophobicContact CB-CB 4.13Å; P393-D595 HydrophobicContact CG-CB 3.75Å; P393-D595 VanDerWaalsContact CG-OD1 3.31Å; P393-D595 WeakPolarHBondContact CG-OD1 3.49Å; P393-I599 HydrophobicContact CB-CD1 4.27Å; P393-I599 HydrophobicContact CB-CG1 3.86Å; P393-I599 WeakPolarHBondContact O-CG1 3.47Å
394	S	70.1	Confident	62.8	Low	69 Å²	69	65.4 Å²	65.4	48%	0.483	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	5.5	179.9	58.6	0	0	0	0	114.7	T392 Q602	T392-S394 PolarHBondContact O-N 2.8Å; T392-S394 VanDerWaalsContact O-N 3.13Å; T392-S394 PolarHBondContact OG1-OG 2.98Å; S394-Q602 PolarHBondContact O-OE1 3.18Å
395	M	79.3	Confident	63.7	Low	6 Å²	6	67.2 Å²	67.2	3%	0.03	36%	0.363	C	S	.	.			trans	-69.9	135.4	178.3	-166.6	168.1	64.2	0	0	109.5	F391 T392 C399 W400 K403 Y522 Q602	F391-M395 HydrophobicContact CB-CE 4.38Å; F391-M395 HydrophobicContact CD1-CE 3.28Å; F391-M395 HydrophobicContact CD1-SD 4.47Å; F391-M395 HydrophobicContact CE1-CE 3.87Å; F391-M395 HydrophobicContact CG-CE 4.23Å; T392-M395 VanDerWaalsContact O-CB 3.27Å; T392-M395 WeakPolarHBondContact O-CB 3.06Å; T392-M395 PolarHBondContact O-N 3.37Å; T392-M395 PolarHBondContact OG1-N 3.12Å; M395-C399 HydrophobicContact CG-CB 3.77Å; M395-W400 HydrophobicContact CE-CB 3.64Å; M395-W400 HydrophobicContact CE-CG 4.13Å; M395-K403 HydrophobicContact SD-CD 3.78Å; M395-Y522 PolarHBondContact O-OH 3.2Å; M395-Q602 VanDerWaalsContact O-CG 3.28Å; M395-Q602 WeakPolarHBondContact O-CG 3.25Å
396	S	82.5	Confident	64.3	Low	36 Å²	36	62.1 Å²	62.1	25%	0.252	34%	0.337	S	S	.	.			trans	-79.7	159	174.7	60.2	0	0	0	0	112.1	R398 C399 W400 D606	S396-R398 VanDerWaalsContact C-N 3.32Å; S396-R398 PolarHBondContact O-N 2.93Å; S396-C399 CarbonylContact O-C 3.52Å; S396-C399 WeakPolarHBondContact O-CB 3.35Å; S396-C399 PolarHBondContact O-N 3.16Å; S396-C399 VanDerWaalsContact O-N 3.1Å; S396-C399 VanDerWaalsContact OG-CB 3.26Å; S396-C399 WeakPolarHBondContact OG-CB 3.3Å; S396-C399 PolarHBondContact OG-N 3.47Å; S396-W400 PolarHBondContact O-N 2.92Å; S396-D606 WeakPolarHBondContact CA-OD2 3.35Å; S396-D606 VanDerWaalsContact CB-OD1 3.22Å; S396-D606 WeakPolarHBondContact CB-OD1 3.47Å
397	F	81.9	Confident	64.6	Low	10 Å²	10	61.1 Å²	61.1	4%	0.044	34%	0.341	C	S	.	.	H	α-helix	trans	-49.6	-50.3	171.7	168.7	-110	0	0	0	112.1	C399 W400 Y401 Y522 V525 M526 E529 D606	F397-C399 VanDerWaalsContact C-N 3.28Å; F397-C399 PolarHBondContact O-N 3.24Å; F397-W400 AromaticContact CD2-CE3 3.89Å; F397-W400 HydrophobicContact CD2-CE3 3.89Å; F397-W400 HydrophobicContact CD2-CZ3 4.28Å; F397-W400 AromaticContact CE2-CE3 3.84Å; F397-W400 HydrophobicContact CE2-CE3 3.84Å; F397-W400 AromaticContact CE2-CZ3 3.83Å; F397-W400 HydrophobicContact CE2-CZ3 3.83Å; F397-W400 WeakPolarHBondContact O-CB 3.18Å; F397-W400 PolarHBondContact O-N 3.13Å; F397-W400 VanDerWaalsContact O-N 3.12Å; F397-Y401 HydrophobicContact CE2-CD2 4.18Å; F397-Y401 AromaticContact CZ-CD2 3.96Å; F397-Y401 HydrophobicContact CZ-CD2 3.96Å; F397-Y401 HydrophobicContact CZ-CG 4.27Å; F397-Y401 WeakPolarHBondContact O-CB 3.5Å; F397-Y401 PolarHBondContact O-N 3.19Å; F397-Y522 HydrophobicContact CB-CD1 3.69Å; F397-Y522 HydrophobicContact CB-CE1 3.91Å; F397-Y522 HydrophobicContact CB-CG 4.37Å; F397-Y522 AromaticContact CD2-CD1 4Å; F397-Y522 HydrophobicContact CD2-CD1 4Å; F397-Y522 AromaticContact CD2-CG 3.83Å; F397-Y522 HydrophobicContact CD2-CG 3.83Å; F397-Y522 HydrophobicContact CG-CD1 4.33Å; F397-V525 HydrophobicContact CB-CB 4.42Å; F397-V525 HydrophobicContact CB-CG1 3.96Å; F397-V525 HydrophobicContact CD1-CG1 3.7Å; F397-V525 HydrophobicContact CE1-CG1 4.42Å; F397-V525 HydrophobicContact CG-CB 4.24Å; F397-V525 HydrophobicContact CG-CG1 3.78Å; F397-M526 HydrophobicContact CE1-CG 4.19Å; F397-M526 HydrophobicContact CE2-CG 3.46Å; F397-M526 VanDerWaalsContact CE2-CG 3.46Å; F397-M526 HydrophobicContact CE2-SD 3.98Å; F397-M526 HydrophobicContact CZ-CG 3.24Å; F397-M526 HydrophobicContact CZ-SD 4.01Å; F397-E529 WeakPolarHBondContact CE1-OE2 3.34Å; F397-D606 HydrophobicContact CB-CB 4.39Å; F397-D606 PolarHBondContact N-OD2 3.1Å
398	R	79.5	Confident	65	Low	98 Å²	98	59.6 Å²	59.6	37%	0.37	33%	0.33	S	S	.	.	H	α-helix	trans	-60.7	-38.6	180	-66.7	-175.9	-178.6	171.3	3.4	112.3	S396 S402 E529 N611	S396-R398 VanDerWaalsContact C-N 3.32Å; S396-R398 PolarHBondContact O-N 2.93Å; R398-S402 WeakPolarHBondContact O-CB 3.46Å; R398-S402 PolarHBondContact O-N 2.65Å; R398-S402 PolarHBondContact O-OG 3.43Å; R398-E529 IonicContact CZ-OE1 3.9Å; R398-E529 IonicContact NE-OE1 2.84Å; R398-E529 PolarHBondContact NE-OE1 3.47Å; R398-E529 IonicContact NH2-OE1 3.05Å; R398-E529 PolarHBondContact NH2-OE1 3.23Å; R398-N611 PolarHBondContact NH2-OD1 2.89Å
399	C	77.6	Confident	65.8	Low	34 Å²	34	61.7 Å²	61.7	23%	0.23	33%	0.331	C	S	.	.	H	α-helix	trans	-71.7	-36.9	176.8	-172.8	0	0	0	0	111.9	M395 S396 F397 S402 K403	M395-C399 HydrophobicContact CG-CB 3.77Å; S396-C399 CarbonylContact O-C 3.52Å; S396-C399 WeakPolarHBondContact O-CB 3.35Å; S396-C399 PolarHBondContact O-N 3.16Å; S396-C399 VanDerWaalsContact O-N 3.1Å; S396-C399 VanDerWaalsContact OG-CB 3.26Å; S396-C399 WeakPolarHBondContact OG-CB 3.3Å; S396-C399 PolarHBondContact OG-N 3.47Å; F397-C399 VanDerWaalsContact C-N 3.28Å; F397-C399 PolarHBondContact O-N 3.24Å; C399-S402 PolarHBondContact O-OG 3.08Å; C399-K403 WeakPolarHBondContact O-CB 3.47Å; C399-K403 VanDerWaalsContact O-CG 3.24Å; C399-K403 WeakPolarHBondContact O-CG 3.41Å; C399-K403 PolarHBondContact O-N 2.8Å; C399-K403 WeakPolarHBondContact SG-CE 3.45Å
400	W	78.6	Confident	66	Low	1 Å²	1	62.2 Å²	62.2	0%	0.004	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-54.9	171.1	173.6	80.2	0	0	0	110.6	F391 M395 S396 F397 S402 K403 V404 S449 F453 A456 Y522	F391-W400 AromaticContact CD1-CD1 3.89Å; F391-W400 AromaticContact CE1-CD1 3.54Å; F391-W400 AromaticContact CE1-NE1 3.89Å; M395-W400 HydrophobicContact CE-CB 3.64Å; M395-W400 HydrophobicContact CE-CG 4.13Å; S396-W400 PolarHBondContact O-N 2.92Å; F397-W400 AromaticContact CD2-CE3 3.89Å; F397-W400 HydrophobicContact CD2-CE3 3.89Å; F397-W400 HydrophobicContact CD2-CZ3 4.28Å; F397-W400 AromaticContact CE2-CE3 3.84Å; F397-W400 HydrophobicContact CE2-CE3 3.84Å; F397-W400 AromaticContact CE2-CZ3 3.83Å; F397-W400 HydrophobicContact CE2-CZ3 3.83Å; F397-W400 WeakPolarHBondContact O-CB 3.18Å; F397-W400 PolarHBondContact O-N 3.13Å; F397-W400 VanDerWaalsContact O-N 3.12Å; W400-S402 VanDerWaalsContact C-N 3.31Å; W400-S402 PolarHBondContact O-N 2.87Å; W400-K403 PolarHBondContact O-N 3.23Å; W400-V404 WeakPolarHBondContact O-CB 3.37Å; W400-V404 WeakPolarHBondContact O-CG2 3.47Å; W400-V404 PolarHBondContact O-N 3.11Å; W400-S449 PolarHBondContact NE1-OG 2.84Å; W400-F453 HydrophobicContact CH2-CB 4.32Å; W400-F453 HydrophobicContact CH2-CD2 4.03Å; W400-F453 HydrophobicContact CZ2-CB 4.03Å; W400-F453 HydrophobicContact CZ2-CD2 4.21Å; W400-F453 HydrophobicContact CZ3-CD2 4.46Å; W400-A456 HydrophobicContact CH2-CB 3.79Å; W400-A456 HydrophobicContact CZ3-CB 4.25Å; W400-Y522 HydrophobicContact CB-CD2 4Å; W400-Y522 HydrophobicContact CB-CE2 3.46Å; W400-Y522 VanDerWaalsContact CB-CE2 3.46Å; W400-Y522 AromaticContact CD1-CE2 3.7Å; W400-Y522 AromaticContact CD2-CD2 3.49Å; W400-Y522 HydrophobicContact CD2-CD2 3.49Å; W400-Y522 VanDerWaalsContact CD2-CD2 3.49Å; W400-Y522 AromaticContact CD2-CE2 3.84Å; W400-Y522 HydrophobicContact CD2-CE2 3.84Å; W400-Y522 HydrophobicContact CD2-CG 4.45Å; W400-Y522 AromaticContact CE2-CD2 3.98Å; W400-Y522 AromaticContact CE3-CD2 3.74Å; W400-Y522 HydrophobicContact CE3-CD2 3.74Å; W400-Y522 HydrophobicContact CE3-CE2 4.4Å; W400-Y522 HydrophobicContact CE3-CG 4.28Å; W400-Y522 AromaticContact CG-CD2 3.6Å; W400-Y522 HydrophobicContact CG-CD2 3.6Å; W400-Y522 AromaticContact CG-CE2 3.38Å; W400-Y522 HydrophobicContact CG-CE2 3.38Å; W400-Y522 HydrophobicContact CZ3-CD2 4.4Å
401	Y	76.5	Confident	66.3	Low	48 Å²	48	60 Å²	60	19%	0.188	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-41.4	-178.2	-165.7	-86.7	0	0	0	111.2	F397 K405 R422 F453 E460	F397-Y401 HydrophobicContact CE2-CD2 4.18Å; F397-Y401 AromaticContact CZ-CD2 3.96Å; F397-Y401 HydrophobicContact CZ-CD2 3.96Å; F397-Y401 HydrophobicContact CZ-CG 4.27Å; F397-Y401 WeakPolarHBondContact O-CB 3.5Å; F397-Y401 PolarHBondContact O-N 3.19Å; Y401-K405 WeakPolarHBondContact O-CB 3.31Å; Y401-K405 PolarHBondContact O-N 3.42Å; Y401-R422 PolarHBondContact OH-NH2 2.95Å; Y401-F453 HydrophobicContact CD2-CE2 4.29Å; Y401-F453 HydrophobicContact CE2-CE2 4.29Å; Y401-E460 PolarHBondContact OH-OE1 3.32Å; Y401-E460 PolarHBondContact OH-OE2 2.84Å
402	S	69.6	Low	66.8	Low	67 Å²	67	61.4 Å²	61.4	47%	0.469	32%	0.317	S	S	.	.	H	α-helix	trans	-73.1	-38.4	177.2	77.8	0	0	0	0	113.7	R398 C399 W400 K405	R398-S402 WeakPolarHBondContact O-CB 3.46Å; R398-S402 PolarHBondContact O-N 2.65Å; R398-S402 PolarHBondContact O-OG 3.43Å; C399-S402 PolarHBondContact O-OG 3.08Å; W400-S402 VanDerWaalsContact C-N 3.31Å; W400-S402 PolarHBondContact O-N 2.87Å; S402-K405 CarbonylContact O-C 3.51Å; S402-K405 PolarHBondContact O-N 3.1Å
403	K	65.6	Low	67.2	Low	86 Å²	86	58.9 Å²	58.9	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-73.4	-30.3	180	-79.9	177.3	174.3	170.5	0	113	M395 C399 W400 K405 R411	M395-K403 HydrophobicContact SD-CD 3.78Å; C399-K403 WeakPolarHBondContact O-CB 3.47Å; C399-K403 VanDerWaalsContact O-CG 3.24Å; C399-K403 WeakPolarHBondContact O-CG 3.41Å; C399-K403 PolarHBondContact O-N 2.8Å; C399-K403 WeakPolarHBondContact SG-CE 3.45Å; W400-K403 PolarHBondContact O-N 3.23Å; K403-K405 VanDerWaalsContact C-N 3.28Å; K403-R411 PolarHBondContact O-NH1 3.25Å
404	V	63.4	Low	67.8	Low	2 Å²	2	57.4 Å²	57.4	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-72.8	-28.2	173.5	-176.7	0	0	0	0	110.2	F391 W400 P406 F453	F391-V404 HydrophobicContact CE1-CG2 4.07Å; F391-V404 HydrophobicContact CZ-CG2 4.1Å; W400-V404 WeakPolarHBondContact O-CB 3.37Å; W400-V404 WeakPolarHBondContact O-CG2 3.47Å; W400-V404 PolarHBondContact O-N 3.11Å; V404-P406 WeakPolarHBondContact O-CD 3.4Å; V404-F453 HydrophobicContact CB-CD2 3.79Å; V404-F453 HydrophobicContact CB-CE2 3.86Å; V404-F453 HydrophobicContact CB-CG 4.21Å; V404-F453 HydrophobicContact CB-CZ 4.32Å; V404-F453 HydrophobicContact CG1-CB 3.91Å; V404-F453 HydrophobicContact CG1-CD1 3.55Å; V404-F453 HydrophobicContact CG1-CD2 3.44Å; V404-F453 VanDerWaalsContact CG1-CD2 3.44Å; V404-F453 HydrophobicContact CG1-CE1 3.79Å; V404-F453 HydrophobicContact CG1-CE2 3.7Å; V404-F453 HydrophobicContact CG1-CG 3.34Å; V404-F453 HydrophobicContact CG1-CZ 3.86Å; V404-F453 HydrophobicContact CG2-CD2 4.43Å
405	K	59.6	Low	68	Low	135 Å²	135	55.4 Å²	55.4	59%	0.587	28%	0.276	S	S	*	.	S	Bend	trans	-78.7	102.9	170.2	-161.9	179.5	-172	175.5	0	111.1	Y401 S402 K403	Y401-K405 WeakPolarHBondContact O-CB 3.31Å; Y401-K405 PolarHBondContact O-N 3.42Å; S402-K405 CarbonylContact O-C 3.51Å; S402-K405 PolarHBondContact O-N 3.1Å; K403-K405 VanDerWaalsContact C-N 3.28Å
406	P	54.5	Low	68	Low	20 Å²	20	56.2 Å²	56.2	13%	0.13	28%	0.28	C	S	.	.			trans	-113.6	156.8	-151.6	39.7	-31.7	0	0	0	115.7	V404 R411 Q412 V415	V404-P406 WeakPolarHBondContact O-CD 3.4Å; P406-R411 HydrophobicContact CB-CB 3.42Å; P406-R411 VanDerWaalsContact CB-CB 3.42Å; P406-R411 HydrophobicContact CB-CG 3.55Å; P406-R411 HydrophobicContact CG-CB 3.22Å; P406-R411 HydrophobicContact CG-CG 3.54Å; P406-R411 VanDerWaalsContact CG-O 3.23Å; P406-R411 WeakPolarHBondContact CG-O 3.1Å; P406-Q412 WeakPolarHBondContact O-CG 3.27Å; P406-V415 HydrophobicContact CG-CG2 4.15Å
407	E	46.7	Very low	68.2	Low	189 Å²	189	54.5 Å²	54.5	88%	0.883	27%	0.268	S	S	*	.	S	Bend	trans	-83.6	-22.9	175.8	-64.1	176.8	166.1	0	0	113.3	Q412	E407-Q412 PolarHBondContact O-NE2 3.4Å
408	C	47.7	Very low	68.2	Low	83 Å²	83	54 Å²	54	56%	0.561	27%	0.266	S	S	*	.	S	Bend	trans	-88.4	140.7	-179.6	-69.3	0	0	0	0	113.7	V410 R411 Q412	C408-V410 PolarHBondContact O-N 3.4Å; C408-R411 WeakPolarHBondContact O-CB 3.27Å; C408-R411 PolarHBondContact O-N 2.82Å; C408-Q412 PolarHBondContact O-N 3.09Å
409	E	53.1	Low	68.2	Low	121 Å²	121	51.2 Å²	51.2	57%	0.565	26%	0.261	S	S	*	.	H	α-helix	trans	-48.5	-48.9	-176.8	-65.7	-178.7	170.7	0	0	114.8	R411 Q412 N413	E409-R411 PolarHBondContact O-N 3.43Å; E409-R411 VanDerWaalsContact O-N 3.16Å; E409-Q412 WeakPolarHBondContact O-CB 3.36Å; E409-Q412 PolarHBondContact O-N 2.86Å; E409-Q412 VanDerWaalsContact O-N 3.13Å; E409-N413 PolarHBondContact O-N 3.22Å; E409-N413 VanDerWaalsContact O-N 3.08Å; E409-N413 PolarHBondContact O-OD1 3.49Å
410	V	53.5	Low	68.5	Low	51 Å²	51	49.6 Å²	49.6	31%	0.309	25%	0.25	S	S	.	.	H	α-helix	trans	-57	-37.6	-179.5	-170.2	0	0	0	0	111.8	N342 W376 C408 N413	N342-V410 HydrophobicContact CB-CG2 4.24Å; N342-V410 VanDerWaalsContact ND2-CG2 3.27Å; N342-V410 WeakPolarHBondContact ND2-CG2 3.23Å; W376-V410 HydrophobicContact CZ2-CG1 4.23Å; C408-V410 PolarHBondContact O-N 3.4Å; V410-N413 WeakPolarHBondContact O-CB 3.33Å; V410-N413 PolarHBondContact O-N 3Å
411	R	59.3	Low	68.8	Low	77 Å²	77	49.7 Å²	49.7	29%	0.291	25%	0.251	S	S	.	.	H	α-helix	trans	-86	-29.1	-171.9	-142.3	-165.5	-112.8	-175.1	5.9	108.1	F381 K403 P406 C408 E409 N413 F414 V415	F381-R411 HydrophobicContact CE1-CG 4.45Å; K403-R411 PolarHBondContact O-NH1 3.25Å; P406-R411 HydrophobicContact CB-CB 3.42Å; P406-R411 VanDerWaalsContact CB-CB 3.42Å; P406-R411 HydrophobicContact CB-CG 3.55Å; P406-R411 HydrophobicContact CG-CB 3.22Å; P406-R411 HydrophobicContact CG-CG 3.54Å; P406-R411 VanDerWaalsContact CG-O 3.23Å; P406-R411 WeakPolarHBondContact CG-O 3.1Å; C408-R411 WeakPolarHBondContact O-CB 3.27Å; C408-R411 PolarHBondContact O-N 2.82Å; E409-R411 PolarHBondContact O-N 3.43Å; E409-R411 VanDerWaalsContact O-N 3.16Å; R411-N413 VanDerWaalsContact C-N 3.29Å; R411-N413 PolarHBondContact O-N 3.13Å; R411-F414 PolarHBondContact O-N 3.5Å; R411-V415 PolarHBondContact O-N 3.2Å
412	Q	70.5	Confident	68.9	Low	69 Å²	69	49.7 Å²	49.7	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-60.7	-38.5	167.9	-68.2	175.1	-3.1	0	0	111.3	P406 E407 C408 E409 F414 V415 M416	P406-Q412 WeakPolarHBondContact O-CG 3.27Å; E407-Q412 PolarHBondContact O-NE2 3.4Å; C408-Q412 PolarHBondContact O-N 3.09Å; E409-Q412 WeakPolarHBondContact O-CB 3.36Å; E409-Q412 PolarHBondContact O-N 2.86Å; E409-Q412 VanDerWaalsContact O-N 3.13Å; Q412-F414 VanDerWaalsContact C-N 3.31Å; Q412-F414 PolarHBondContact O-N 2.94Å; Q412-V415 PolarHBondContact O-N 3.03Å; Q412-V415 VanDerWaalsContact O-N 3.14Å; Q412-M416 VanDerWaalsContact O-CG 3.26Å; Q412-M416 WeakPolarHBondContact O-CG 3.42Å; Q412-M416 PolarHBondContact O-N 3.41Å
413	N	76.4	Confident	69.4	Low	3 Å²	3	51.2 Å²	51.2	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-41.5	176.1	-64.6	-12.7	0	0	0	112.2	N342 V345 H346 L349 E409 V410 R411 M416 F417	N342-N413 PolarHBondContact O-ND2 3.13Å; V345-N413 HydrophobicContact CG1-CB 3.94Å; V345-N413 WeakPolarHBondContact CG1-ND2 3.47Å; H346-N413 WeakPolarHBondContact CA-OD1 3.33Å; H346-N413 WeakPolarHBondContact CB-OD1 3.37Å; H346-N413 PolarHBondContact N-OD1 2.9Å; H346-N413 PolarHBondContact ND1-OD1 2.85Å; L349-N413 HydrophobicContact CD1-CB 3.7Å; L349-N413 VanDerWaalsContact CD1-O 3.29Å; L349-N413 WeakPolarHBondContact CD1-O 3.49Å; E409-N413 PolarHBondContact O-N 3.22Å; E409-N413 VanDerWaalsContact O-N 3.08Å; E409-N413 PolarHBondContact O-OD1 3.49Å; V410-N413 WeakPolarHBondContact O-CB 3.33Å; V410-N413 PolarHBondContact O-N 3Å; R411-N413 VanDerWaalsContact C-N 3.29Å; R411-N413 PolarHBondContact O-N 3.13Å; N413-M416 PolarHBondContact O-N 3.37Å; N413-F417 PolarHBondContact O-N 3.19Å
414	F	77.3	Confident	70	Confident	1 Å²	1	48 Å²	48	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-40	175.6	-173.8	-106.5	0	0	0	112.3	F373 W376 R411 Q412 F417 C418 H450 F453 I454	F373-F414 AromaticContact CD1-CD2 3.85Å; F373-F414 HydrophobicContact CD1-CD2 3.85Å; F373-F414 HydrophobicContact CE1-CB 4.43Å; F373-F414 HydrophobicContact CE1-CD2 4.18Å; W376-F414 HydrophobicContact CE3-CD2 4.4Å; W376-F414 HydrophobicContact CH2-CB 4.36Å; W376-F414 HydrophobicContact CH2-CD2 4.39Å; W376-F414 HydrophobicContact CH2-CG 4.37Å; W376-F414 AromaticContact CZ3-CD2 3.78Å; W376-F414 HydrophobicContact CZ3-CD2 3.78Å; W376-F414 HydrophobicContact CZ3-CE2 4.1Å; W376-F414 HydrophobicContact CZ3-CG 4.17Å; R411-F414 PolarHBondContact O-N 3.5Å; Q412-F414 VanDerWaalsContact C-N 3.31Å; Q412-F414 PolarHBondContact O-N 2.94Å; F414-F417 WeakPolarHBondContact O-CB 3.43Å; F414-F417 PolarHBondContact O-N 3.1Å; F414-C418 PolarHBondContact O-N 3.42Å; F414-C418 PolarHBondContact O-SG 3.34Å; F414-H450 HydrophobicContact CE1-CB 4.18Å; F414-H450 HydrophobicContact CZ-CB 4.08Å; F414-H450 WeakPolarHBondContact CZ-O 3.5Å; F414-F453 HydrophobicContact CD1-CD1 4.37Å; F414-F453 AromaticContact CE1-CD1 3.83Å; F414-F453 HydrophobicContact CE1-CD1 3.83Å; F414-I454 HydrophobicContact CE1-CG1 4.32Å; F414-I454 HydrophobicContact CE2-CD1 3.91Å; F414-I454 HydrophobicContact CE2-CG1 4.1Å; F414-I454 HydrophobicContact CZ-CD1 3.73Å; F414-I454 HydrophobicContact CZ-CG1 3.51Å
415	V	75.5	Confident	70.5	Confident	27 Å²	27	49.9 Å²	49.9	16%	0.164	25%	0.246	C	C	.	.	H	α-helix	trans	-66.9	-38.5	175	173	0	0	0	0	112	P406 R411 Q412 F417 C418 S419 F453	P406-V415 HydrophobicContact CG-CG2 4.15Å; R411-V415 PolarHBondContact O-N 3.2Å; Q412-V415 PolarHBondContact O-N 3.03Å; Q412-V415 VanDerWaalsContact O-N 3.14Å; V415-F417 VanDerWaalsContact C-N 3.32Å; V415-C418 WeakPolarHBondContact O-CB 3.39Å; V415-C418 PolarHBondContact O-N 3.15Å; V415-S419 PolarHBondContact O-N 2.86Å; V415-S419 PolarHBondContact O-OG 3.13Å; V415-F453 HydrophobicContact CG2-CE1 4.35Å
416	M	79.7	Confident	71	Confident	22 Å²	22	47.2 Å²	47.2	11%	0.108	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-38.7	174.3	-69.6	169	75.3	0	0	111.4	H346 L349 T350 L353 Q412 N413 S419 L420	H346-M416 PolarHBondContact CE1-SD 2.95Å; H346-M416 PolarHBondContact ND1-SD 2.66Å; H346-M416 VanDerWaalsContact ND1-SD 3.35Å; L349-M416 VanDerWaalsContact C-CE 3.5Å; L349-M416 HydrophobicContact CB-CB 4.1Å; L349-M416 HydrophobicContact CB-CE 3.63Å; L349-M416 HydrophobicContact CB-SD 4.33Å; L349-M416 HydrophobicContact CD1-CB 4.27Å; T350-M416 VanDerWaalsContact CA-CE 3.45Å; T350-M416 WeakPolarHBondContact OG1-CE 3.39Å; L353-M416 HydrophobicContact CD1-CB 4.07Å; L353-M416 HydrophobicContact CD1-CE 3.84Å; L353-M416 HydrophobicContact CD1-CG 4.1Å; Q412-M416 VanDerWaalsContact O-CG 3.26Å; Q412-M416 WeakPolarHBondContact O-CG 3.42Å; Q412-M416 PolarHBondContact O-N 3.41Å; N413-M416 PolarHBondContact O-N 3.37Å; M416-S419 WeakPolarHBondContact O-CB 3.46Å; M416-S419 PolarHBondContact O-N 2.92Å; M416-L420 WeakPolarHBondContact O-CG 3.49Å; M416-L420 PolarHBondContact O-N 3.23Å
417	F	85.2	Confident	71.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-45	170.7	175.4	-110.7	0	0	0	111.8	V366 L369 W370 F373 N413 F414 V415 S419 L420 L421	V366-F417 HydrophobicContact CG1-CE2 4.5Å; L369-F417 HydrophobicContact CB-CD2 4.06Å; L369-F417 HydrophobicContact CB-CE2 3.74Å; L369-F417 HydrophobicContact CD1-CD2 4.17Å; L369-F417 HydrophobicContact CD1-CE2 4.38Å; W370-F417 HydrophobicContact CB-CZ 4.42Å; W370-F417 HydrophobicContact CE3-CE1 4Å; W370-F417 HydrophobicContact CE3-CZ 4.08Å; W370-F417 HydrophobicContact CZ3-CE1 4.4Å; F373-F417 HydrophobicContact CB-CE1 4.43Å; F373-F417 HydrophobicContact CD2-CB 4.04Å; F373-F417 AromaticContact CD2-CD1 3.73Å; F373-F417 HydrophobicContact CD2-CD1 3.73Å; F373-F417 AromaticContact CD2-CD2 3.71Å; F373-F417 HydrophobicContact CD2-CD2 3.71Å; F373-F417 HydrophobicContact CD2-CE1 4.08Å; F373-F417 HydrophobicContact CD2-CE2 4.07Å; F373-F417 AromaticContact CD2-CG 3.53Å; F373-F417 HydrophobicContact CD2-CG 3.53Å; F373-F417 HydrophobicContact CD2-CZ 4.24Å; F373-F417 HydrophobicContact CE1-CB 4.39Å; F373-F417 HydrophobicContact CE2-CB 3.46Å; F373-F417 VanDerWaalsContact CE2-CB 3.46Å; F373-F417 HydrophobicContact CE2-CD1 4.07Å; F373-F417 AromaticContact CE2-CD2 3.63Å; F373-F417 HydrophobicContact CE2-CD2 3.63Å; F373-F417 HydrophobicContact CE2-CE2 4.4Å; F373-F417 AromaticContact CE2-CG 3.43Å; F373-F417 HydrophobicContact CE2-CG 3.43Å; F373-F417 VanDerWaalsContact CE2-CG 3.43Å; F373-F417 HydrophobicContact CG-CD1 4.09Å; F373-F417 HydrophobicContact CG-CE1 4.4Å; F373-F417 HydrophobicContact CG-CG 4.29Å; F373-F417 HydrophobicContact CZ-CB 3.65Å; F373-F417 HydrophobicContact CZ-CG 4.1Å; N413-F417 PolarHBondContact O-N 3.19Å; F414-F417 WeakPolarHBondContact O-CB 3.43Å; F414-F417 PolarHBondContact O-N 3.1Å; V415-F417 VanDerWaalsContact C-N 3.32Å; F417-S419 VanDerWaalsContact C-N 3.26Å; F417-S419 PolarHBondContact O-N 3.03Å; F417-L420 WeakPolarHBondContact O-CB 3.26Å; F417-L420 PolarHBondContact O-N 2.99Å; F417-L420 VanDerWaalsContact O-N 3.13Å; F417-L421 HydrophobicContact CD1-CD1 4.17Å; F417-L421 HydrophobicContact CE1-CD1 3.67Å; F417-L421 HydrophobicContact CE1-CG 4.17Å; F417-L421 HydrophobicContact CE2-CD2 4.23Å; F417-L421 HydrophobicContact CE2-CG 4.33Å; F417-L421 HydrophobicContact CZ-CD1 3.95Å; F417-L421 HydrophobicContact CZ-CD2 3.96Å; F417-L421 HydrophobicContact CZ-CG 4.05Å; F417-L421 WeakPolarHBondContact O-CG 3.09Å; F417-L421 PolarHBondContact O-N 2.96Å
418	C	82.2	Confident	73.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-38.6	173.4	-63.1	0	0	0	0	111.8	F414 V415 L420 L421 R422 N457	F414-C418 PolarHBondContact O-N 3.42Å; F414-C418 PolarHBondContact O-SG 3.34Å; V415-C418 WeakPolarHBondContact O-CB 3.39Å; V415-C418 PolarHBondContact O-N 3.15Å; C418-L420 VanDerWaalsContact C-N 3.34Å; C418-L420 PolarHBondContact O-N 3.34Å; C418-L421 WeakPolarHBondContact O-CB 3.35Å; C418-L421 PolarHBondContact O-N 3.35Å; C418-R422 WeakPolarHBondContact O-CG 3.1Å; C418-R422 PolarHBondContact O-N 2.88Å; C418-R422 VanDerWaalsContact O-N 3.13Å; C418-N457 HydrophobicContact CB-CB 4.21Å
419	S	80.7	Confident	74.9	Confident	39 Å²	39	41.7 Å²	41.7	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-67.1	-34.3	176.6	-54	0	0	0	0	112.4	V415 M416 F417	V415-S419 PolarHBondContact O-N 2.86Å; V415-S419 PolarHBondContact O-OG 3.13Å; M416-S419 WeakPolarHBondContact O-CB 3.46Å; M416-S419 PolarHBondContact O-N 2.92Å; F417-S419 VanDerWaalsContact C-N 3.26Å; F417-S419 PolarHBondContact O-N 3.03Å
420	L	83	Confident	76	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-40.8	172	-74.9	168.8	0	0	0	111.3	L349 L352 L353 I361 L369 M416 F417 C418 R422 R423	L349-L420 HydrophobicContact CD2-CD1 3.6Å; L352-L420 HydrophobicContact CB-CD1 4.09Å; L352-L420 HydrophobicContact CB-CD2 4.02Å; L352-L420 HydrophobicContact CD1-CD1 4.4Å; L353-L420 HydrophobicContact CB-CD2 4.41Å; L353-L420 HydrophobicContact CD2-CD2 3.56Å; L353-L420 HydrophobicContact CD2-CG 3.7Å; L353-L420 HydrophobicContact CG-CD2 3.79Å; L353-L420 HydrophobicContact CG-CG 3.98Å; I361-L420 HydrophobicContact CD1-CB 3.69Å; I361-L420 HydrophobicContact CD1-CD2 3.8Å; I361-L420 HydrophobicContact CD1-CG 4.25Å; L369-L420 HydrophobicContact CD1-CD1 4.15Å; M416-L420 WeakPolarHBondContact O-CG 3.49Å; M416-L420 PolarHBondContact O-N 3.23Å; F417-L420 WeakPolarHBondContact O-CB 3.26Å; F417-L420 PolarHBondContact O-N 2.99Å; F417-L420 VanDerWaalsContact O-N 3.13Å; C418-L420 VanDerWaalsContact C-N 3.34Å; C418-L420 PolarHBondContact O-N 3.34Å; L420-R422 VanDerWaalsContact C-N 3.32Å; L420-R422 PolarHBondContact O-N 3.21Å; L420-R423 PolarHBondContact O-N 2.92Å; L420-R423 VanDerWaalsContact O-N 3.14Å
421	L	84.6	Confident	77.4	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-40.5	176.9	-69	178.4	0	0	0	112.2	V366 F417 C418 R423 L424 L432 I454 L458	V366-L421 HydrophobicContact CB-CD2 4.36Å; V366-L421 HydrophobicContact CG1-CD2 3.29Å; V366-L421 HydrophobicContact CG2-CD2 4.16Å; F417-L421 HydrophobicContact CD1-CD1 4.17Å; F417-L421 HydrophobicContact CE1-CD1 3.67Å; F417-L421 HydrophobicContact CE1-CG 4.17Å; F417-L421 HydrophobicContact CE2-CD2 4.23Å; F417-L421 HydrophobicContact CE2-CG 4.33Å; F417-L421 HydrophobicContact CZ-CD1 3.95Å; F417-L421 HydrophobicContact CZ-CD2 3.96Å; F417-L421 HydrophobicContact CZ-CG 4.05Å; F417-L421 WeakPolarHBondContact O-CG 3.09Å; F417-L421 PolarHBondContact O-N 2.96Å; C418-L421 WeakPolarHBondContact O-CB 3.35Å; C418-L421 PolarHBondContact O-N 3.35Å; L421-R423 PolarHBondContact O-N 3.2Å; L421-L424 HydrophobicContact CD2-CD1 4.18Å; L421-L424 WeakPolarHBondContact O-CB 3.21Å; L421-L424 PolarHBondContact O-N 3.32Å; L421-L432 HydrophobicContact CD2-CD1 3.9Å; L421-I454 HydrophobicContact CD1-CG2 3.51Å; L421-L458 HydrophobicContact CB-CD2 3.95Å
422	R	78.8	Confident	78.6	Confident	49 Å²	49	38.2 Å²	38.2	19%	0.185	21%	0.21	C	C	.	.	H	α-helix	trans	-58.9	-26.1	175.8	-67.7	-172.7	-166.8	-150.4	-0.1	113.3	Y401 C418 L420 N457 E460 E461	Y401-R422 PolarHBondContact OH-NH2 2.95Å; C418-R422 WeakPolarHBondContact O-CG 3.1Å; C418-R422 PolarHBondContact O-N 2.88Å; C418-R422 VanDerWaalsContact O-N 3.13Å; L420-R422 VanDerWaalsContact C-N 3.32Å; L420-R422 PolarHBondContact O-N 3.21Å; R422-N457 PolarHBondContact NE-OD1 3.48Å; R422-N457 PolarHBondContact NH2-OD1 2.93Å; R422-E460 IonicContact CZ-OE1 2.79Å; R422-E460 IonicContact CZ-OE2 3.07Å; R422-E460 IonicContact NH1-OE1 3.97Å; R422-E460 PolarHBondContact NH1-OE1 2.93Å; R422-E460 IonicContact NH1-OE2 3.29Å; R422-E460 IonicContact NH2-OE1 3.17Å; R422-E460 PolarHBondContact NH2-OE1 3.35Å; R422-E460 VanDerWaalsContact NH2-OE1 3.14Å; R422-E460 IonicContact NH2-OE2 3.79Å; R422-E460 PolarHBondContact NH2-OE2 3.2Å; R422-E461 HydrophobicContact CB-CB 4.2Å; R422-E461 HydrophobicContact CB-CG 3.96Å; R422-E461 WeakPolarHBondContact CB-OE2 2.95Å; R422-E461 WeakPolarHBondContact CD-OE2 3.38Å; R422-E461 HydrophobicContact CG-CB 3.97Å; R422-E461 HydrophobicContact CG-CG 4.31Å; R422-E461 WeakPolarHBondContact O-CG 3.14Å
423	R	79.4	Confident	79.2	Confident	98 Å²	98	35 Å²	35	37%	0.37	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.1	-177.9	-65.5	178	176.3	-171.5	-7.8	114.2	L353 S356 E357 I361 L420 L421	L353-R423 PolarHBondContact O-NH1 3.08Å; S356-R423 VanDerWaalsContact OG-CD 3.22Å; S356-R423 WeakPolarHBondContact OG-CD 3.41Å; S356-R423 PolarHBondContact OG-NH1 3.15Å; E357-R423 VanDerWaalsContact CG-NH1 3.31Å; E357-R423 IonicContact OE1-CZ 3.61Å; E357-R423 IonicContact OE1-NH1 2.73Å; E357-R423 PolarHBondContact OE1-NH1 3.07Å; E357-R423 IonicContact OE1-NH2 3.94Å; E357-R423 PolarHBondContact OE1-NH2 3.06Å; I361-R423 VanDerWaalsContact CG2-C 3.47Å; I361-R423 HydrophobicContact CG2-CB 4.16Å; I361-R423 WeakPolarHBondContact CG2-O 3.28Å; L420-R423 PolarHBondContact O-N 2.92Å; L420-R423 VanDerWaalsContact O-N 3.14Å; L421-R423 PolarHBondContact O-N 3.2Å
424	L	79.1	Confident	79.5	Confident	19 Å²	19	38.7 Å²	38.7	10%	0.099	22%	0.218	C	C	.	.	S	Bend	trans	-66.9	151.9	176.7	-84.5	164.3	0	0	0	111.5	I361 V366 L421 D428 L432	I361-L424 HydrophobicContact CG2-CB 4.17Å; I361-L424 HydrophobicContact CG2-CD2 3.69Å; I361-L424 HydrophobicContact CG2-CG 3.62Å; V366-L424 HydrophobicContact CB-CD1 4.48Å; V366-L424 HydrophobicContact CG1-CD1 4.34Å; V366-L424 HydrophobicContact CG2-CD1 3.99Å; V366-L424 HydrophobicContact CG2-CD2 4.27Å; V366-L424 HydrophobicContact CG2-CG 4.27Å; L421-L424 HydrophobicContact CD2-CD1 4.18Å; L421-L424 WeakPolarHBondContact O-CB 3.21Å; L421-L424 PolarHBondContact O-N 3.32Å; L424-D428 HydrophobicContact CD2-CB 4.4Å; L424-L432 HydrophobicContact CD1-CD1 3.71Å; L424-L432 HydrophobicContact CD1-CD2 3.66Å; L424-L432 HydrophobicContact CD1-CG 4.14Å
425	S	74.4	Confident	79.8	Confident	41 Å²	41	39.9 Å²	39.9	29%	0.287	23%	0.225	S	C	.	.			trans	-68.3	144.5	175.1	81.1	0	0	0	0	110.7	S427 D428	S425-S427 PolarHBondContact O-N 3.39Å; S425-S427 VanDerWaalsContact O-N 3.14Å; S425-S427 PolarHBondContact OG-OG 2.81Å; S425-D428 PolarHBondContact O-N 3.15Å; S425-D428 PolarHBondContact OG-N 3.37Å; S425-D428 PolarHBondContact OG-OD2 3.47Å
426	P	69.9	Low	80.2	Confident	80 Å²	80	38.7 Å²	38.7	52%	0.519	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-57.6	-28.8	176	-26.3	34.3	0	0	0	113.7	D428 I429	P426-D428 VanDerWaalsContact C-N 3.25Å; P426-D428 PolarHBondContact O-N 3.44Å; P426-I429 HydrophobicContact CB-CD1 4.3Å; P426-I429 WeakPolarHBondContact O-CB 3.37Å; P426-I429 WeakPolarHBondContact O-CG1 3.43Å; P426-I429 PolarHBondContact O-N 2.83Å
427	S	72.6	Confident	80.4	Confident	105 Å²	105	40.7 Å²	40.7	73%	0.734	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-65.9	-23.1	176.2	39.2	0	0	0	0	114.1	S425	S425-S427 PolarHBondContact O-N 3.39Å; S425-S427 VanDerWaalsContact O-N 3.14Å; S425-S427 PolarHBondContact OG-OG 2.81Å
428	D	78.6	Confident	80.2	Confident	48 Å²	48	41.1 Å²	41.1	26%	0.257	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-88.6	-3.3	-178.8	-65.9	-47.7	0	0	0	113	L424 S425 P426 E430 A431 L432	L424-D428 HydrophobicContact CD2-CB 4.4Å; S425-D428 PolarHBondContact O-N 3.15Å; S425-D428 PolarHBondContact OG-N 3.37Å; S425-D428 PolarHBondContact OG-OD2 3.47Å; P426-D428 VanDerWaalsContact C-N 3.25Å; P426-D428 PolarHBondContact O-N 3.44Å; D428-E430 PolarHBondContact O-N 2.89Å; D428-A431 CarbonylContact O-C 3.51Å; D428-A431 PolarHBondContact O-N 3.33Å; D428-L432 WeakPolarHBondContact O-CB 3.32Å; D428-L432 PolarHBondContact O-N 3.2Å
429	I	78.8	Confident	80	Confident	23 Å²	23	45.1 Å²	45.1	12%	0.118	25%	0.254	C	S	.	.	H	α-helix	trans	-65.6	-40.4	-168	-71.3	177.7	0	0	0	112.8	P426 A431 L432 C433 C479 L483	P426-I429 HydrophobicContact CB-CD1 4.3Å; P426-I429 WeakPolarHBondContact O-CB 3.37Å; P426-I429 WeakPolarHBondContact O-CG1 3.43Å; P426-I429 PolarHBondContact O-N 2.83Å; I429-A431 VanDerWaalsContact C-N 3.31Å; I429-A431 PolarHBondContact O-N 3.5Å; I429-L432 WeakPolarHBondContact O-CB 3.36Å; I429-L432 PolarHBondContact O-N 2.72Å; I429-C433 PolarHBondContact O-N 3.36Å; I429-C433 PolarHBondContact O-SG 3.22Å; I429-C479 HydrophobicContact CD1-CB 4.17Å; I429-C479 WeakPolarHBondContact CD1-SG 3.46Å; I429-L483 HydrophobicContact CG2-CD2 3.76Å; I429-L483 HydrophobicContact CG2-CG 3.83Å
430	E	77.4	Confident	79.9	Confident	144 Å²	144	43.6 Å²	43.6	67%	0.673	24%	0.242	S	C	*	.	H	α-helix	trans	-61.5	-42.8	177	-172.2	-178.6	175.4	0	0	111.3	D428 L432 C433 T434	D428-E430 PolarHBondContact O-N 2.89Å; E430-L432 VanDerWaalsContact C-N 3.35Å; E430-C433 WeakPolarHBondContact O-CB 3.28Å; E430-C433 PolarHBondContact O-N 3.3Å; E430-T434 PolarHBondContact O-N 3.33Å; E430-T434 PolarHBondContact O-OG1 2.68Å
431	A	81.2	Confident	79.5	Confident	31 Å²	31	48.2 Å²	48.2	26%	0.256	27%	0.267	S	S	.	.	H	α-helix	trans	-72.9	-28.1	177.2	0	0	0	0	0	112.4	L363 D428 I429 T434 T435	L363-A431 HydrophobicContact CD2-CB 3.38Å; D428-A431 CarbonylContact O-C 3.51Å; D428-A431 PolarHBondContact O-N 3.33Å; I429-A431 VanDerWaalsContact C-N 3.31Å; I429-A431 PolarHBondContact O-N 3.5Å; A431-T434 WeakPolarHBondContact CA-OG1 3.42Å; A431-T434 PolarHBondContact O-OG1 2.73Å; A431-T435 WeakPolarHBondContact O-CB 3.28Å; A431-T435 PolarHBondContact O-N 3.05Å; A431-T435 PolarHBondContact O-OG1 3.18Å
432	L	85.3	Confident	79	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-66.4	-47.1	169.9	178.8	65.8	0	0	0	110.9	L363 V366 L421 L424 D428 I429 E430 T434 T435 L436 L458	L363-L432 HydrophobicContact CD1-CB 4.1Å; L363-L432 HydrophobicContact CD1-CD1 4.21Å; V366-L432 HydrophobicContact CG1-CD1 3.67Å; L421-L432 HydrophobicContact CD2-CD1 3.9Å; L424-L432 HydrophobicContact CD1-CD1 3.71Å; L424-L432 HydrophobicContact CD1-CD2 3.66Å; L424-L432 HydrophobicContact CD1-CG 4.14Å; D428-L432 WeakPolarHBondContact O-CB 3.32Å; D428-L432 PolarHBondContact O-N 3.2Å; I429-L432 WeakPolarHBondContact O-CB 3.36Å; I429-L432 PolarHBondContact O-N 2.72Å; E430-L432 VanDerWaalsContact C-N 3.35Å; L432-T434 VanDerWaalsContact C-N 3.33Å; L432-T434 PolarHBondContact O-N 3.2Å; L432-T435 WeakPolarHBondContact O-CA 3.25Å; L432-T435 VanDerWaalsContact O-CB 3.31Å; L432-T435 WeakPolarHBondContact O-CB 3.41Å; L432-T435 PolarHBondContact O-N 3.29Å; L432-L436 HydrophobicContact CD1-CD1 3.88Å; L432-L436 HydrophobicContact CD1-CD2 4.42Å; L432-L436 HydrophobicContact CD1-CG 3.93Å; L432-L436 HydrophobicContact CD2-CD1 4.28Å; L432-L436 HydrophobicContact CG-CD1 3.8Å; L432-L436 HydrophobicContact CG-CG 4.2Å; L432-L436 WeakPolarHBondContact O-CG 3.46Å; L432-L436 PolarHBondContact O-N 3.34Å; L432-L458 HydrophobicContact CD2-CD1 3.92Å; L432-L458 HydrophobicContact CD2-CD2 3.86Å
433	C	83.4	Confident	78.9	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-56.7	-47.6	179.5	-74.3	0	0	0	0	111.8	I429 E430 T435 L436 K437 W455 N486	I429-C433 PolarHBondContact O-N 3.36Å; I429-C433 PolarHBondContact O-SG 3.22Å; E430-C433 WeakPolarHBondContact O-CB 3.28Å; E430-C433 PolarHBondContact O-N 3.3Å; C433-T435 VanDerWaalsContact C-N 3.28Å; C433-T435 PolarHBondContact O-N 3.31Å; C433-L436 PolarHBondContact O-N 3.06Å; C433-K437 WeakPolarHBondContact O-CG 3.12Å; C433-K437 PolarHBondContact O-N 3.05Å; C433-W455 HydrophobicContact CB-CH2 4.29Å; C433-N486 HydrophobicContact CB-CB 4.06Å; C433-N486 VanDerWaalsContact CB-CG 3.4Å; C433-N486 WeakPolarHBondContact CB-ND2 3.47Å; C433-N486 PolarHBondContact SG-ND2 3.11Å; C433-N486 VanDerWaalsContact SG-ND2 3.44Å
434	T	82.2	Confident	78.7	Confident	81 Å²	81	46.4 Å²	46.4	50%	0.497	28%	0.275	S	S	.	.	H	α-helix	trans	-62.2	-35.8	175.8	54.4	0	0	0	0	112.5	E430 A431 L432	E430-T434 PolarHBondContact O-N 3.33Å; E430-T434 PolarHBondContact O-OG1 2.68Å; A431-T434 WeakPolarHBondContact CA-OG1 3.42Å; A431-T434 PolarHBondContact O-OG1 2.73Å; L432-T434 VanDerWaalsContact C-N 3.33Å; L432-T434 PolarHBondContact O-N 3.2Å
435	T	83.4	Confident	78.4	Confident	26 Å²	26	49.1 Å²	49.1	16%	0.16	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-44.5	176.4	-61.3	0	0	0	0	111.8	R367 W370 A431 L432 C433 K437	R367-T435 HydrophobicContact CB-CG2 4.25Å; R367-T435 HydrophobicContact CG-CG2 3.46Å; R367-T435 VanDerWaalsContact CG-CG2 3.46Å; R367-T435 PolarHBondContact NE-OG1 3.34Å; W370-T435 HydrophobicContact CB-CG2 4.44Å; W370-T435 HydrophobicContact CG-CG2 4.32Å; W370-T435 PolarHBondContact NE1-O 3.34Å; A431-T435 WeakPolarHBondContact O-CB 3.28Å; A431-T435 PolarHBondContact O-N 3.05Å; A431-T435 PolarHBondContact O-OG1 3.18Å; L432-T435 WeakPolarHBondContact O-CA 3.25Å; L432-T435 VanDerWaalsContact O-CB 3.31Å; L432-T435 WeakPolarHBondContact O-CB 3.41Å; L432-T435 PolarHBondContact O-N 3.29Å; C433-T435 VanDerWaalsContact C-N 3.28Å; C433-T435 PolarHBondContact O-N 3.31Å; T435-K437 VanDerWaalsContact C-N 3.26Å; T435-K437 PolarHBondContact O-N 2.89Å
436	L	85.1	Confident	78.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-76.2	-6.4	-175	-66.1	179	0	0	0	114	W370 L432 C433 I438 Y451 I454 W455 L458	W370-L436 HydrophobicContact CD2-CD2 3.53Å; W370-L436 HydrophobicContact CE3-CD2 3.66Å; W370-L436 HydrophobicContact CG-CD2 3.99Å; W370-L436 HydrophobicContact CH2-CD2 4.1Å; W370-L436 HydrophobicContact CZ2-CB 4.32Å; W370-L436 HydrophobicContact CZ2-CD2 3.97Å; W370-L436 WeakPolarHBondContact CZ2-O 3.21Å; W370-L436 HydrophobicContact CZ3-CD2 3.97Å; L432-L436 HydrophobicContact CD1-CD1 3.88Å; L432-L436 HydrophobicContact CD1-CD2 4.42Å; L432-L436 HydrophobicContact CD1-CG 3.93Å; L432-L436 HydrophobicContact CD2-CD1 4.28Å; L432-L436 HydrophobicContact CG-CD1 3.8Å; L432-L436 HydrophobicContact CG-CG 4.2Å; L432-L436 WeakPolarHBondContact O-CG 3.46Å; L432-L436 PolarHBondContact O-N 3.34Å; C433-L436 PolarHBondContact O-N 3.06Å; L436-I438 PolarHBondContact O-N 2.75Å; L436-Y451 WeakPolarHBondContact O-CE2 3.35Å; L436-Y451 PolarHBondContact O-OH 3.39Å; L436-Y451 VanDerWaalsContact O-OH 3.05Å; L436-I454 HydrophobicContact CD1-CG2 4.08Å; L436-W455 HydrophobicContact CB-CH2 4.4Å; L436-W455 HydrophobicContact CB-CZ2 4.04Å; L436-L458 HydrophobicContact CD1-CD1 3.73Å
437	K	82.7	Confident	78.9	Confident	65 Å²	65	46.8 Å²	46.8	28%	0.283	26%	0.263	S	S	.	.			trans	-59.3	122	-179.4	-77.8	-178.3	179	-173.9	0	112.2	C433 T435 N486 E489 I490	C433-K437 WeakPolarHBondContact O-CG 3.12Å; C433-K437 PolarHBondContact O-N 3.05Å; T435-K437 VanDerWaalsContact C-N 3.26Å; T435-K437 PolarHBondContact O-N 2.89Å; K437-N486 WeakPolarHBondContact CE-OD1 3.47Å; K437-N486 PolarHBondContact NZ-OD1 3.49Å; K437-E489 IonicContact NZ-OE1 3.59Å; K437-E489 PolarHBondContact NZ-OE1 2.98Å; K437-E489 IonicContact NZ-OE2 2.64Å; K437-E489 PolarHBondContact NZ-OE2 2.65Å; K437-I490 HydrophobicContact CG-CD1 4.24Å; K437-I490 HydrophobicContact CG-CG1 4.31Å
438	I	81.2	Confident	79.3	Confident	9 Å²	9	41.8 Å²	41.8	5%	0.046	23%	0.229	C	C	.	.			trans	-127.2	135.8	169.6	-68.4	172.3	0	0	0	108.9	W370 K374 L377 L436 L440 L443 Y451	W370-I438 HydrophobicContact CH2-CD1 3.47Å; W370-I438 VanDerWaalsContact CH2-CD1 3.47Å; W370-I438 HydrophobicContact CH2-CG1 4.34Å; W370-I438 HydrophobicContact CZ2-CD1 3.22Å; W370-I438 HydrophobicContact CZ2-CG1 3.64Å; K374-I438 HydrophobicContact CB-CD1 4.24Å; K374-I438 HydrophobicContact CD-CD1 4.31Å; K374-I438 HydrophobicContact CD-CG1 4.11Å; K374-I438 HydrophobicContact CG-CD1 3.79Å; K374-I438 HydrophobicContact CG-CG1 4.11Å; L377-I438 HydrophobicContact CD1-CD1 4.17Å; L436-I438 PolarHBondContact O-N 2.75Å; I438-L440 PolarHBondContact O-N 3.33Å; I438-L443 HydrophobicContact CG2-CD1 4.02Å; I438-L443 HydrophobicContact CG2-CD2 3.89Å; I438-L443 HydrophobicContact CG2-CG 3.91Å; I438-Y451 HydrophobicContact CB-CE2 4.17Å; I438-Y451 HydrophobicContact CD1-CD2 4.19Å; I438-Y451 HydrophobicContact CD1-CE2 4.1Å; I438-Y451 HydrophobicContact CG1-CE2 4.29Å; I438-Y451 PolarHBondContact N-OH 3.35Å
439	P	78.9	Confident	79.4	Confident	83 Å²	83	39.6 Å²	39.6	54%	0.539	22%	0.217	S	C	.	.			trans	-63.8	116.9	172	25.9	-33.1	0	0	0	110.5	L441 S442	P439-L441 PolarHBondContact O-N 3.42Å; P439-S442 PolarHBondContact O-N 3.03Å; P439-S442 PolarHBondContact O-OG 3.42Å
440	L	77.2	Confident	79.5	Confident	7 Å²	7	38.7 Å²	38.7	4%	0.037	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-56	-28.1	-178.4	-68.8	176.7	0	0	0	113.3	I438 S442 L443 Y451 F452 I490 L516	I438-L440 PolarHBondContact O-N 3.33Å; L440-S442 PolarHBondContact O-N 3.47Å; L440-L443 HydrophobicContact CD2-CD1 4.3Å; L440-L443 PolarHBondContact O-N 2.87Å; L440-L443 VanDerWaalsContact O-N 3.17Å; L440-Y451 HydrophobicContact CD2-CD1 4.07Å; L440-Y451 HydrophobicContact CD2-CE1 4.09Å; L440-F452 HydrophobicContact CD2-CE2 4.02Å; L440-I490 HydrophobicContact CD1-CG2 3.82Å; L440-I490 HydrophobicContact CD2-CG2 4.08Å; L440-I490 HydrophobicContact CG-CG2 3.68Å; L440-L516 HydrophobicContact CD1-CD1 4.22Å; L440-L516 HydrophobicContact CD1-CD2 4.2Å
441	L	74.9	Confident	79.9	Confident	98 Å²	98	31.9 Å²	31.9	51%	0.513	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-60.6	-29.9	178	-69.6	172.2	0	0	0	113.3	P439 L443 L494 W508 R512	P439-L441 PolarHBondContact O-N 3.42Å; L441-L443 VanDerWaalsContact C-N 3.31Å; L441-L494 HydrophobicContact CD2-CD1 3.63Å; L441-L494 HydrophobicContact CG-CD1 4.06Å; L441-W508 HydrophobicContact CD2-CG 4.03Å; L441-R512 PolarHBondContact O-NH1 3.41Å
442	S	74.3	Confident	80.2	Confident	63 Å²	63	30.5 Å²	30.5	44%	0.441	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-80.9	-10.8	179.9	68	0	0	0	0	113.6	P439 L440	P439-S442 PolarHBondContact O-N 3.03Å; P439-S442 PolarHBondContact O-OG 3.42Å; L440-S442 PolarHBondContact O-N 3.47Å
443	L	77.2	Confident	80.2	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.169	C	C	.	.			trans	-91.2	142	-172	-65.3	-178	0	0	0	112.2	L377 I438 L440 L441 I448 Y451 R512	L377-L443 HydrophobicContact CB-CD2 4.31Å; I438-L443 HydrophobicContact CG2-CD1 4.02Å; I438-L443 HydrophobicContact CG2-CD2 3.89Å; I438-L443 HydrophobicContact CG2-CG 3.91Å; L440-L443 HydrophobicContact CD2-CD1 4.3Å; L440-L443 PolarHBondContact O-N 2.87Å; L440-L443 VanDerWaalsContact O-N 3.17Å; L441-L443 VanDerWaalsContact C-N 3.31Å; L443-I448 HydrophobicContact CB-CG1 3.73Å; L443-I448 HydrophobicContact CD1-CG1 4.41Å; L443-Y451 HydrophobicContact CD1-CD1 4.25Å; L443-Y451 HydrophobicContact CD1-CG 4.08Å; L443-R512 PolarHBondContact O-NH1 3.42Å
444	T	74.2	Confident	80.3	Confident	47 Å²	47	30.6 Å²	30.6	29%	0.288	17%	0.169	S	C	.	.			trans	-74.7	168.1	169	76.9	0	0	0	0	111.2	Q446 S447 I448	T444-Q446 VanDerWaalsContact C-N 3.32Å; T444-Q446 PolarHBondContact O-N 3.45Å; T444-S447 PolarHBondContact O-N 3.41Å; T444-S447 VanDerWaalsContact O-N 3.14Å; T444-S447 PolarHBondContact OG1-N 3.38Å; T444-S447 PolarHBondContact OG1-OG 3.17Å; T444-I448 WeakPolarHBondContact O-CG1 3.48Å; T444-I448 PolarHBondContact O-N 2.51Å
445	K	73.5	Confident	80.5	Confident	76 Å²	76	26.9 Å²	26.9	33%	0.33	15%	0.146	S	C	.	.	H	α-helix	trans	-48.9	-50	174.2	-71.6	-172.2	-163.1	-172.3	0	112.9	D509 N511 R512 I515	K445-D509 WeakPolarHBondContact CE-OD2 3.43Å; K445-D509 IonicContact NZ-OD2 3.41Å; K445-N511 HydrophobicContact CD-CB 4.03Å; K445-N511 PolarHBondContact NZ-ND2 3.46Å; K445-R512 HydrophobicContact CG-CG 3.82Å; K445-I515 HydrophobicContact CB-CD1 3.38Å; K445-I515 HydrophobicContact CD-CD1 3.94Å; K445-I515 HydrophobicContact CG-CD1 3.7Å
446	Q	75.6	Confident	80.7	Confident	72 Å²	72	25.6 Å²	25.6	34%	0.336	14%	0.138	S	C	.	.	H	α-helix	trans	-69.7	-40.9	179.6	-69	176.8	-12.7	0	0	111.3	F381 F391 T444 I448 S449 H450	F381-Q446 HydrophobicContact CD2-CB 4.45Å; F391-Q446 HydrophobicContact CD2-CG 4.16Å; F391-Q446 HydrophobicContact CE2-CB 4.43Å; F391-Q446 HydrophobicContact CE2-CG 4.21Å; T444-Q446 VanDerWaalsContact C-N 3.32Å; T444-Q446 PolarHBondContact O-N 3.45Å; Q446-I448 VanDerWaalsContact C-N 3.3Å; Q446-I448 PolarHBondContact O-N 3.45Å; Q446-S449 WeakPolarHBondContact O-CB 3.39Å; Q446-S449 PolarHBondContact O-N 3.15Å; Q446-H450 PolarHBondContact O-N 2.71Å; Q446-H450 VanDerWaalsContact O-N 3.11Å; Q446-H450 PolarHBondContact O-ND1 3.17Å
447	S	78.8	Confident	80.5	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.5	-34.8	-179.7	-47.5	0	0	0	0	112.7	L377 T444 H450 Y451	L377-S447 WeakPolarHBondContact O-CB 3.02Å; L377-S447 PolarHBondContact O-OG 3.16Å; T444-S447 PolarHBondContact O-N 3.41Å; T444-S447 VanDerWaalsContact O-N 3.14Å; T444-S447 PolarHBondContact OG1-N 3.38Å; T444-S447 PolarHBondContact OG1-OG 3.17Å; S447-H450 PolarHBondContact O-N 3.3Å; S447-Y451 VanDerWaalsContact O-CB 3.22Å; S447-Y451 WeakPolarHBondContact O-CB 3.34Å; S447-Y451 PolarHBondContact O-N 2.85Å
448	I	81.8	Confident	80.6	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-59.6	-49.6	173.1	-67.5	167.1	0	0	0	110	L443 T444 Q446 H450 Y451 F452 W508 R512 I515 L516	L443-I448 HydrophobicContact CB-CG1 3.73Å; L443-I448 HydrophobicContact CD1-CG1 4.41Å; T444-I448 WeakPolarHBondContact O-CG1 3.48Å; T444-I448 PolarHBondContact O-N 2.51Å; Q446-I448 VanDerWaalsContact C-N 3.3Å; Q446-I448 PolarHBondContact O-N 3.45Å; I448-H450 PolarHBondContact O-N 2.82Å; I448-Y451 WeakPolarHBondContact O-CB 3.29Å; I448-Y451 PolarHBondContact O-N 2.88Å; I448-F452 HydrophobicContact CG2-CD2 3.89Å; I448-F452 HydrophobicContact CG2-CE2 4.13Å; I448-F452 WeakPolarHBondContact O-CD2 3.5Å; I448-F452 PolarHBondContact O-N 3.39Å; I448-W508 HydrophobicContact CD1-CZ2 4.29Å; I448-R512 HydrophobicContact CD1-CB 3.81Å; I448-R512 HydrophobicContact CD1-CG 4.17Å; I448-I515 HydrophobicContact CB-CG2 4.37Å; I448-I515 HydrophobicContact CG2-CG2 4.13Å; I448-L516 HydrophobicContact CG2-CB 4.48Å
449	S	81.1	Confident	80.8	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-58.1	-45	178.9	-179.5	0	0	0	0	112.7	F391 W400 Q446 F452 F453	F391-S449 WeakPolarHBondContact CD1-OG 3.32Å; F391-S449 WeakPolarHBondContact CE1-OG 3.48Å; F391-S449 WeakPolarHBondContact CZ-OG 3.42Å; W400-S449 PolarHBondContact NE1-OG 2.84Å; Q446-S449 WeakPolarHBondContact O-CB 3.39Å; Q446-S449 PolarHBondContact O-N 3.15Å; S449-F452 PolarHBondContact O-N 3.14Å; S449-F453 PolarHBondContact O-N 3.31Å
450	H	80.3	Confident	81	Confident	5 Å²	5	20.1 Å²	20.1	2%	0.023	11%	0.106	C	C	.	.	H	α-helix	trans	-69.2	-35.5	177.6	-66.9	82.7	0	0	0	112.3	L377 F381 F391 F414 Q446 S447 I448 F453 I454	L377-H450 HydrophobicContact CD2-CB 3.71Å; F381-H450 AromaticContact CE2-CD2 3.78Å; F381-H450 AromaticContact CE2-CE1 3.18Å; F381-H450 WeakPolarHBondContact CE2-CE1 3.23Å; F381-H450 AromaticContact CE2-CG 3.73Å; F381-H450 AromaticContact CE2-ND1 3.37Å; F381-H450 WeakPolarHBondContact CE2-ND1 3.3Å; F381-H450 AromaticContact CE2-NE2 3.45Å; F381-H450 WeakPolarHBondContact CE2-NE2 3.14Å; F381-H450 AromaticContact CZ-CD2 3.55Å; F381-H450 AromaticContact CZ-CE1 3.43Å; F381-H450 VanDerWaalsContact CZ-CE1 3.43Å; F381-H450 WeakPolarHBondContact CZ-CE1 3.47Å; F381-H450 AromaticContact CZ-CG 3.99Å; F381-H450 AromaticContact CZ-ND1 3.92Å; F381-H450 AromaticContact CZ-NE2 3.17Å; F381-H450 WeakPolarHBondContact CZ-NE2 3.49Å; F391-H450 AromaticContact CE2-CE1 3.97Å; F391-H450 AromaticContact CZ-CE1 3.97Å; F414-H450 HydrophobicContact CE1-CB 4.18Å; F414-H450 HydrophobicContact CZ-CB 4.08Å; F414-H450 WeakPolarHBondContact CZ-O 3.5Å; Q446-H450 PolarHBondContact O-N 2.71Å; Q446-H450 VanDerWaalsContact O-N 3.11Å; Q446-H450 PolarHBondContact O-ND1 3.17Å; S447-H450 PolarHBondContact O-N 3.3Å; I448-H450 PolarHBondContact O-N 2.82Å; H450-F453 WeakPolarHBondContact O-CB 3.48Å; H450-F453 PolarHBondContact O-N 3.02Å; H450-I454 PolarHBondContact O-N 2.9Å
451	Y	86.2	Confident	81.1	Confident	1 Å²	1	22.7 Å²	22.7	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-62.9	-45.7	174.6	-179.2	-112	0	0	0	111.4	W370 L377 L436 I438 L440 L443 S447 I448 F453 I454 W455 I490	W370-Y451 HydrophobicContact CH2-CD2 4.09Å; W370-Y451 HydrophobicContact CH2-CE2 4.02Å; W370-Y451 HydrophobicContact CZ2-CE2 4.24Å; L377-Y451 HydrophobicContact CD1-CD2 4.29Å; L436-Y451 WeakPolarHBondContact O-CE2 3.35Å; L436-Y451 PolarHBondContact O-OH 3.39Å; L436-Y451 VanDerWaalsContact O-OH 3.05Å; I438-Y451 HydrophobicContact CB-CE2 4.17Å; I438-Y451 HydrophobicContact CD1-CD2 4.19Å; I438-Y451 HydrophobicContact CD1-CE2 4.1Å; I438-Y451 HydrophobicContact CG1-CE2 4.29Å; I438-Y451 PolarHBondContact N-OH 3.35Å; L440-Y451 HydrophobicContact CD2-CD1 4.07Å; L440-Y451 HydrophobicContact CD2-CE1 4.09Å; L443-Y451 HydrophobicContact CD1-CD1 4.25Å; L443-Y451 HydrophobicContact CD1-CG 4.08Å; S447-Y451 VanDerWaalsContact O-CB 3.22Å; S447-Y451 WeakPolarHBondContact O-CB 3.34Å; S447-Y451 PolarHBondContact O-N 2.85Å; I448-Y451 WeakPolarHBondContact O-CB 3.29Å; I448-Y451 PolarHBondContact O-N 2.88Å; Y451-F453 VanDerWaalsContact C-N 3.28Å; Y451-F453 PolarHBondContact O-N 3.41Å; Y451-I454 WeakPolarHBondContact O-CB 3.23Å; Y451-I454 PolarHBondContact O-N 3.04Å; Y451-W455 AromaticContact CD1-NE1 3.95Å; Y451-W455 AromaticContact CE1-CD1 3.87Å; Y451-W455 AromaticContact CE1-NE1 3.31Å; Y451-W455 VanDerWaalsContact CE1-NE1 3.31Å; Y451-W455 AromaticContact CE2-NE1 3.66Å; Y451-W455 AromaticContact CZ-NE1 3.16Å; Y451-W455 VanDerWaalsContact O-CD1 3.23Å; Y451-W455 PolarHBondContact O-N 3.17Å; Y451-W455 PolarHBondContact OH-NE1 2.83Å; Y451-I490 HydrophobicContact CE1-CG2 4.43Å; Y451-I490 WeakPolarHBondContact OH-CD1 3.33Å
452	F	87.8	Confident	81.3	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.009	10%	0.096	C	C	.	.	H	α-helix	trans	-69.6	-24	174.8	-85.1	-89.6	0	0	0	113.4	L440 I448 S449 I454 W455 A456 I487 L516 C519 L520 L523	L440-F452 HydrophobicContact CD2-CE2 4.02Å; I448-F452 HydrophobicContact CG2-CD2 3.89Å; I448-F452 HydrophobicContact CG2-CE2 4.13Å; I448-F452 WeakPolarHBondContact O-CD2 3.5Å; I448-F452 PolarHBondContact O-N 3.39Å; S449-F452 PolarHBondContact O-N 3.14Å; F452-I454 VanDerWaalsContact C-N 3.32Å; F452-I454 PolarHBondContact O-N 2.94Å; F452-W455 PolarHBondContact O-N 3.02Å; F452-A456 WeakPolarHBondContact O-CB 3.17Å; F452-A456 PolarHBondContact O-N 3.05Å; F452-I487 HydrophobicContact CE1-CG2 3.96Å; F452-L516 HydrophobicContact CD2-CD1 4.25Å; F452-L516 HydrophobicContact CE1-CD1 4.25Å; F452-L516 HydrophobicContact CE2-CD1 3.25Å; F452-L516 HydrophobicContact CZ-CD1 3.25Å; F452-C519 HydrophobicContact CB-CB 3.64Å; F452-C519 HydrophobicContact CD1-CB 4.04Å; F452-C519 HydrophobicContact CD2-CB 4.11Å; F452-C519 HydrophobicContact CG-CB 3.65Å; F452-L520 HydrophobicContact CD1-CD2 4.49Å; F452-L520 HydrophobicContact CE1-CD2 3.62Å; F452-L520 HydrophobicContact CE1-CG 4.23Å; F452-L520 HydrophobicContact CZ-CD2 4.22Å; F452-L523 HydrophobicContact CD1-CD1 4.04Å; F452-L523 HydrophobicContact CE1-CD1 4.37Å
453	F	84.2	Confident	81.5	Confident	3 Å²	3	15.3 Å²	15.3	1%	0.013	8%	0.075	C	C	.	.	H	α-helix	trans	-63.3	-36.8	169.6	-175.2	-102.3	0	0	0	112.3	W400 Y401 V404 F414 V415 S449 H450 Y451 A456 N457	W400-F453 HydrophobicContact CH2-CB 4.32Å; W400-F453 HydrophobicContact CH2-CD2 4.03Å; W400-F453 HydrophobicContact CZ2-CB 4.03Å; W400-F453 HydrophobicContact CZ2-CD2 4.21Å; W400-F453 HydrophobicContact CZ3-CD2 4.46Å; Y401-F453 HydrophobicContact CD2-CE2 4.29Å; Y401-F453 HydrophobicContact CE2-CE2 4.29Å; V404-F453 HydrophobicContact CB-CD2 3.79Å; V404-F453 HydrophobicContact CB-CE2 3.86Å; V404-F453 HydrophobicContact CB-CG 4.21Å; V404-F453 HydrophobicContact CB-CZ 4.32Å; V404-F453 HydrophobicContact CG1-CB 3.91Å; V404-F453 HydrophobicContact CG1-CD1 3.55Å; V404-F453 HydrophobicContact CG1-CD2 3.44Å; V404-F453 VanDerWaalsContact CG1-CD2 3.44Å; V404-F453 HydrophobicContact CG1-CE1 3.79Å; V404-F453 HydrophobicContact CG1-CE2 3.7Å; V404-F453 HydrophobicContact CG1-CG 3.34Å; V404-F453 HydrophobicContact CG1-CZ 3.86Å; V404-F453 HydrophobicContact CG2-CD2 4.43Å; F414-F453 HydrophobicContact CD1-CD1 4.37Å; F414-F453 AromaticContact CE1-CD1 3.83Å; F414-F453 HydrophobicContact CE1-CD1 3.83Å; V415-F453 HydrophobicContact CG2-CE1 4.35Å; S449-F453 PolarHBondContact O-N 3.31Å; H450-F453 WeakPolarHBondContact O-CB 3.48Å; H450-F453 PolarHBondContact O-N 3.02Å; Y451-F453 VanDerWaalsContact C-N 3.28Å; Y451-F453 PolarHBondContact O-N 3.41Å; F453-A456 PolarHBondContact O-N 2.84Å; F453-N457 VanDerWaalsContact CD1-ND2 3.3Å; F453-N457 WeakPolarHBondContact CD1-ND2 3.46Å; F453-N457 WeakPolarHBondContact CE1-ND2 3.28Å; F453-N457 VanDerWaalsContact CZ-ND2 3.28Å; F453-N457 WeakPolarHBondContact CZ-ND2 3.43Å; F453-N457 PolarHBondContact O-N 3.25Å; F453-N457 PolarHBondContact O-ND2 3.24Å
454	I	85.7	Confident	81.5	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-59.6	-49.5	173.4	-61.4	171	0	0	0	110	W370 L377 F414 L421 L436 H450 Y451 F452 A456 N457 L458	W370-I454 HydrophobicContact CH2-CD1 3.97Å; W370-I454 HydrophobicContact CZ3-CD1 3.56Å; L377-I454 HydrophobicContact CD1-CD1 4.27Å; F414-I454 HydrophobicContact CE1-CG1 4.32Å; F414-I454 HydrophobicContact CE2-CD1 3.91Å; F414-I454 HydrophobicContact CE2-CG1 4.1Å; F414-I454 HydrophobicContact CZ-CD1 3.73Å; F414-I454 HydrophobicContact CZ-CG1 3.51Å; L421-I454 HydrophobicContact CD1-CG2 3.51Å; L436-I454 HydrophobicContact CD1-CG2 4.08Å; H450-I454 PolarHBondContact O-N 2.9Å; Y451-I454 WeakPolarHBondContact O-CB 3.23Å; Y451-I454 PolarHBondContact O-N 3.04Å; F452-I454 VanDerWaalsContact C-N 3.32Å; F452-I454 PolarHBondContact O-N 2.94Å; I454-A456 VanDerWaalsContact C-N 3.32Å; I454-A456 PolarHBondContact O-N 3.44Å; I454-N457 PolarHBondContact O-N 3.1Å; I454-L458 HydrophobicContact CG2-CD1 4.3Å; I454-L458 WeakPolarHBondContact O-CG 3.09Å; I454-L458 PolarHBondContact O-N 2.98Å; I454-L458 VanDerWaalsContact O-N 3.1Å
455	W	87.5	Confident	81.4	Confident	2 Å²	2	17.6 Å²	17.6	1%	0.008	9%	0.087	C	C	.	.	H	α-helix	trans	-62.2	-40	177.9	-68.7	106.5	0	0	0	112.2	C433 L436 Y451 F452 N457 L458 V459 L483 N486 I487 I490	C433-W455 HydrophobicContact CB-CH2 4.29Å; L436-W455 HydrophobicContact CB-CH2 4.4Å; L436-W455 HydrophobicContact CB-CZ2 4.04Å; Y451-W455 AromaticContact CD1-NE1 3.95Å; Y451-W455 AromaticContact CE1-CD1 3.87Å; Y451-W455 AromaticContact CE1-NE1 3.31Å; Y451-W455 VanDerWaalsContact CE1-NE1 3.31Å; Y451-W455 AromaticContact CE2-NE1 3.66Å; Y451-W455 AromaticContact CZ-NE1 3.16Å; Y451-W455 VanDerWaalsContact O-CD1 3.23Å; Y451-W455 PolarHBondContact O-N 3.17Å; Y451-W455 PolarHBondContact OH-NE1 2.83Å; F452-W455 PolarHBondContact O-N 3.02Å; W455-N457 VanDerWaalsContact C-N 3.35Å; W455-N457 PolarHBondContact O-N 3.45Å; W455-L458 HydrophobicContact CE3-CD1 4.28Å; W455-L458 HydrophobicContact CZ3-CD1 4.49Å; W455-L458 PolarHBondContact O-N 2.77Å; W455-V459 WeakPolarHBondContact O-CB 3.26Å; W455-V459 VanDerWaalsContact O-CG2 3.26Å; W455-V459 WeakPolarHBondContact O-CG2 3.35Å; W455-V459 PolarHBondContact O-N 2.83Å; W455-L483 HydrophobicContact CE3-CD2 4.32Å; W455-L483 HydrophobicContact CZ3-CD2 3.93Å; W455-N486 HydrophobicContact CH2-CB 4.12Å; W455-N486 HydrophobicContact CZ3-CB 4.46Å; W455-I487 HydrophobicContact CB-CD1 3.98Å; W455-I487 HydrophobicContact CB-CG1 4.28Å; W455-I487 HydrophobicContact CD2-CD1 4.26Å; W455-I487 HydrophobicContact CD2-CG1 3.81Å; W455-I487 HydrophobicContact CE3-CD1 4.04Å; W455-I487 HydrophobicContact CE3-CG1 3.78Å; W455-I487 HydrophobicContact CG-CD1 4.26Å; W455-I487 HydrophobicContact CG-CG1 4.03Å; W455-I487 HydrophobicContact CZ3-CG1 4.39Å; W455-I490 HydrophobicContact CH2-CD1 4.45Å; W455-I490 HydrophobicContact CZ2-CD1 3.75Å
456	A	85.8	Confident	81.3	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.6	-43.8	175	0	0	0	0	0	112.1	W400 F452 F453 I454 L458 V459 E460 L523 M526	W400-A456 HydrophobicContact CH2-CB 3.79Å; W400-A456 HydrophobicContact CZ3-CB 4.25Å; F452-A456 WeakPolarHBondContact O-CB 3.17Å; F452-A456 PolarHBondContact O-N 3.05Å; F453-A456 PolarHBondContact O-N 2.84Å; I454-A456 VanDerWaalsContact C-N 3.32Å; I454-A456 PolarHBondContact O-N 3.44Å; A456-L458 VanDerWaalsContact C-N 3.34Å; A456-L458 PolarHBondContact O-N 3.22Å; A456-V459 PolarHBondContact O-N 3.21Å; A456-E460 VanDerWaalsContact O-CB 3.28Å; A456-E460 WeakPolarHBondContact O-CB 3.15Å; A456-E460 PolarHBondContact O-N 2.94Å; A456-L523 HydrophobicContact CB-CD2 3.78Å; A456-M526 HydrophobicContact CB-CE 3.97Å; A456-M526 HydrophobicContact CB-SD 3.71Å; A456-M526 WeakPolarHBondContact O-CE 3.34Å
457	N	82.8	Confident	81	Confident	5 Å²	5	12.3 Å²	12.3	3%	0.027	7%	0.068	C	C	.	.	H	α-helix	trans	-64	-38.1	177	-82.4	-103.6	0	0	0	112.6	C418 R422 F453 I454 W455 E461	C418-N457 HydrophobicContact CB-CB 4.21Å; R422-N457 PolarHBondContact NE-OD1 3.48Å; R422-N457 PolarHBondContact NH2-OD1 2.93Å; F453-N457 VanDerWaalsContact CD1-ND2 3.3Å; F453-N457 WeakPolarHBondContact CD1-ND2 3.46Å; F453-N457 WeakPolarHBondContact CE1-ND2 3.28Å; F453-N457 VanDerWaalsContact CZ-ND2 3.28Å; F453-N457 WeakPolarHBondContact CZ-ND2 3.43Å; F453-N457 PolarHBondContact O-N 3.25Å; F453-N457 PolarHBondContact O-ND2 3.24Å; I454-N457 PolarHBondContact O-N 3.1Å; W455-N457 VanDerWaalsContact C-N 3.35Å; W455-N457 PolarHBondContact O-N 3.45Å; N457-E461 PolarHBondContact O-N 3.14Å; N457-E461 VanDerWaalsContact O-N 3.13Å
458	L	84.6	Confident	80.5	Confident	13 Å²	13	18.3 Å²	18.3	7%	0.068	10%	0.104	C	C	.	.	H	α-helix	trans	-70	-40.3	176.8	-71.3	174.2	0	0	0	111.9	L421 L432 L436 I454 W455 A456 A462 L483	L421-L458 HydrophobicContact CB-CD2 3.95Å; L432-L458 HydrophobicContact CD2-CD1 3.92Å; L432-L458 HydrophobicContact CD2-CD2 3.86Å; L436-L458 HydrophobicContact CD1-CD1 3.73Å; I454-L458 HydrophobicContact CG2-CD1 4.3Å; I454-L458 WeakPolarHBondContact O-CG 3.09Å; I454-L458 PolarHBondContact O-N 2.98Å; I454-L458 VanDerWaalsContact O-N 3.1Å; W455-L458 HydrophobicContact CE3-CD1 4.28Å; W455-L458 HydrophobicContact CZ3-CD1 4.49Å; W455-L458 PolarHBondContact O-N 2.77Å; A456-L458 VanDerWaalsContact C-N 3.34Å; A456-L458 PolarHBondContact O-N 3.22Å; L458-A462 WeakPolarHBondContact O-CB 3.26Å; L458-A462 PolarHBondContact O-N 3.38Å; L458-L483 HydrophobicContact CB-CD1 4.43Å; L458-L483 HydrophobicContact CB-CD2 4.22Å; L458-L483 HydrophobicContact CD1-CD2 4.3Å
459	V	84.9	Confident	79.5	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-44	175.2	167.1	0	0	0	0	110.5	W455 A456 A462 L463 L480 I487 M526 F527	W455-V459 WeakPolarHBondContact O-CB 3.26Å; W455-V459 VanDerWaalsContact O-CG2 3.26Å; W455-V459 WeakPolarHBondContact O-CG2 3.35Å; W455-V459 PolarHBondContact O-N 2.83Å; A456-V459 PolarHBondContact O-N 3.21Å; V459-A462 PolarHBondContact O-N 3.27Å; V459-L463 HydrophobicContact CG1-CD1 3.81Å; V459-L463 HydrophobicContact CG1-CG 4.29Å; V459-L463 VanDerWaalsContact O-CG 3.23Å; V459-L463 WeakPolarHBondContact O-CG 3.11Å; V459-L463 PolarHBondContact O-N 3.38Å; V459-L480 HydrophobicContact CG1-CD1 4.43Å; V459-I487 HydrophobicContact CG2-CD1 4.24Å; V459-M526 HydrophobicContact CB-CE 4.01Å; V459-M526 HydrophobicContact CG1-CE 3.73Å; V459-F527 HydrophobicContact CG1-CD1 4.44Å; V459-F527 HydrophobicContact CG1-CE1 3.53Å; V459-F527 HydrophobicContact CG1-CE2 4.13Å; V459-F527 HydrophobicContact CG1-CZ 3.33Å; V459-F527 HydrophobicContact CG2-CZ 4.39Å
460	E	82.5	Confident	78.5	Confident	24 Å²	24	25 Å²	25	11%	0.112	14%	0.141	C	C	.	.	H	α-helix	trans	-57.2	-49.6	176.3	-171.3	-172.8	147.3	0	0	111.7	Y401 R422 A456 A462 L463 D464 Y530	Y401-E460 PolarHBondContact OH-OE1 3.32Å; Y401-E460 PolarHBondContact OH-OE2 2.84Å; R422-E460 IonicContact CZ-OE1 2.79Å; R422-E460 IonicContact CZ-OE2 3.07Å; R422-E460 IonicContact NH1-OE1 3.97Å; R422-E460 PolarHBondContact NH1-OE1 2.93Å; R422-E460 IonicContact NH1-OE2 3.29Å; R422-E460 IonicContact NH2-OE1 3.17Å; R422-E460 PolarHBondContact NH2-OE1 3.35Å; R422-E460 VanDerWaalsContact NH2-OE1 3.14Å; R422-E460 IonicContact NH2-OE2 3.79Å; R422-E460 PolarHBondContact NH2-OE2 3.2Å; A456-E460 VanDerWaalsContact O-CB 3.28Å; A456-E460 WeakPolarHBondContact O-CB 3.15Å; A456-E460 PolarHBondContact O-N 2.94Å; E460-A462 VanDerWaalsContact C-N 3.33Å; E460-A462 PolarHBondContact O-N 3.49Å; E460-L463 CarbonylContact O-C 3.55Å; E460-L463 WeakPolarHBondContact O-CB 3.41Å; E460-L463 PolarHBondContact O-N 2.94Å; E460-L463 VanDerWaalsContact O-N 3.09Å; E460-D464 PolarHBondContact O-N 3.38Å; E460-Y530 HydrophobicContact CG-CE2 4.07Å; E460-Y530 WeakPolarHBondContact CG-OH 3.41Å
461	E	79.5	Confident	77.4	Confident	62 Å²	62	32.8 Å²	32.8	29%	0.29	18%	0.183	S	C	.	.	H	α-helix	trans	-62.6	-39.1	176.1	-173.6	68.6	-153.8	0	0	112.4	R422 N457 L463 D464 T465	R422-E461 HydrophobicContact CB-CB 4.2Å; R422-E461 HydrophobicContact CB-CG 3.96Å; R422-E461 WeakPolarHBondContact CB-OE2 2.95Å; R422-E461 WeakPolarHBondContact CD-OE2 3.38Å; R422-E461 HydrophobicContact CG-CB 3.97Å; R422-E461 HydrophobicContact CG-CG 4.31Å; R422-E461 WeakPolarHBondContact O-CG 3.14Å; N457-E461 PolarHBondContact O-N 3.14Å; N457-E461 VanDerWaalsContact O-N 3.13Å; E461-L463 VanDerWaalsContact C-N 3.28Å; E461-L463 PolarHBondContact O-N 2.98Å; E461-D464 PolarHBondContact O-N 3.08Å; E461-T465 WeakPolarHBondContact O-CB 3.3Å; E461-T465 WeakPolarHBondContact O-CG2 3.46Å; E461-T465 PolarHBondContact O-N 3.21Å; E461-T465 PolarHBondContact O-OG1 3.45Å
462	A	79.5	Confident	76.2	Confident	5 Å²	5	37.1 Å²	37.1	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-64.8	-32.9	175	0	0	0	0	0	112.1	L458 V459 E460 T465 L466 L480 L483	L458-A462 WeakPolarHBondContact O-CB 3.26Å; L458-A462 PolarHBondContact O-N 3.38Å; V459-A462 PolarHBondContact O-N 3.27Å; E460-A462 VanDerWaalsContact C-N 3.33Å; E460-A462 PolarHBondContact O-N 3.49Å; A462-T465 WeakPolarHBondContact CA-OG1 3.29Å; A462-T465 PolarHBondContact O-OG1 3.23Å; A462-L466 VanDerWaalsContact O-CB 3.3Å; A462-L466 WeakPolarHBondContact O-CB 3.44Å; A462-L466 PolarHBondContact O-N 2.92Å; A462-L466 VanDerWaalsContact O-N 3.16Å; A462-L480 HydrophobicContact CB-CD1 3.93Å; A462-L483 HydrophobicContact CB-CD1 3.86Å
463	L	78.2	Confident	74.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-74.7	-42.7	174.5	-68.6	168.8	0	0	0	111.5	V459 E460 E461 T465 L466 S467 L480 F527 Y530 Y540 L544	V459-L463 HydrophobicContact CG1-CD1 3.81Å; V459-L463 HydrophobicContact CG1-CG 4.29Å; V459-L463 VanDerWaalsContact O-CG 3.23Å; V459-L463 WeakPolarHBondContact O-CG 3.11Å; V459-L463 PolarHBondContact O-N 3.38Å; E460-L463 CarbonylContact O-C 3.55Å; E460-L463 WeakPolarHBondContact O-CB 3.41Å; E460-L463 PolarHBondContact O-N 2.94Å; E460-L463 VanDerWaalsContact O-N 3.09Å; E461-L463 VanDerWaalsContact C-N 3.28Å; E461-L463 PolarHBondContact O-N 2.98Å; L463-T465 PolarHBondContact O-N 2.93Å; L463-L466 WeakPolarHBondContact O-CB 3.28Å; L463-L466 PolarHBondContact O-N 3.17Å; L463-S467 PolarHBondContact O-N 2.89Å; L463-L480 HydrophobicContact CD2-CD2 4.11Å; L463-F527 HydrophobicContact CD1-CD1 3.82Å; L463-F527 HydrophobicContact CD1-CE1 3.94Å; L463-F527 HydrophobicContact CD2-CD1 3.92Å; L463-F527 HydrophobicContact CD2-CE1 3.97Å; L463-F527 HydrophobicContact CG-CD1 4.4Å; L463-F527 HydrophobicContact CG-CE1 4.26Å; L463-Y530 HydrophobicContact CB-CD1 3.92Å; L463-Y530 HydrophobicContact CB-CE1 4.26Å; L463-Y530 HydrophobicContact CB-CG 4.07Å; L463-Y530 HydrophobicContact CD1-CD2 3.83Å; L463-Y530 HydrophobicContact CD1-CE2 4.45Å; L463-Y530 HydrophobicContact CD1-CG 3.92Å; L463-Y540 WeakPolarHBondContact CD2-OH 3.43Å; L463-L544 HydrophobicContact CD2-CD2 3.67Å
464	D	76.7	Confident	74.1	Confident	51 Å²	51	42.4 Å²	42.4	27%	0.273	23%	0.234	S	C	.	.	H	α-helix	trans	-58.1	-47.8	174.8	-78.4	-31.7	0	0	0	110.9	E460 E461 L466 S467 V468 Y530	E460-D464 PolarHBondContact O-N 3.38Å; E461-D464 PolarHBondContact O-N 3.08Å; D464-L466 VanDerWaalsContact C-N 3.34Å; D464-L466 PolarHBondContact O-N 3.17Å; D464-S467 WeakPolarHBondContact O-CB 3.12Å; D464-S467 PolarHBondContact O-N 3.36Å; D464-S467 VanDerWaalsContact O-N 3.13Å; D464-S467 PolarHBondContact O-OG 3.46Å; D464-V468 WeakPolarHBondContact O-CG2 3.46Å; D464-V468 PolarHBondContact O-N 3.13Å; D464-Y530 VanDerWaalsContact OD1-CE1 3.29Å; D464-Y530 WeakPolarHBondContact OD1-CE1 3.12Å; D464-Y530 PolarHBondContact OD1-OH 2.77Å
465	T	73	Confident	73.2	Confident	46 Å²	46	47.3 Å²	47.3	28%	0.282	26%	0.26	S	S	.	.	H	α-helix	trans	-65.4	-35.2	177.5	50.3	0	0	0	0	113.1	E461 A462 L463 S467 S469 N476	E461-T465 WeakPolarHBondContact O-CB 3.3Å; E461-T465 WeakPolarHBondContact O-CG2 3.46Å; E461-T465 PolarHBondContact O-N 3.21Å; E461-T465 PolarHBondContact O-OG1 3.45Å; A462-T465 WeakPolarHBondContact CA-OG1 3.29Å; A462-T465 PolarHBondContact O-OG1 3.23Å; L463-T465 PolarHBondContact O-N 2.93Å; T465-S467 VanDerWaalsContact C-N 3.32Å; T465-S469 PolarHBondContact O-N 3.36Å; T465-S469 PolarHBondContact O-OG 3.45Å; T465-N476 PolarHBondContact O-ND2 3.03Å
466	L	71.6	Confident	72.4	Confident	4 Å²	4	48 Å²	48	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-37.1	172.6	-167.7	72.9	0	0	0	111.4	A462 L463 D464 M473 N476 Y540	A462-L466 VanDerWaalsContact O-CB 3.3Å; A462-L466 WeakPolarHBondContact O-CB 3.44Å; A462-L466 PolarHBondContact O-N 2.92Å; A462-L466 VanDerWaalsContact O-N 3.16Å; L463-L466 WeakPolarHBondContact O-CB 3.28Å; L463-L466 PolarHBondContact O-N 3.17Å; D464-L466 VanDerWaalsContact C-N 3.34Å; D464-L466 PolarHBondContact O-N 3.17Å; L466-M473 HydrophobicContact CD1-CE 4.07Å; L466-M473 HydrophobicContact CD1-SD 3.43Å; L466-M473 WeakPolarHBondContact CD1-SD 3.34Å; L466-M473 HydrophobicContact CG-CE 4.23Å; L466-M473 HydrophobicContact CG-SD 3.8Å; L466-M473 VanDerWaalsContact O-SD 3.37Å; L466-N476 HydrophobicContact CD1-CB 3.68Å; L466-Y540 HydrophobicContact CB-CE2 4.25Å; L466-Y540 HydrophobicContact CD2-CD2 4Å; L466-Y540 HydrophobicContact CD2-CE2 3.42Å; L466-Y540 VanDerWaalsContact CD2-CE2 3.42Å; L466-Y540 HydrophobicContact CG-CD2 4.27Å; L466-Y540 HydrophobicContact CG-CE2 3.76Å
467	S	67.7	Low	71.6	Confident	33 Å²	33	51.4 Å²	51.4	23%	0.231	28%	0.279	C	S	.	.	H	α-helix	trans	-68.4	-35.7	179.6	78.8	0	0	0	0	113.7	L463 D464 T465 H534	L463-S467 PolarHBondContact O-N 2.89Å; D464-S467 WeakPolarHBondContact O-CB 3.12Å; D464-S467 PolarHBondContact O-N 3.36Å; D464-S467 VanDerWaalsContact O-N 3.13Å; D464-S467 PolarHBondContact O-OG 3.46Å; T465-S467 VanDerWaalsContact C-N 3.32Å; S467-H534 VanDerWaalsContact CB-NE2 3.32Å; S467-H534 WeakPolarHBondContact CB-NE2 3.1Å
468	V	68.9	Low	71.1	Confident	126 Å²	126	56.5 Å²	56.5	76%	0.764	31%	0.305	S	S	*	.	H	α-helix	trans	-80.4	-27.5	-174.4	175.5	0	0	0	0	112.7	D464	D464-V468 WeakPolarHBondContact O-CG2 3.46Å; D464-V468 PolarHBondContact O-N 3.13Å
469	S	61.5	Low	70.6	Confident	35 Å²	35	56.5 Å²	56.5	25%	0.245	31%	0.306	C	S	.	.			trans	-123	75.7	-167.6	59.5	0	0	0	0	113.7	T465 D471 N472 M473 N476	T465-S469 PolarHBondContact O-N 3.36Å; T465-S469 PolarHBondContact O-OG 3.45Å; S469-D471 PolarHBondContact O-N 3.31Å; S469-N472 PolarHBondContact O-N 2.83Å; S469-M473 WeakPolarHBondContact O-CG 3.43Å; S469-N476 PolarHBondContact OG-ND2 2.87Å
470	I	59	Low	70.4	Confident	108 Å²	108	56.7 Å²	56.7	55%	0.554	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-57.6	-31.9	176.3	-60.2	172	0	0	0	111.9	M473	I470-M473 VanDerWaalsContact C-CG 3.48Å; I470-M473 WeakPolarHBondContact O-CG 3.36Å
471	D	57.5	Low	70.3	Confident	168 Å²	168	57.2 Å²	57.2	90%	0.898	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-78.4	-20.1	-178.1	-63.7	-30.5	0	0	0	113.9	S469	S469-D471 PolarHBondContact O-N 3.31Å
472	N	62.1	Low	70.4	Confident	91 Å²	91	55.6 Å²	55.6	49%	0.487	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-110.6	19.2	-174.4	-132.1	3.3	0	0	0	112.9	S469 D474 N475 N476	S469-N472 PolarHBondContact O-N 2.83Å; N472-D474 VanDerWaalsContact C-N 3.26Å; N472-D474 PolarHBondContact O-N 3.46Å; N472-D474 VanDerWaalsContact O-N 3.11Å; N472-N475 PolarHBondContact O-N 2.93Å; N472-N476 PolarHBondContact O-N 2.74Å
473	M	60	Low	70.7	Confident	15 Å²	15	55.4 Å²	55.4	7%	0.074	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-24.9	-166.1	-72	-81.2	-82.5	0	0	114.8	L466 S469 I470 K477 Y540 R543	L466-M473 HydrophobicContact CD1-CE 4.07Å; L466-M473 HydrophobicContact CD1-SD 3.43Å; L466-M473 WeakPolarHBondContact CD1-SD 3.34Å; L466-M473 HydrophobicContact CG-CE 4.23Å; L466-M473 HydrophobicContact CG-SD 3.8Å; L466-M473 VanDerWaalsContact O-SD 3.37Å; S469-M473 WeakPolarHBondContact O-CG 3.43Å; I470-M473 VanDerWaalsContact C-CG 3.48Å; I470-M473 WeakPolarHBondContact O-CG 3.36Å; M473-K477 WeakPolarHBondContact O-CB 3.42Å; M473-K477 PolarHBondContact O-N 3.31Å; M473-Y540 HydrophobicContact CE-CD2 4.4Å; M473-R543 PolarHBondContact O-NH1 3.5Å
474	D	66.9	Low	71	Confident	102 Å²	102	55.4 Å²	55.4	55%	0.545	31%	0.305	S	S	.	.	H	α-helix	trans	-75.3	-40.7	-177.1	-69.8	-11	0	0	0	112.2	N472 K477 I478 R543	N472-D474 VanDerWaalsContact C-N 3.26Å; N472-D474 PolarHBondContact O-N 3.46Å; N472-D474 VanDerWaalsContact O-N 3.11Å; D474-K477 PolarHBondContact O-N 3.49Å; D474-I478 WeakPolarHBondContact O-CG1 3.49Å; D474-I478 PolarHBondContact O-N 3.27Å; D474-I478 VanDerWaalsContact O-N 3.07Å; D474-R543 IonicContact OD1-CZ 3.08Å; D474-R543 VanDerWaalsContact OD1-CZ 3.32Å; D474-R543 IonicContact OD1-NH1 2.69Å; D474-R543 PolarHBondContact OD1-NH1 3.19Å; D474-R543 IonicContact OD1-NH2 3.24Å; D474-R543 PolarHBondContact OD1-NH2 3.28Å
475	N	67.7	Low	71.4	Confident	103 Å²	103	56.1 Å²	56.1	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-66.3	-43.1	174.9	-72.2	-25.2	0	0	0	111.2	N472 K477 I478 C479	N472-N475 PolarHBondContact O-N 2.93Å; N475-K477 VanDerWaalsContact C-N 3.31Å; N475-K477 PolarHBondContact O-N 3.35Å; N475-I478 PolarHBondContact O-N 3.36Å; N475-C479 PolarHBondContact O-N 3.26Å; N475-C479 VanDerWaalsContact O-N 3.08Å
476	N	69.1	Low	71.9	Confident	17 Å²	17	54.6 Å²	54.6	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-65.9	-34.8	177.5	-66.1	-9.4	0	0	0	111.8	T465 L466 S469 N472 C479 L480	T465-N476 PolarHBondContact O-ND2 3.03Å; L466-N476 HydrophobicContact CD1-CB 3.68Å; S469-N476 PolarHBondContact OG-ND2 2.87Å; N472-N476 PolarHBondContact O-N 2.74Å; N476-C479 WeakPolarHBondContact O-CB 3.38Å; N476-C479 PolarHBondContact O-N 3.41Å; N476-L480 PolarHBondContact O-N 2.77Å
477	K	69.4	Low	72.6	Confident	71 Å²	71	54.5 Å²	54.5	31%	0.309	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-43.3	173.2	-178.1	-177.1	178	-176.4	0	112.1	M473 D474 N475 C479 L480 L481 R543	M473-K477 WeakPolarHBondContact O-CB 3.42Å; M473-K477 PolarHBondContact O-N 3.31Å; D474-K477 PolarHBondContact O-N 3.49Å; N475-K477 VanDerWaalsContact C-N 3.31Å; N475-K477 PolarHBondContact O-N 3.35Å; K477-C479 VanDerWaalsContact C-N 3.27Å; K477-C479 PolarHBondContact O-N 3.38Å; K477-L480 PolarHBondContact O-N 3.03Å; K477-L481 HydrophobicContact CD-CD1 4.49Å; K477-L481 HydrophobicContact CG-CD1 3.9Å; K477-L481 HydrophobicContact CG-CG 4.43Å; K477-L481 WeakPolarHBondContact O-CB 3.42Å; K477-L481 WeakPolarHBondContact O-CG 3.46Å; K477-L481 PolarHBondContact O-N 2.98Å; K477-R543 HydrophobicContact CD-CG 4.35Å
478	I	72.7	Confident	73.5	Confident	112 Å²	112	54.2 Å²	54.2	57%	0.574	30%	0.295	S	S	*	.	H	α-helix	trans	-60.4	-42.6	176.8	-67.7	163.8	0	0	0	110.1	D474 N475 S482	D474-I478 WeakPolarHBondContact O-CG1 3.49Å; D474-I478 PolarHBondContact O-N 3.27Å; D474-I478 VanDerWaalsContact O-N 3.07Å; N475-I478 PolarHBondContact O-N 3.36Å; I478-S482 WeakPolarHBondContact O-CB 3.31Å; I478-S482 PolarHBondContact O-N 3.38Å
479	C	74.3	Confident	74.2	Confident	13 Å²	13	53.2 Å²	53.2	9%	0.088	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-52.9	174.6	154.6	0	0	0	0	112.2	I429 N475 N476 K477 L481 S482 L483	I429-C479 HydrophobicContact CD1-CB 4.17Å; I429-C479 WeakPolarHBondContact CD1-SG 3.46Å; N475-C479 PolarHBondContact O-N 3.26Å; N475-C479 VanDerWaalsContact O-N 3.08Å; N476-C479 WeakPolarHBondContact O-CB 3.38Å; N476-C479 PolarHBondContact O-N 3.41Å; K477-C479 VanDerWaalsContact C-N 3.27Å; K477-C479 PolarHBondContact O-N 3.38Å; C479-L481 VanDerWaalsContact C-N 3.34Å; C479-L481 PolarHBondContact O-N 3.47Å; C479-S482 WeakPolarHBondContact O-CB 3.22Å; C479-S482 PolarHBondContact O-N 3.13Å; C479-L483 PolarHBondContact O-N 3.49Å; C479-L483 VanDerWaalsContact O-N 3.09Å
480	L	80.5	Confident	75.2	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-42.6	-179.2	-177.1	65.9	0	0	0	111.6	V459 A462 L463 N476 K477 S482 L483 V484 F527 L544 V547	V459-L480 HydrophobicContact CG1-CD1 4.43Å; A462-L480 HydrophobicContact CB-CD1 3.93Å; L463-L480 HydrophobicContact CD2-CD2 4.11Å; N476-L480 PolarHBondContact O-N 2.77Å; K477-L480 PolarHBondContact O-N 3.03Å; L480-S482 PolarHBondContact O-N 2.83Å; L480-L483 PolarHBondContact O-N 3.04Å; L480-V484 WeakPolarHBondContact O-CG2 3.36Å; L480-V484 PolarHBondContact O-N 3.46Å; L480-V484 VanDerWaalsContact O-N 3.07Å; L480-F527 HydrophobicContact CD1-CE1 4.07Å; L480-F527 HydrophobicContact CD1-CZ 4.43Å; L480-F527 HydrophobicContact CD2-CE1 4.38Å; L480-L544 HydrophobicContact CD2-CD2 3.98Å; L480-V547 HydrophobicContact CD2-CG2 4.09Å; L480-V547 HydrophobicContact CG-CG2 4.17Å
481	L	80.4	Confident	76.3	Confident	35 Å²	35	47 Å²	47	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-62.4	-41.6	176.4	-76.5	168.6	0	0	0	111.9	K477 C479 L483 V484 D485 V547	K477-L481 HydrophobicContact CD-CD1 4.49Å; K477-L481 HydrophobicContact CG-CD1 3.9Å; K477-L481 HydrophobicContact CG-CG 4.43Å; K477-L481 WeakPolarHBondContact O-CB 3.42Å; K477-L481 WeakPolarHBondContact O-CG 3.46Å; K477-L481 PolarHBondContact O-N 2.98Å; C479-L481 VanDerWaalsContact C-N 3.34Å; C479-L481 PolarHBondContact O-N 3.47Å; L481-L483 PolarHBondContact O-N 2.68Å; L481-V484 PolarHBondContact O-N 3.2Å; L481-D485 VanDerWaalsContact O-CB 3.31Å; L481-D485 WeakPolarHBondContact O-CB 3.33Å; L481-D485 PolarHBondContact O-N 2.94Å; L481-V547 HydrophobicContact CD2-CG2 3.72Å; L481-V547 HydrophobicContact CG-CG2 4.36Å
482	S	81.8	Confident	77.3	Confident	28 Å²	28	40.1 Å²	40.1	20%	0.196	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-41.3	177.2	-176.7	0	0	0	0	112.5	I478 C479 L480 N486	I478-S482 WeakPolarHBondContact O-CB 3.31Å; I478-S482 PolarHBondContact O-N 3.38Å; C479-S482 WeakPolarHBondContact O-CB 3.22Å; C479-S482 PolarHBondContact O-N 3.13Å; L480-S482 PolarHBondContact O-N 2.83Å; S482-N486 PolarHBondContact O-N 2.82Å; S482-N486 VanDerWaalsContact O-N 3.13Å; S482-N486 PolarHBondContact O-ND2 3.07Å
483	L	85.3	Confident	77.8	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-48.1	174.5	-72.1	169	0	0	0	110.9	I429 W455 L458 A462 C479 L480 L481 N486 I487	I429-L483 HydrophobicContact CG2-CD2 3.76Å; I429-L483 HydrophobicContact CG2-CG 3.83Å; W455-L483 HydrophobicContact CE3-CD2 4.32Å; W455-L483 HydrophobicContact CZ3-CD2 3.93Å; L458-L483 HydrophobicContact CB-CD1 4.43Å; L458-L483 HydrophobicContact CB-CD2 4.22Å; L458-L483 HydrophobicContact CD1-CD2 4.3Å; A462-L483 HydrophobicContact CB-CD1 3.86Å; C479-L483 PolarHBondContact O-N 3.49Å; C479-L483 VanDerWaalsContact O-N 3.09Å; L480-L483 PolarHBondContact O-N 3.04Å; L481-L483 PolarHBondContact O-N 2.68Å; L483-N486 PolarHBondContact O-N 2.92Å; L483-I487 WeakPolarHBondContact O-CG1 3.49Å; L483-I487 PolarHBondContact O-N 3.03Å
484	V	85.2	Confident	78.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.3	-41	-178.7	173.4	0	0	0	0	111.3	L480 L481 N486 I487 V488 F527 V547 K550 I551	L480-V484 WeakPolarHBondContact O-CG2 3.36Å; L480-V484 PolarHBondContact O-N 3.46Å; L480-V484 VanDerWaalsContact O-N 3.07Å; L481-V484 PolarHBondContact O-N 3.2Å; V484-N486 VanDerWaalsContact C-N 3.28Å; V484-N486 PolarHBondContact O-N 3.29Å; V484-I487 PolarHBondContact O-N 3.17Å; V484-I487 VanDerWaalsContact O-N 3.15Å; V484-V488 HydrophobicContact CG1-CG2 4.23Å; V484-V488 WeakPolarHBondContact O-CB 3.45Å; V484-V488 VanDerWaalsContact O-CG2 3.28Å; V484-V488 WeakPolarHBondContact O-CG2 3.49Å; V484-V488 PolarHBondContact O-N 3.2Å; V484-F527 HydrophobicContact CG2-CZ 4.25Å; V484-V547 HydrophobicContact CB-CG1 4.31Å; V484-V547 HydrophobicContact CG1-CG1 4.13Å; V484-V547 HydrophobicContact CG2-CB 4.33Å; V484-V547 HydrophobicContact CG2-CG1 3.42Å; V484-V547 VanDerWaalsContact CG2-CG1 3.42Å; V484-V547 HydrophobicContact CG2-CG2 4.16Å; V484-K550 HydrophobicContact CG1-CB 4.08Å; V484-K550 HydrophobicContact CG1-CD 4.45Å; V484-I551 HydrophobicContact CG1-CD1 4.19Å; V484-I551 HydrophobicContact CG1-CG1 3.83Å
485	D	85	Confident	78	Confident	65 Å²	65	35.7 Å²	35.7	35%	0.348	20%	0.195	S	C	.	.	H	α-helix	trans	-60.4	-39.1	177	-78.1	-29.8	0	0	0	111.6	L481 V488 E489 K550	L481-D485 VanDerWaalsContact O-CB 3.31Å; L481-D485 WeakPolarHBondContact O-CB 3.33Å; L481-D485 PolarHBondContact O-N 2.94Å; D485-V488 PolarHBondContact O-N 2.97Å; D485-E489 VanDerWaalsContact O-CB 3.28Å; D485-E489 WeakPolarHBondContact O-CB 3.49Å; D485-E489 PolarHBondContact O-N 3.3Å; D485-K550 WeakPolarHBondContact OD1-CD 3.5Å; D485-K550 WeakPolarHBondContact OD1-CE 3.44Å; D485-K550 IonicContact OD1-NZ 2.92Å; D485-K550 PolarHBondContact OD1-NZ 3.4Å; D485-K550 IonicContact OD2-NZ 3.34Å; D485-K550 PolarHBondContact OD2-NZ 3.37Å
486	N	83.6	Confident	77.4	Confident	14 Å²	14	38.1 Å²	38.1	8%	0.075	20%	0.202	C	C	.	.	H	α-helix	trans	-68.6	-42.4	173.9	-80	-81.4	0	0	0	112.4	C433 K437 W455 S482 L483 V484 V488 E489 I490	C433-N486 HydrophobicContact CB-CB 4.06Å; C433-N486 VanDerWaalsContact CB-CG 3.4Å; C433-N486 WeakPolarHBondContact CB-ND2 3.47Å; C433-N486 PolarHBondContact SG-ND2 3.11Å; C433-N486 VanDerWaalsContact SG-ND2 3.44Å; K437-N486 WeakPolarHBondContact CE-OD1 3.47Å; K437-N486 PolarHBondContact NZ-OD1 3.49Å; W455-N486 HydrophobicContact CH2-CB 4.12Å; W455-N486 HydrophobicContact CZ3-CB 4.46Å; S482-N486 PolarHBondContact O-N 2.82Å; S482-N486 VanDerWaalsContact O-N 3.13Å; S482-N486 PolarHBondContact O-ND2 3.07Å; L483-N486 PolarHBondContact O-N 2.92Å; V484-N486 VanDerWaalsContact C-N 3.28Å; V484-N486 PolarHBondContact O-N 3.29Å; N486-V488 VanDerWaalsContact C-N 3.26Å; N486-V488 PolarHBondContact O-N 3.21Å; N486-E489 PolarHBondContact O-N 3.22Å; N486-I490 WeakPolarHBondContact O-CB 3.12Å; N486-I490 VanDerWaalsContact O-CD1 3.25Å; N486-I490 WeakPolarHBondContact O-CD1 3.37Å; N486-I490 WeakPolarHBondContact O-CG1 3.41Å; N486-I490 PolarHBondContact O-N 2.71Å
487	I	86.7	Confident	76.5	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-42.7	175.3	-66.5	165.5	0	0	0	110.4	F452 W455 V459 L483 V484 S491 L520 L523	F452-I487 HydrophobicContact CE1-CG2 3.96Å; W455-I487 HydrophobicContact CB-CD1 3.98Å; W455-I487 HydrophobicContact CB-CG1 4.28Å; W455-I487 HydrophobicContact CD2-CD1 4.26Å; W455-I487 HydrophobicContact CD2-CG1 3.81Å; W455-I487 HydrophobicContact CE3-CD1 4.04Å; W455-I487 HydrophobicContact CE3-CG1 3.78Å; W455-I487 HydrophobicContact CG-CD1 4.26Å; W455-I487 HydrophobicContact CG-CG1 4.03Å; W455-I487 HydrophobicContact CZ3-CG1 4.39Å; V459-I487 HydrophobicContact CG2-CD1 4.24Å; L483-I487 WeakPolarHBondContact O-CG1 3.49Å; L483-I487 PolarHBondContact O-N 3.03Å; V484-I487 PolarHBondContact O-N 3.17Å; V484-I487 VanDerWaalsContact O-N 3.15Å; I487-S491 VanDerWaalsContact O-CB 3.31Å; I487-S491 WeakPolarHBondContact O-CB 3.29Å; I487-S491 PolarHBondContact O-N 3.14Å; I487-S491 PolarHBondContact O-OG 2.73Å; I487-L520 HydrophobicContact CG2-CD2 3.88Å; I487-L523 HydrophobicContact CD1-CD1 4.09Å; I487-L523 HydrophobicContact CG2-CD1 4.29Å
488	V	85.3	Confident	75	Confident	27 Å²	27	43 Å²	43	16%	0.164	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-46	177.9	168.5	0	0	0	0	111.1	V484 D485 N486 S491 S492 K550 V554	V484-V488 HydrophobicContact CG1-CG2 4.23Å; V484-V488 WeakPolarHBondContact O-CB 3.45Å; V484-V488 VanDerWaalsContact O-CG2 3.28Å; V484-V488 WeakPolarHBondContact O-CG2 3.49Å; V484-V488 PolarHBondContact O-N 3.2Å; D485-V488 PolarHBondContact O-N 2.97Å; N486-V488 VanDerWaalsContact C-N 3.26Å; N486-V488 PolarHBondContact O-N 3.21Å; V488-S491 PolarHBondContact O-N 3.04Å; V488-S492 WeakPolarHBondContact O-CA 3.38Å; V488-S492 WeakPolarHBondContact O-CB 3.07Å; V488-S492 PolarHBondContact O-N 3.17Å; V488-S492 PolarHBondContact O-OG 3.5Å; V488-K550 HydrophobicContact CG2-CB 4.18Å; V488-V554 HydrophobicContact CB-CG2 4.08Å; V488-V554 HydrophobicContact CG1-CG2 3.71Å; V488-V554 HydrophobicContact CG2-CG2 3.95Å
489	E	84.3	Confident	73.4	Confident	105 Å²	105	44.6 Å²	44.6	49%	0.491	25%	0.246	S	C	.	.	H	α-helix	trans	-60	-47.9	176.7	-172.3	-164.1	149.3	0	0	111.2	K437 D485 N486 S491 S492 S493	K437-E489 IonicContact NZ-OE1 3.59Å; K437-E489 PolarHBondContact NZ-OE1 2.98Å; K437-E489 IonicContact NZ-OE2 2.64Å; K437-E489 PolarHBondContact NZ-OE2 2.65Å; D485-E489 VanDerWaalsContact O-CB 3.28Å; D485-E489 WeakPolarHBondContact O-CB 3.49Å; D485-E489 PolarHBondContact O-N 3.3Å; N486-E489 PolarHBondContact O-N 3.22Å; E489-S491 VanDerWaalsContact C-N 3.28Å; E489-S491 PolarHBondContact O-N 2.89Å; E489-S492 PolarHBondContact O-N 3.43Å; E489-S493 WeakPolarHBondContact O-CB 3.39Å; E489-S493 PolarHBondContact O-N 3.23Å
490	I	82.8	Confident	71.9	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.062	29%	0.287	C	S	.	.	H	α-helix	trans	-59.1	-42.9	178.5	-68.3	159.6	0	0	0	110.4	K437 L440 Y451 W455 N486 S493	K437-I490 HydrophobicContact CG-CD1 4.24Å; K437-I490 HydrophobicContact CG-CG1 4.31Å; L440-I490 HydrophobicContact CD1-CG2 3.82Å; L440-I490 HydrophobicContact CD2-CG2 4.08Å; L440-I490 HydrophobicContact CG-CG2 3.68Å; Y451-I490 HydrophobicContact CE1-CG2 4.43Å; Y451-I490 WeakPolarHBondContact OH-CD1 3.33Å; W455-I490 HydrophobicContact CH2-CD1 4.45Å; W455-I490 HydrophobicContact CZ2-CD1 3.75Å; N486-I490 WeakPolarHBondContact O-CB 3.12Å; N486-I490 VanDerWaalsContact O-CD1 3.25Å; N486-I490 WeakPolarHBondContact O-CD1 3.37Å; N486-I490 WeakPolarHBondContact O-CG1 3.41Å; N486-I490 PolarHBondContact O-N 2.71Å; I490-S493 PolarHBondContact O-OG 2.84Å
491	S	82.3	Confident	69.7	Low	1 Å²	1	55.1 Å²	55.1	1%	0.007	32%	0.318	C	S	.	.	H	α-helix	trans	-79	-32.9	-178	-52.5	0	0	0	0	112.8	I487 V488 E489 L494	I487-S491 VanDerWaalsContact O-CB 3.31Å; I487-S491 WeakPolarHBondContact O-CB 3.29Å; I487-S491 PolarHBondContact O-N 3.14Å; I487-S491 PolarHBondContact O-OG 2.73Å; V488-S491 PolarHBondContact O-N 3.04Å; E489-S491 VanDerWaalsContact C-N 3.28Å; E489-S491 PolarHBondContact O-N 2.89Å; S491-L494 WeakPolarHBondContact O-CB 3.49Å; S491-L494 PolarHBondContact O-N 2.96Å
492	S	77.4	Confident	67.8	Low	23 Å²	23	61 Å²	61	16%	0.161	34%	0.344	C	S	.	.	H	α-helix	trans	-75.3	-32.7	178.7	-56.7	0	0	0	0	111.8	V488 E489 L494 L495 E496	V488-S492 WeakPolarHBondContact O-CA 3.38Å; V488-S492 WeakPolarHBondContact O-CB 3.07Å; V488-S492 PolarHBondContact O-N 3.17Å; V488-S492 PolarHBondContact O-OG 3.5Å; E489-S492 PolarHBondContact O-N 3.43Å; S492-L494 PolarHBondContact O-N 2.63Å; S492-L494 VanDerWaalsContact O-N 3.07Å; S492-L495 CarbonylContact O-C 3.56Å; S492-L495 WeakPolarHBondContact O-CA 3.35Å; S492-L495 PolarHBondContact O-N 3.32Å; S492-E496 PolarHBondContact O-N 2.85Å
493	S	73	Confident	66	Low	79 Å²	79	67.3 Å²	67.3	55%	0.552	37%	0.368	S	S	*	.	H	α-helix	trans	-56.5	-26.2	174.1	73.2	0	0	0	0	113.3	E489 I490	E489-S493 WeakPolarHBondContact O-CB 3.39Å; E489-S493 PolarHBondContact O-N 3.23Å; I490-S493 PolarHBondContact O-OG 2.84Å
494	L	69	Low	64	Low	12 Å²	12	68.9 Å²	68.9	6%	0.063	38%	0.38	C	S	.	.	H	α-helix	trans	-74.2	-38.7	172.6	-176.5	81.4	0	0	0	111.9	L441 S491 S492 S497 L505 W508 L516	L441-L494 HydrophobicContact CD2-CD1 3.63Å; L441-L494 HydrophobicContact CG-CD1 4.06Å; S491-L494 WeakPolarHBondContact O-CB 3.49Å; S491-L494 PolarHBondContact O-N 2.96Å; S492-L494 PolarHBondContact O-N 2.63Å; S492-L494 VanDerWaalsContact O-N 3.07Å; L494-S497 PolarHBondContact O-OG 3.35Å; L494-L505 HydrophobicContact CG-CD1 4.14Å; L494-L505 WeakPolarHBondContact O-CD1 3.38Å; L494-W508 HydrophobicContact CD1-CD2 4.05Å; L494-W508 HydrophobicContact CD1-CE3 4.15Å; L494-W508 HydrophobicContact CD1-CH2 4.39Å; L494-W508 HydrophobicContact CD1-CZ2 4.26Å; L494-W508 HydrophobicContact CD1-CZ3 4.35Å; L494-W508 HydrophobicContact CD2-CD2 4.34Å; L494-W508 HydrophobicContact CD2-CE3 3.68Å; L494-W508 HydrophobicContact CD2-CH2 3.36Å; L494-W508 HydrophobicContact CD2-CZ2 4.03Å; L494-W508 HydrophobicContact CD2-CZ3 3.16Å; L494-W508 HydrophobicContact CG-CE3 4.36Å; L494-W508 HydrophobicContact CG-CH2 4.5Å; L494-W508 HydrophobicContact CG-CZ3 4.27Å; L494-L516 HydrophobicContact CD2-CD2 3.92Å
495	L	62.1	Low	62	Low	25 Å²	25	71.6 Å²	71.6	13%	0.131	39%	0.394	C	S	.	.	H	α-helix	trans	-84.7	-33.4	-173.7	-67.1	160.2	0	0	0	113.4	S492 S497 V554	S492-L495 CarbonylContact O-C 3.56Å; S492-L495 WeakPolarHBondContact O-CA 3.35Å; S492-L495 PolarHBondContact O-N 3.32Å; L495-S497 PolarHBondContact O-N 3.32Å; L495-V554 HydrophobicContact CD1-CG1 4.05Å
496	E	55.6	Low	60.1	Low	153 Å²	153	76.2 Å²	76.2	72%	0.715	41%	0.413	S	S	*	.			trans	-74.8	2.3	-176.1	-74.9	-173.8	167.7	0	0	114.4	S492 N498	S492-E496 PolarHBondContact O-N 2.85Å; E496-N498 PolarHBondContact O-N 3.12Å
497	S	48.9	Very low	58.4	Low	53 Å²	53	81.8 Å²	81.8	37%	0.371	44%	0.442	S	S	.	.			trans	-72.7	50.2	171.1	62.1	0	0	0	0	112.6	L494 L495 N499	L494-S497 PolarHBondContact O-OG 3.35Å; L495-S497 PolarHBondContact O-N 3.32Å; S497-N499 VanDerWaalsContact C-N 3.3Å
498	N	39.8	Very low	57	Low	139 Å²	139	82.8 Å²	82.8	74%	0.743	45%	0.446	S	S	*	.			trans	-83.8	4.2	177	-80.1	-28.3	0	0	0	113.6	E496 V500	E496-N498 PolarHBondContact O-N 3.12Å; N498-V500 PolarHBondContact O-N 3.08Å
499	N	38.3	Very low	56.1	Low	145 Å²	145	83.9 Å²	83.9	78%	0.775	45%	0.451	S	S	*	.	S	Bend	trans	-68.1	120.3	168.4	-82.1	-19.6	0	0	0	108.7	S497 A501 Q502	S497-N499 VanDerWaalsContact C-N 3.3Å; N499-A501 CarbonylContact O-C 3.58Å; N499-A501 PolarHBondContact O-N 3.19Å; N499-Q502 PolarHBondContact O-N 3.15Å
500	V	42	Very low	55.3	Low	157 Å²	157	80.9 Å²	80.9	95%	0.952	44%	0.441	S	S	*	.	S	Bend	trans	-47.3	-8.9	-174.1	176.7	0	0	0	0	115.3	N498	N498-V500 PolarHBondContact O-N 3.08Å
501	A	35	Very low	54.8	Low	81 Å²	81	82.4 Å²	82.4	67%	0.669	45%	0.449	S	S	*	.	S	Bend	trans	-112.9	80.2	169.8	0	0	0	0	0	111.4	N499	N499-A501 CarbonylContact O-C 3.58Å; N499-A501 PolarHBondContact O-N 3.19Å
502	Q	39.5	Very low	54.5	Low	158 Å²	158	85.5 Å²	85.5	74%	0.738	46%	0.461	S	S	*	.			trans	-176.9	128.9	133	-100.2	165.7	24.6	0	0	112.5	N499 S504	N499-Q502 PolarHBondContact O-N 3.15Å; Q502-S504 PolarHBondContact O-N 2.87Å
503	K	44.8	Very low	54.5	Low	161 Å²	161	84.5 Å²	84.5	70%	0.7	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	18.6	166.2	-70.2	170	170.8	173	0	113.8	H506 N507	K503-H506 PolarHBondContact O-N 2.91Å; K503-N507 WeakPolarHBondContact O-CB 3.5Å; K503-N507 PolarHBondContact O-N 3.36Å; K503-N507 PolarHBondContact O-ND2 3.04Å; K503-N507 PolarHBondContact O-OD1 3.28Å
504	S	44.3	Very low	54.8	Low	35 Å²	35	81 Å²	81	25%	0.245	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-45.1	-171.1	52.2	0	0	0	0	112.5	Q502 N507 W508	Q502-S504 PolarHBondContact O-N 2.87Å; S504-N507 PolarHBondContact O-N 3.31Å; S504-W508 PolarHBondContact O-N 3.31Å; S504-W508 VanDerWaalsContact O-N 3.09Å
505	L	41.8	Very low	55.5	Low	57 Å²	57	81.2 Å²	81.2	30%	0.298	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-36.5	175.9	-146.2	91.8	0	0	0	111.8	L494 N507 W508 S561	L494-L505 HydrophobicContact CG-CD1 4.14Å; L494-L505 WeakPolarHBondContact O-CD1 3.38Å; L505-N507 VanDerWaalsContact C-N 3.26Å; L505-N507 PolarHBondContact O-N 3.08Å; L505-W508 PolarHBondContact O-N 3.2Å; L505-S561 VanDerWaalsContact CD2-OG 3.25Å; L505-S561 WeakPolarHBondContact CD2-OG 3.47Å
506	H	46.6	Very low	56.6	Low	162 Å²	162	80.1 Å²	80.1	75%	0.75	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.6	173.8	-75.9	-57.6	0	0	0	113.4	K503	K503-H506 PolarHBondContact O-N 2.91Å
507	N	46.8	Very low	58.1	Low	130 Å²	130	72.8 Å²	72.8	70%	0.695	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-8.1	173.4	-72.7	-11.2	0	0	0	112.9	K503 S504 L505	K503-N507 WeakPolarHBondContact O-CB 3.5Å; K503-N507 PolarHBondContact O-N 3.36Å; K503-N507 PolarHBondContact O-ND2 3.04Å; K503-N507 PolarHBondContact O-OD1 3.28Å; S504-N507 PolarHBondContact O-N 3.31Å; L505-N507 VanDerWaalsContact C-N 3.26Å; L505-N507 PolarHBondContact O-N 3.08Å
508	W	58.3	Low	60	Low	24 Å²	24	70.5 Å²	70.5	9%	0.091	37%	0.374	C	S	.	.	S	Bend	trans	-80.7	124.5	177.4	-161.4	50.9	0	0	0	109.7	L441 I448 L494 S504 L505 P510 R512 G513 L516	L441-W508 HydrophobicContact CD2-CG 4.03Å; I448-W508 HydrophobicContact CD1-CZ2 4.29Å; L494-W508 HydrophobicContact CD1-CD2 4.05Å; L494-W508 HydrophobicContact CD1-CE3 4.15Å; L494-W508 HydrophobicContact CD1-CH2 4.39Å; L494-W508 HydrophobicContact CD1-CZ2 4.26Å; L494-W508 HydrophobicContact CD1-CZ3 4.35Å; L494-W508 HydrophobicContact CD2-CD2 4.34Å; L494-W508 HydrophobicContact CD2-CE3 3.68Å; L494-W508 HydrophobicContact CD2-CH2 3.36Å; L494-W508 HydrophobicContact CD2-CZ2 4.03Å; L494-W508 HydrophobicContact CD2-CZ3 3.16Å; L494-W508 HydrophobicContact CG-CE3 4.36Å; L494-W508 HydrophobicContact CG-CH2 4.5Å; L494-W508 HydrophobicContact CG-CZ3 4.27Å; S504-W508 PolarHBondContact O-N 3.31Å; S504-W508 VanDerWaalsContact O-N 3.09Å; L505-W508 PolarHBondContact O-N 3.2Å; W508-P510 VanDerWaalsContact O-CD 3.29Å; W508-P510 WeakPolarHBondContact O-CD 3.46Å; W508-P510 VanDerWaalsContact O-N 3.11Å; W508-R512 HydrophobicContact CH2-CB 4.33Å; W508-R512 HydrophobicContact CZ2-CB 3.85Å; W508-G513 VanDerWaalsContact CZ3-CA 3.46Å; W508-L516 HydrophobicContact CH2-CB 4.21Å; W508-L516 HydrophobicContact CH2-CD2 3.73Å; W508-L516 HydrophobicContact CZ3-CD2 4.31Å
509	D	65.7	Low	62.3	Low	49 Å²	49	64 Å²	64	26%	0.262	34%	0.339	S	S	.	.			trans	-55.1	115.9	-177.1	174.9	6.6	0	0	0	109.9	K445 N511 R512 G513	K445-D509 WeakPolarHBondContact CE-OD2 3.43Å; K445-D509 IonicContact NZ-OD2 3.41Å; D509-N511 PolarHBondContact O-N 3.29Å; D509-N511 WeakPolarHBondContact OD1-CB 3.39Å; D509-N511 PolarHBondContact OD1-N 3.32Å; D509-N511 VanDerWaalsContact OD1-N 3.13Å; D509-N511 PolarHBondContact OD1-ND2 2.86Å; D509-R512 HydrophobicContact CB-CG 4.04Å; D509-R512 WeakPolarHBondContact O-CA 3.19Å; D509-R512 VanDerWaalsContact O-CB 3.31Å; D509-R512 WeakPolarHBondContact O-CB 3.38Å; D509-R512 PolarHBondContact O-N 3.22Å; D509-G513 PolarHBondContact O-N 2.85Å
510	P	67.2	Low	64.8	Low	43 Å²	43	57.1 Å²	57.1	28%	0.279	30%	0.302	S	S	.	.	H	α-helix	trans	-54.7	-29.8	-176.6	-28.2	34.6	0	0	0	114.2	W508 R512 G513 C514 R592	W508-P510 VanDerWaalsContact O-CD 3.29Å; W508-P510 WeakPolarHBondContact O-CD 3.46Å; W508-P510 VanDerWaalsContact O-N 3.11Å; P510-R512 VanDerWaalsContact C-N 3.27Å; P510-R512 PolarHBondContact O-N 3.07Å; P510-G513 CarbonylContact O-C 3.52Å; P510-G513 WeakPolarHBondContact O-CA 3.23Å; P510-G513 PolarHBondContact O-N 3.36Å; P510-G513 VanDerWaalsContact O-N 3.07Å; P510-C514 PolarHBondContact O-N 3.26Å; P510-C514 PolarHBondContact O-SG 3.19Å; P510-R592 VanDerWaalsContact CB-CD 3.46Å; P510-R592 HydrophobicContact CB-CG 3.94Å
511	N	72.1	Confident	67.1	Low	44 Å²	44	49.7 Å²	49.7	24%	0.235	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-31	176.8	-60.1	-54.5	0	0	0	112.5	K445 D509 G513 C514 I515	K445-N511 HydrophobicContact CD-CB 4.03Å; K445-N511 PolarHBondContact NZ-ND2 3.46Å; D509-N511 PolarHBondContact O-N 3.29Å; D509-N511 WeakPolarHBondContact OD1-CB 3.39Å; D509-N511 PolarHBondContact OD1-N 3.32Å; D509-N511 VanDerWaalsContact OD1-N 3.13Å; D509-N511 PolarHBondContact OD1-ND2 2.86Å; N511-G513 VanDerWaalsContact C-N 3.33Å; N511-C514 PolarHBondContact O-N 3.46Å; N511-I515 WeakPolarHBondContact O-CG1 3.42Å; N511-I515 PolarHBondContact O-N 2.96Å
512	R	75.8	Confident	69.7	Low	66 Å²	66	46.1 Å²	46.1	25%	0.249	23%	0.226	C	C	.	.	H	α-helix	trans	-67.7	-38.5	171.3	-64.5	-178.3	-169.7	-171.3	6.1	110.3	L441 L443 K445 I448 W508 D509 P510 I515 L516	L441-R512 PolarHBondContact O-NH1 3.41Å; L443-R512 PolarHBondContact O-NH1 3.42Å; K445-R512 HydrophobicContact CG-CG 3.82Å; I448-R512 HydrophobicContact CD1-CB 3.81Å; I448-R512 HydrophobicContact CD1-CG 4.17Å; W508-R512 HydrophobicContact CH2-CB 4.33Å; W508-R512 HydrophobicContact CZ2-CB 3.85Å; D509-R512 HydrophobicContact CB-CG 4.04Å; D509-R512 WeakPolarHBondContact O-CA 3.19Å; D509-R512 VanDerWaalsContact O-CB 3.31Å; D509-R512 WeakPolarHBondContact O-CB 3.38Å; D509-R512 PolarHBondContact O-N 3.22Å; P510-R512 VanDerWaalsContact C-N 3.27Å; P510-R512 PolarHBondContact O-N 3.07Å; R512-I515 PolarHBondContact O-N 3.28Å; R512-L516 WeakPolarHBondContact O-CB 3.4Å; R512-L516 PolarHBondContact O-N 3.49Å
513	G	78.2	Confident	72.1	Confident	2 Å²	2	38.6 Å²	38.6	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-43	171.3	0	0	0	0	0	112.9	W508 D509 P510 N511 L516 L517	W508-G513 VanDerWaalsContact CZ3-CA 3.46Å; D509-G513 PolarHBondContact O-N 2.85Å; P510-G513 CarbonylContact O-C 3.52Å; P510-G513 WeakPolarHBondContact O-CA 3.23Å; P510-G513 PolarHBondContact O-N 3.36Å; P510-G513 VanDerWaalsContact O-N 3.07Å; N511-G513 VanDerWaalsContact C-N 3.33Å; G513-L516 PolarHBondContact O-N 3.26Å; G513-L517 WeakPolarHBondContact O-CB 3.39Å; G513-L517 PolarHBondContact O-N 3.25Å
514	C	79.9	Confident	74.2	Confident	4 Å²	4	31 Å²	31	3%	0.027	16%	0.158	C	C	.	.	H	α-helix	trans	-61.6	-42.8	174.1	-70.7	0	0	0	0	112.4	P510 N511 L517 Q518 I599	P510-C514 PolarHBondContact O-N 3.26Å; P510-C514 PolarHBondContact O-SG 3.19Å; N511-C514 PolarHBondContact O-N 3.46Å; C514-L517 WeakPolarHBondContact O-CB 3.38Å; C514-L517 PolarHBondContact O-N 3.46Å; C514-Q518 WeakPolarHBondContact O-CB 3.48Å; C514-Q518 PolarHBondContact O-N 3.46Å; C514-I599 HydrophobicContact CB-CD1 3.64Å
515	I	82.5	Confident	76.2	Confident	17 Å²	17	29.3 Å²	29.3	9%	0.087	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-40.3	177.2	-68.5	168.1	0	0	0	111.4	K445 I448 N511 R512 L517 Q518 C519	K445-I515 HydrophobicContact CB-CD1 3.38Å; K445-I515 HydrophobicContact CD-CD1 3.94Å; K445-I515 HydrophobicContact CG-CD1 3.7Å; I448-I515 HydrophobicContact CB-CG2 4.37Å; I448-I515 HydrophobicContact CG2-CG2 4.13Å; N511-I515 WeakPolarHBondContact O-CG1 3.42Å; N511-I515 PolarHBondContact O-N 2.96Å; R512-I515 PolarHBondContact O-N 3.28Å; I515-L517 VanDerWaalsContact C-N 3.31Å; I515-L517 PolarHBondContact O-N 3.03Å; I515-Q518 PolarHBondContact O-N 3.49Å; I515-C519 WeakPolarHBondContact O-CB 3.47Å; I515-C519 PolarHBondContact O-N 2.98Å; I515-C519 PolarHBondContact O-SG 3.16Å
516	L	85.7	Confident	78.2	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-58.5	-46.3	173.3	175.9	63.4	0	0	0	110.6	L440 I448 F452 L494 W508 R512 G513 Q518 C519 L520 L558	L440-L516 HydrophobicContact CD1-CD1 4.22Å; L440-L516 HydrophobicContact CD1-CD2 4.2Å; I448-L516 HydrophobicContact CG2-CB 4.48Å; F452-L516 HydrophobicContact CD2-CD1 4.25Å; F452-L516 HydrophobicContact CE1-CD1 4.25Å; F452-L516 HydrophobicContact CE2-CD1 3.25Å; F452-L516 HydrophobicContact CZ-CD1 3.25Å; L494-L516 HydrophobicContact CD2-CD2 3.92Å; W508-L516 HydrophobicContact CH2-CB 4.21Å; W508-L516 HydrophobicContact CH2-CD2 3.73Å; W508-L516 HydrophobicContact CZ3-CD2 4.31Å; R512-L516 WeakPolarHBondContact O-CB 3.4Å; R512-L516 PolarHBondContact O-N 3.49Å; G513-L516 PolarHBondContact O-N 3.26Å; L516-Q518 VanDerWaalsContact C-N 3.35Å; L516-Q518 PolarHBondContact O-N 2.95Å; L516-C519 PolarHBondContact O-N 2.92Å; L516-L520 HydrophobicContact CD1-CD1 4.23Å; L516-L520 HydrophobicContact CD1-CG 4.31Å; L516-L520 HydrophobicContact CG-CD1 4.16Å; L516-L520 WeakPolarHBondContact O-CG 3.27Å; L516-L520 PolarHBondContact O-N 3.26Å; L516-L558 HydrophobicContact CB-CD2 4.27Å; L516-L558 HydrophobicContact CD2-CD1 4.38Å; L516-L558 HydrophobicContact CD2-CD2 4.04Å; L516-L558 HydrophobicContact CG-CD2 3.91Å
517	L	87.4	Confident	80	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58.3	-47.8	175.9	177.9	65.2	0	0	0	111.2	G513 C514 I515 C519 L520 Q521 I555 L558 R559 L562 F596	G513-L517 WeakPolarHBondContact O-CB 3.39Å; G513-L517 PolarHBondContact O-N 3.25Å; C514-L517 WeakPolarHBondContact O-CB 3.38Å; C514-L517 PolarHBondContact O-N 3.46Å; I515-L517 VanDerWaalsContact C-N 3.31Å; I515-L517 PolarHBondContact O-N 3.03Å; L517-C519 VanDerWaalsContact C-N 3.34Å; L517-C519 PolarHBondContact O-N 3.13Å; L517-L520 PolarHBondContact O-N 3.34Å; L517-Q521 HydrophobicContact CD1-CG 4.36Å; L517-Q521 WeakPolarHBondContact O-CB 3.3Å; L517-Q521 VanDerWaalsContact O-CG 3.26Å; L517-Q521 WeakPolarHBondContact O-CG 3.5Å; L517-Q521 PolarHBondContact O-N 3.32Å; L517-I555 HydrophobicContact CD1-CG1 4.49Å; L517-I555 HydrophobicContact CD1-CG2 3.84Å; L517-L558 HydrophobicContact CB-CD2 3.62Å; L517-L558 HydrophobicContact CB-CG 4.34Å; L517-L558 HydrophobicContact CD1-CD2 4.15Å; L517-L558 HydrophobicContact CG-CD2 4.49Å; L517-R559 HydrophobicContact CD1-CG 3.87Å; L517-R559 HydrophobicContact CD2-CG 4.24Å; L517-L562 HydrophobicContact CB-CD1 4.3Å; L517-L562 HydrophobicContact CD2-CD1 3.89Å; L517-F596 HydrophobicContact CD2-CD2 3.76Å; L517-F596 HydrophobicContact CD2-CE2 3.62Å
518	Q	88.3	Confident	81.7	Confident	5 Å²	5	13 Å²	13	2%	0.023	7%	0.065	C	C	.	.	H	α-helix	trans	-59.9	-43.4	178.4	-170.8	179.4	32.8	0	0	111.5	T392 C514 I515 L516 Q521 Y522 I599	T392-Q518 PolarHBondContact O-NE2 3.08Å; C514-Q518 WeakPolarHBondContact O-CB 3.48Å; C514-Q518 PolarHBondContact O-N 3.46Å; I515-Q518 PolarHBondContact O-N 3.49Å; L516-Q518 VanDerWaalsContact C-N 3.35Å; L516-Q518 PolarHBondContact O-N 2.95Å; Q518-Q521 WeakPolarHBondContact O-CB 3.48Å; Q518-Q521 PolarHBondContact O-N 3.3Å; Q518-Y522 HydrophobicContact CG-CD2 4.31Å; Q518-Y522 HydrophobicContact CG-CE1 4.1Å; Q518-Y522 HydrophobicContact CG-CE2 3.59Å; Q518-Y522 VanDerWaalsContact CG-CZ 3.48Å; Q518-Y522 WeakPolarHBondContact CG-OH 3.49Å; Q518-Y522 PolarHBondContact NE2-OH 3.09Å; Q518-Y522 WeakPolarHBondContact O-CD2 3.38Å; Q518-Y522 PolarHBondContact O-N 3.37Å; Q518-I599 HydrophobicContact CB-CD1 4.46Å; Q518-I599 HydrophobicContact CB-CG2 3.87Å; Q518-I599 HydrophobicContact CG-CG2 4.18Å
519	C	88.5	Confident	82.7	Confident	1 Å²	1	13.7 Å²	13.7	1%	0.007	7%	0.069	C	C	.	.	H	α-helix	trans	-66	-42.2	178.3	-65.2	0	0	0	0	112.4	F452 I515 L516 L517 Q521 Y522 L523	F452-C519 HydrophobicContact CB-CB 3.64Å; F452-C519 HydrophobicContact CD1-CB 4.04Å; F452-C519 HydrophobicContact CD2-CB 4.11Å; F452-C519 HydrophobicContact CG-CB 3.65Å; I515-C519 WeakPolarHBondContact O-CB 3.47Å; I515-C519 PolarHBondContact O-N 2.98Å; I515-C519 PolarHBondContact O-SG 3.16Å; L516-C519 PolarHBondContact O-N 2.92Å; L517-C519 VanDerWaalsContact C-N 3.34Å; L517-C519 PolarHBondContact O-N 3.13Å; C519-Q521 VanDerWaalsContact C-N 3.33Å; C519-Y522 WeakPolarHBondContact O-CB 3.5Å; C519-Y522 PolarHBondContact O-N 2.99Å; C519-L523 PolarHBondContact O-N 3.36Å; C519-L523 VanDerWaalsContact O-N 3.09Å
520	L	90.5	Very high	83.1	Confident	2 Å²	2	13.1 Å²	13.1	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-65	-39	175.7	-69.7	171.8	0	0	0	111.6	F452 I487 L516 L517 Y522 L523 L524 V554 I555 L558	F452-L520 HydrophobicContact CD1-CD2 4.49Å; F452-L520 HydrophobicContact CE1-CD2 3.62Å; F452-L520 HydrophobicContact CE1-CG 4.23Å; F452-L520 HydrophobicContact CZ-CD2 4.22Å; I487-L520 HydrophobicContact CG2-CD2 3.88Å; L516-L520 HydrophobicContact CD1-CD1 4.23Å; L516-L520 HydrophobicContact CD1-CG 4.31Å; L516-L520 HydrophobicContact CG-CD1 4.16Å; L516-L520 WeakPolarHBondContact O-CG 3.27Å; L516-L520 PolarHBondContact O-N 3.26Å; L517-L520 PolarHBondContact O-N 3.34Å; L520-Y522 VanDerWaalsContact C-N 3.35Å; L520-L523 HydrophobicContact CD2-CD1 4.43Å; L520-L523 WeakPolarHBondContact O-CB 3.37Å; L520-L523 PolarHBondContact O-N 2.73Å; L520-L524 PolarHBondContact O-N 3.28Å; L520-V554 HydrophobicContact CD1-CG1 3.8Å; L520-I555 HydrophobicContact CB-CD1 3.91Å; L520-I555 HydrophobicContact CB-CG1 3.77Å; L520-I555 HydrophobicContact CD1-CG1 4.16Å; L520-L558 HydrophobicContact CD1-CD2 4.27Å
521	Q	91	Very high	83.2	Confident	1 Å²	1	11.2 Å²	11.2	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-62.3	-40.9	173.4	-80.2	174.6	-4.6	0	0	111.9	L517 Q518 C519 L523 L524 V525 I555 I599 F603	L517-Q521 HydrophobicContact CD1-CG 4.36Å; L517-Q521 WeakPolarHBondContact O-CB 3.3Å; L517-Q521 VanDerWaalsContact O-CG 3.26Å; L517-Q521 WeakPolarHBondContact O-CG 3.5Å; L517-Q521 PolarHBondContact O-N 3.32Å; Q518-Q521 WeakPolarHBondContact O-CB 3.48Å; Q518-Q521 PolarHBondContact O-N 3.3Å; C519-Q521 VanDerWaalsContact C-N 3.33Å; Q521-L523 VanDerWaalsContact C-N 3.33Å; Q521-L523 PolarHBondContact O-N 2.92Å; Q521-L524 WeakPolarHBondContact O-CA 3.37Å; Q521-L524 WeakPolarHBondContact O-CB 3.43Å; Q521-L524 PolarHBondContact O-N 3.09Å; Q521-L524 VanDerWaalsContact O-N 3.09Å; Q521-V525 WeakPolarHBondContact O-CG2 3.33Å; Q521-V525 PolarHBondContact O-N 3.45Å; Q521-I555 HydrophobicContact CG-CD1 4.33Å; Q521-I599 VanDerWaalsContact OE1-CG2 3.27Å; Q521-F603 HydrophobicContact CB-CB 4.34Å; Q521-F603 HydrophobicContact CB-CD2 3.45Å; Q521-F603 VanDerWaalsContact CB-CD2 3.45Å; Q521-F603 HydrophobicContact CB-CE2 3.74Å; Q521-F603 HydrophobicContact CB-CG 3.87Å; Q521-F603 HydrophobicContact CB-CZ 4.39Å; Q521-F603 HydrophobicContact CG-CB 4.3Å; Q521-F603 HydrophobicContact CG-CD1 3.98Å; Q521-F603 HydrophobicContact CG-CD2 3.77Å; Q521-F603 HydrophobicContact CG-CE1 4.16Å; Q521-F603 HydrophobicContact CG-CE2 3.95Å; Q521-F603 HydrophobicContact CG-CG 3.74Å; Q521-F603 HydrophobicContact CG-CZ 4.12Å; Q521-F603 WeakPolarHBondContact O-CE2 3.48Å
522	Y	90	Very high	83	Confident	5 Å²	5	10 Å²	10	2%	0.02	5%	0.047	C	C	.	.	H	α-helix	trans	-63.6	-35.4	174	-69.8	-19.4	0	0	0	113.9	M395 F397 W400 Q518 C519 L520 L524 V525 M526	M395-Y522 PolarHBondContact O-OH 3.2Å; F397-Y522 HydrophobicContact CB-CD1 3.69Å; F397-Y522 HydrophobicContact CB-CE1 3.91Å; F397-Y522 HydrophobicContact CB-CG 4.37Å; F397-Y522 AromaticContact CD2-CD1 4Å; F397-Y522 HydrophobicContact CD2-CD1 4Å; F397-Y522 AromaticContact CD2-CG 3.83Å; F397-Y522 HydrophobicContact CD2-CG 3.83Å; F397-Y522 HydrophobicContact CG-CD1 4.33Å; W400-Y522 HydrophobicContact CB-CD2 4Å; W400-Y522 HydrophobicContact CB-CE2 3.46Å; W400-Y522 VanDerWaalsContact CB-CE2 3.46Å; W400-Y522 AromaticContact CD1-CE2 3.7Å; W400-Y522 AromaticContact CD2-CD2 3.49Å; W400-Y522 HydrophobicContact CD2-CD2 3.49Å; W400-Y522 VanDerWaalsContact CD2-CD2 3.49Å; W400-Y522 AromaticContact CD2-CE2 3.84Å; W400-Y522 HydrophobicContact CD2-CE2 3.84Å; W400-Y522 HydrophobicContact CD2-CG 4.45Å; W400-Y522 AromaticContact CE2-CD2 3.98Å; W400-Y522 AromaticContact CE3-CD2 3.74Å; W400-Y522 HydrophobicContact CE3-CD2 3.74Å; W400-Y522 HydrophobicContact CE3-CE2 4.4Å; W400-Y522 HydrophobicContact CE3-CG 4.28Å; W400-Y522 AromaticContact CG-CD2 3.6Å; W400-Y522 HydrophobicContact CG-CD2 3.6Å; W400-Y522 AromaticContact CG-CE2 3.38Å; W400-Y522 HydrophobicContact CG-CE2 3.38Å; W400-Y522 HydrophobicContact CZ3-CD2 4.4Å; Q518-Y522 HydrophobicContact CG-CD2 4.31Å; Q518-Y522 HydrophobicContact CG-CE1 4.1Å; Q518-Y522 HydrophobicContact CG-CE2 3.59Å; Q518-Y522 VanDerWaalsContact CG-CZ 3.48Å; Q518-Y522 WeakPolarHBondContact CG-OH 3.49Å; Q518-Y522 PolarHBondContact NE2-OH 3.09Å; Q518-Y522 WeakPolarHBondContact O-CD2 3.38Å; Q518-Y522 PolarHBondContact O-N 3.37Å; C519-Y522 WeakPolarHBondContact O-CB 3.5Å; C519-Y522 PolarHBondContact O-N 2.99Å; L520-Y522 VanDerWaalsContact C-N 3.35Å; Y522-L524 VanDerWaalsContact C-N 3.29Å; Y522-L524 PolarHBondContact O-N 2.65Å; Y522-V525 PolarHBondContact O-N 3.29Å; Y522-M526 PolarHBondContact O-N 3.42Å
523	L	88.9	Confident	82.5	Confident	1 Å²	1	12.5 Å²	12.5	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-61.2	-41.1	170.9	-66.4	176.6	0	0	0	110.9	F452 A456 I487 C519 L520 Q521 M526 F527	F452-L523 HydrophobicContact CD1-CD1 4.04Å; F452-L523 HydrophobicContact CE1-CD1 4.37Å; A456-L523 HydrophobicContact CB-CD2 3.78Å; I487-L523 HydrophobicContact CD1-CD1 4.09Å; I487-L523 HydrophobicContact CG2-CD1 4.29Å; C519-L523 PolarHBondContact O-N 3.36Å; C519-L523 VanDerWaalsContact O-N 3.09Å; L520-L523 HydrophobicContact CD2-CD1 4.43Å; L520-L523 WeakPolarHBondContact O-CB 3.37Å; L520-L523 PolarHBondContact O-N 2.73Å; Q521-L523 VanDerWaalsContact C-N 3.33Å; Q521-L523 PolarHBondContact O-N 2.92Å; L523-M526 HydrophobicContact CD2-CE 3.95Å; L523-M526 WeakPolarHBondContact O-CB 3.39Å; L523-M526 PolarHBondContact O-N 3.25Å; L523-F527 HydrophobicContact CB-CE2 4.36Å; L523-F527 WeakPolarHBondContact O-CD2 3.42Å; L523-F527 PolarHBondContact O-N 2.78Å
524	L	89	Confident	81.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64.3	-38.5	173.9	-68.2	-176.2	0	0	0	113.1	L520 Q521 Y522 M526 F527 E528 V548 I551 N552 I555 F603 C629	L520-L524 PolarHBondContact O-N 3.28Å; Q521-L524 WeakPolarHBondContact O-CA 3.37Å; Q521-L524 WeakPolarHBondContact O-CB 3.43Å; Q521-L524 PolarHBondContact O-N 3.09Å; Q521-L524 VanDerWaalsContact O-N 3.09Å; Y522-L524 VanDerWaalsContact C-N 3.29Å; Y522-L524 PolarHBondContact O-N 2.65Å; L524-M526 VanDerWaalsContact C-N 3.31Å; L524-M526 PolarHBondContact O-N 2.93Å; L524-F527 HydrophobicContact CD2-CD2 4.39Å; L524-F527 PolarHBondContact O-N 3.36Å; L524-E528 PolarHBondContact O-N 3.28Å; L524-V548 HydrophobicContact CD2-CB 4.35Å; L524-V548 HydrophobicContact CD2-CG1 4.04Å; L524-V548 HydrophobicContact CD2-CG2 4.3Å; L524-I551 HydrophobicContact CD1-CG2 4.32Å; L524-I551 HydrophobicContact CD2-CB 3.97Å; L524-I551 HydrophobicContact CD2-CD1 4.3Å; L524-I551 HydrophobicContact CD2-CG2 3.77Å; L524-I551 HydrophobicContact CG-CG2 3.87Å; L524-N552 WeakPolarHBondContact CD1-OD1 3.18Å; L524-I555 HydrophobicContact CD1-CD1 3.42Å; L524-I555 VanDerWaalsContact CD1-CD1 3.42Å; L524-I555 HydrophobicContact CG-CD1 4.1Å; L524-F603 HydrophobicContact CB-CE2 4.13Å; L524-F603 HydrophobicContact CB-CZ 4.24Å; L524-F603 HydrophobicContact CD1-CZ 4.04Å; L524-C629 HydrophobicContact CB-CB 4.39Å; L524-C629 HydrophobicContact CD1-CB 4.41Å; L524-C629 WeakPolarHBondContact CD1-O 3.11Å
525	V	87.1	Confident	80.6	Confident	1 Å²	1	17.3 Å²	17.3	1%	0.006	9%	0.092	C	C	.	.	H	α-helix	trans	-61.6	-41	173.3	176.4	0	0	0	0	110.6	F397 Q521 Y522 E528 E529 F603 D606 L607	F397-V525 HydrophobicContact CB-CB 4.42Å; F397-V525 HydrophobicContact CB-CG1 3.96Å; F397-V525 HydrophobicContact CD1-CG1 3.7Å; F397-V525 HydrophobicContact CE1-CG1 4.42Å; F397-V525 HydrophobicContact CG-CB 4.24Å; F397-V525 HydrophobicContact CG-CG1 3.78Å; Q521-V525 WeakPolarHBondContact O-CG2 3.33Å; Q521-V525 PolarHBondContact O-N 3.45Å; Y522-V525 PolarHBondContact O-N 3.29Å; V525-E528 WeakPolarHBondContact O-CB 3.42Å; V525-E528 PolarHBondContact O-N 3.01Å; V525-E529 HydrophobicContact CG1-CG 4.44Å; V525-E529 PolarHBondContact O-N 3.35Å; V525-F603 HydrophobicContact CG2-CD2 3.89Å; V525-F603 HydrophobicContact CG2-CE2 3.92Å; V525-D606 HydrophobicContact CG1-CB 4.34Å; V525-D606 HydrophobicContact CG2-CB 3.95Å; V525-L607 HydrophobicContact CG2-CD2 4.06Å; V525-L607 HydrophobicContact CG2-CG 4.31Å
526	M	83.7	Confident	79.3	Confident	4 Å²	4	25.7 Å²	25.7	2%	0.02	13%	0.131	C	C	.	.	H	α-helix	trans	-61.7	-45.5	173.9	-72.7	-179.8	3.9	0	0	112.4	F397 A456 V459 Y522 L523 L524 E528 E529 Y530	F397-M526 HydrophobicContact CE1-CG 4.19Å; F397-M526 HydrophobicContact CE2-CG 3.46Å; F397-M526 VanDerWaalsContact CE2-CG 3.46Å; F397-M526 HydrophobicContact CE2-SD 3.98Å; F397-M526 HydrophobicContact CZ-CG 3.24Å; F397-M526 HydrophobicContact CZ-SD 4.01Å; A456-M526 HydrophobicContact CB-CE 3.97Å; A456-M526 HydrophobicContact CB-SD 3.71Å; A456-M526 WeakPolarHBondContact O-CE 3.34Å; V459-M526 HydrophobicContact CB-CE 4.01Å; V459-M526 HydrophobicContact CG1-CE 3.73Å; Y522-M526 PolarHBondContact O-N 3.42Å; L523-M526 HydrophobicContact CD2-CE 3.95Å; L523-M526 WeakPolarHBondContact O-CB 3.39Å; L523-M526 PolarHBondContact O-N 3.25Å; L524-M526 VanDerWaalsContact C-N 3.31Å; L524-M526 PolarHBondContact O-N 2.93Å; M526-E528 PolarHBondContact O-N 3.41Å; M526-E529 PolarHBondContact O-N 3.29Å; M526-Y530 WeakPolarHBondContact O-CD2 3.29Å; M526-Y530 PolarHBondContact O-N 2.92Å
527	F	83.9	Confident	78	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-34.7	175.8	-70.7	-62.1	0	0	0	112	V459 L463 L480 V484 L523 L524 G531 L544 V547 V548 I551	V459-F527 HydrophobicContact CG1-CD1 4.44Å; V459-F527 HydrophobicContact CG1-CE1 3.53Å; V459-F527 HydrophobicContact CG1-CE2 4.13Å; V459-F527 HydrophobicContact CG1-CZ 3.33Å; V459-F527 HydrophobicContact CG2-CZ 4.39Å; L463-F527 HydrophobicContact CD1-CD1 3.82Å; L463-F527 HydrophobicContact CD1-CE1 3.94Å; L463-F527 HydrophobicContact CD2-CD1 3.92Å; L463-F527 HydrophobicContact CD2-CE1 3.97Å; L463-F527 HydrophobicContact CG-CD1 4.4Å; L463-F527 HydrophobicContact CG-CE1 4.26Å; L480-F527 HydrophobicContact CD1-CE1 4.07Å; L480-F527 HydrophobicContact CD1-CZ 4.43Å; L480-F527 HydrophobicContact CD2-CE1 4.38Å; V484-F527 HydrophobicContact CG2-CZ 4.25Å; L523-F527 HydrophobicContact CB-CE2 4.36Å; L523-F527 WeakPolarHBondContact O-CD2 3.42Å; L523-F527 PolarHBondContact O-N 2.78Å; L524-F527 HydrophobicContact CD2-CD2 4.39Å; L524-F527 PolarHBondContact O-N 3.36Å; F527-G531 PolarHBondContact O-N 3.11Å; F527-L544 HydrophobicContact CD1-CD2 4.03Å; F527-V547 HydrophobicContact CD1-CG1 4.31Å; F527-V547 HydrophobicContact CD2-CG1 4.39Å; F527-V547 HydrophobicContact CE1-CG1 3.74Å; F527-V547 HydrophobicContact CE2-CG1 3.87Å; F527-V547 HydrophobicContact CZ-CG1 3.49Å; F527-V547 VanDerWaalsContact CZ-CG1 3.49Å; F527-V548 HydrophobicContact CB-CG2 4.33Å; F527-I551 HydrophobicContact CD2-CD1 4.06Å; F527-I551 HydrophobicContact CE2-CD1 3.36Å; F527-I551 HydrophobicContact CZ-CD1 4.2Å
528	E	81.9	Confident	76.8	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-67.7	-49.4	173.8	-169.8	-81.8	163.5	0	0	112.4	L524 V525 M526 Y530 G531 C532 L607 R622 L625 I626	L524-E528 PolarHBondContact O-N 3.28Å; V525-E528 WeakPolarHBondContact O-CB 3.42Å; V525-E528 PolarHBondContact O-N 3.01Å; M526-E528 PolarHBondContact O-N 3.41Å; E528-Y530 VanDerWaalsContact C-N 3.33Å; E528-Y530 PolarHBondContact O-N 3.19Å; E528-G531 PolarHBondContact O-N 3.18Å; E528-G531 VanDerWaalsContact O-N 3.15Å; E528-C532 WeakPolarHBondContact O-CB 3.19Å; E528-C532 PolarHBondContact O-N 2.75Å; E528-C532 PolarHBondContact O-SG 3.17Å; E528-C532 PolarHBondContact OE1-SG 2.85Å; E528-L607 HydrophobicContact CB-CD2 4.02Å; E528-L607 HydrophobicContact CG-CD2 4.09Å; E528-R622 IonicContact OE1-CZ 2.79Å; E528-R622 IonicContact OE1-NE 2.64Å; E528-R622 PolarHBondContact OE1-NE 3.43Å; E528-R622 IonicContact OE1-NH2 2.84Å; E528-R622 PolarHBondContact OE1-NH2 2.97Å; E528-L625 HydrophobicContact CB-CD2 4.34Å; E528-L625 HydrophobicContact CG-CD2 4.32Å; E528-I626 HydrophobicContact CG-CG1 4.13Å
529	E	78.8	Confident	75.7	Confident	39 Å²	39	39.7 Å²	39.7	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-59.9	-43.2	-179.6	-75.6	-168.6	154.8	0	0	111.3	F397 R398 V525 M526 C532 L533	F397-E529 WeakPolarHBondContact CE1-OE2 3.34Å; R398-E529 IonicContact CZ-OE1 3.9Å; R398-E529 IonicContact NE-OE1 2.84Å; R398-E529 PolarHBondContact NE-OE1 3.47Å; R398-E529 IonicContact NH2-OE1 3.05Å; R398-E529 PolarHBondContact NH2-OE1 3.23Å; V525-E529 HydrophobicContact CG1-CG 4.44Å; V525-E529 PolarHBondContact O-N 3.35Å; M526-E529 PolarHBondContact O-N 3.29Å; E529-C532 PolarHBondContact O-N 3.19Å; E529-L533 WeakPolarHBondContact O-CG 3.32Å; E529-L533 PolarHBondContact O-N 3.3Å
530	Y	73.8	Confident	74.7	Confident	36 Å²	36	39.9 Å²	39.9	14%	0.141	20%	0.201	C	C	.	.	H	α-helix	trans	-71.1	-37	175.1	-83.7	-88.3	0	0	0	113	E460 L463 D464 M526 E528 C532 L533 H534	E460-Y530 HydrophobicContact CG-CE2 4.07Å; E460-Y530 WeakPolarHBondContact CG-OH 3.41Å; L463-Y530 HydrophobicContact CB-CD1 3.92Å; L463-Y530 HydrophobicContact CB-CE1 4.26Å; L463-Y530 HydrophobicContact CB-CG 4.07Å; L463-Y530 HydrophobicContact CD1-CD2 3.83Å; L463-Y530 HydrophobicContact CD1-CE2 4.45Å; L463-Y530 HydrophobicContact CD1-CG 3.92Å; D464-Y530 VanDerWaalsContact OD1-CE1 3.29Å; D464-Y530 WeakPolarHBondContact OD1-CE1 3.12Å; D464-Y530 PolarHBondContact OD1-OH 2.77Å; M526-Y530 WeakPolarHBondContact O-CD2 3.29Å; M526-Y530 PolarHBondContact O-N 2.92Å; E528-Y530 VanDerWaalsContact C-N 3.33Å; E528-Y530 PolarHBondContact O-N 3.19Å; Y530-C532 VanDerWaalsContact C-N 3.25Å; Y530-C532 PolarHBondContact O-N 3.4Å; Y530-L533 PolarHBondContact O-N 2.86Å; Y530-H534 PolarHBondContact O-CD2 2.78Å; Y530-H534 PolarHBondContact O-N 3.44Å
531	G	70.2	Confident	73.7	Confident	3 Å²	3	40.9 Å²	40.9	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-36.7	173.4	0	0	0	0	0	112.4	F527 E528 H534 S535	F527-G531 PolarHBondContact O-N 3.11Å; E528-G531 PolarHBondContact O-N 3.18Å; E528-G531 VanDerWaalsContact O-N 3.15Å; G531-H534 CarbonylContact O-C 3.57Å; G531-H534 PolarHBondContact O-N 3.36Å; G531-S535 WeakPolarHBondContact O-CA 3.37Å; G531-S535 PolarHBondContact O-N 3.34Å
532	C	67.1	Low	72.6	Confident	20 Å²	20	45.5 Å²	45.5	14%	0.135	23%	0.231	C	C	.	.	H	α-helix	trans	-70.8	-42.9	178.4	-75.5	0	0	0	0	113.3	E528 E529 Y530 H534 S535 R622	E528-C532 WeakPolarHBondContact O-CB 3.19Å; E528-C532 PolarHBondContact O-N 2.75Å; E528-C532 PolarHBondContact O-SG 3.17Å; E528-C532 PolarHBondContact OE1-SG 2.85Å; E529-C532 PolarHBondContact O-N 3.19Å; Y530-C532 VanDerWaalsContact C-N 3.25Å; Y530-C532 PolarHBondContact O-N 3.4Å; C532-H534 PolarHBondContact O-N 3.33Å; C532-H534 VanDerWaalsContact O-N 3.17Å; C532-S535 WeakPolarHBondContact O-CB 3.47Å; C532-S535 PolarHBondContact O-N 2.91Å; C532-S535 PolarHBondContact O-OG 2.95Å; C532-R622 WeakPolarHBondContact SG-CD 3.26Å; C532-R622 WeakPolarHBondContact SG-CG 3.22Å
533	L	66.2	Low	71.7	Confident	118 Å²	118	47.9 Å²	47.9	62%	0.618	24%	0.239	S	C	*	.	H	α-helix	trans	-56.9	-29.1	176.3	-74.6	167.1	0	0	0	112.5	E529 Y530	E529-L533 WeakPolarHBondContact O-CG 3.32Å; E529-L533 PolarHBondContact O-N 3.3Å; Y530-L533 PolarHBondContact O-N 2.86Å
534	H	64.6	Low	71.2	Confident	50 Å²	50	47.8 Å²	47.8	23%	0.231	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	22.4	-178	-59.8	-62.8	0	0	0	113.3	S467 Y530 G531 C532 E536 L537 Y540	S467-H534 VanDerWaalsContact CB-NE2 3.32Å; S467-H534 WeakPolarHBondContact CB-NE2 3.1Å; Y530-H534 PolarHBondContact O-CD2 2.78Å; Y530-H534 PolarHBondContact O-N 3.44Å; G531-H534 CarbonylContact O-C 3.57Å; G531-H534 PolarHBondContact O-N 3.36Å; C532-H534 PolarHBondContact O-N 3.33Å; C532-H534 VanDerWaalsContact O-N 3.17Å; H534-E536 PolarHBondContact O-N 3.14Å; H534-L537 HydrophobicContact CB-CD1 4.43Å; H534-L537 WeakPolarHBondContact O-CB 3.33Å; H534-L537 PolarHBondContact O-N 3.33Å; H534-Y540 HydrophobicContact CB-CD1 3.95Å; H534-Y540 HydrophobicContact CB-CE1 4.21Å; H534-Y540 HydrophobicContact CB-CG 4.23Å
535	S	53.7	Low	70.8	Confident	56 Å²	56	49.1 Å²	49.1	39%	0.392	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.3	-174.1	53.2	0	0	0	0	114.5	G531 C532 L537	G531-S535 WeakPolarHBondContact O-CA 3.37Å; G531-S535 PolarHBondContact O-N 3.34Å; C532-S535 WeakPolarHBondContact O-CB 3.47Å; C532-S535 PolarHBondContact O-N 2.91Å; C532-S535 PolarHBondContact O-OG 2.95Å; S535-L537 PolarHBondContact O-N 2.62Å
536	E	56.1	Low	70.5	Confident	193 Å²	193	51.1 Å²	51.1	90%	0.902	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.8	173.3	-62.3	-173	169	0	0	113.2	H534 H538	H534-E536 PolarHBondContact O-N 3.14Å; E536-H538 PolarHBondContact O-N 3.23Å
537	L	56.7	Low	70.5	Confident	74 Å²	74	51 Å²	51	39%	0.387	26%	0.258	S	S	.	.			trans	-96.4	84.7	179.6	-63.8	169.3	0	0	0	110	H534 S535 I539 Y540 L541	H534-L537 HydrophobicContact CB-CD1 4.43Å; H534-L537 WeakPolarHBondContact O-CB 3.33Å; H534-L537 PolarHBondContact O-N 3.33Å; S535-L537 PolarHBondContact O-N 2.62Å; L537-I539 PolarHBondContact O-N 3.35Å; L537-Y540 WeakPolarHBondContact O-CA 3.48Å; L537-Y540 VanDerWaalsContact O-CB 3.23Å; L537-Y540 WeakPolarHBondContact O-CB 3.31Å; L537-Y540 PolarHBondContact O-N 2.96Å; L537-L541 PolarHBondContact O-N 2.78Å
538	H	63.5	Low	70.6	Confident	119 Å²	119	51 Å²	51	55%	0.551	26%	0.258	S	S	*	.	H	α-helix	trans	-48.9	-33.1	176.5	-172.8	8.2	0	0	0	113.3	E536 Y540 L541 L542	E536-H538 PolarHBondContact O-N 3.23Å; H538-Y540 VanDerWaalsContact C-N 3.32Å; H538-Y540 PolarHBondContact O-N 3.17Å; H538-L541 PolarHBondContact O-N 3.26Å; H538-L542 WeakPolarHBondContact O-CG 3.33Å; H538-L542 PolarHBondContact O-N 3.38Å; H538-L542 VanDerWaalsContact O-N 3.12Å
539	I	64.7	Low	70.7	Confident	109 Å²	109	55.6 Å²	55.6	56%	0.559	28%	0.28	S	S	*	.	H	α-helix	trans	-61.3	-38	175.7	-61.1	170.2	0	0	0	111.9	L537 R543	L537-I539 PolarHBondContact O-N 3.35Å; I539-R543 WeakPolarHBondContact O-CG 3.36Å; I539-R543 PolarHBondContact O-N 2.82Å
540	Y	67.4	Low	71	Confident	5 Å²	5	57.4 Å²	57.4	2%	0.02	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-47.6	178.5	-171.1	-99.1	0	0	0	110.7	L463 L466 M473 H534 L537 H538 L542 R543 L544	L463-Y540 WeakPolarHBondContact CD2-OH 3.43Å; L466-Y540 HydrophobicContact CB-CE2 4.25Å; L466-Y540 HydrophobicContact CD2-CD2 4Å; L466-Y540 HydrophobicContact CD2-CE2 3.42Å; L466-Y540 VanDerWaalsContact CD2-CE2 3.42Å; L466-Y540 HydrophobicContact CG-CD2 4.27Å; L466-Y540 HydrophobicContact CG-CE2 3.76Å; M473-Y540 HydrophobicContact CE-CD2 4.4Å; H534-Y540 HydrophobicContact CB-CD1 3.95Å; H534-Y540 HydrophobicContact CB-CE1 4.21Å; H534-Y540 HydrophobicContact CB-CG 4.23Å; L537-Y540 WeakPolarHBondContact O-CA 3.48Å; L537-Y540 VanDerWaalsContact O-CB 3.23Å; L537-Y540 WeakPolarHBondContact O-CB 3.31Å; L537-Y540 PolarHBondContact O-N 2.96Å; H538-Y540 VanDerWaalsContact C-N 3.32Å; H538-Y540 PolarHBondContact O-N 3.17Å; Y540-L542 PolarHBondContact O-N 3.09Å; Y540-R543 PolarHBondContact O-N 2.86Å; Y540-R543 VanDerWaalsContact O-N 3.11Å; Y540-L544 HydrophobicContact CD1-CD1 3.82Å; Y540-L544 HydrophobicContact CD1-CG 4.35Å; Y540-L544 HydrophobicContact CE1-CD1 3.39Å; Y540-L544 HydrophobicContact CE1-CG 4.11Å; Y540-L544 PolarHBondContact O-N 2.92Å; Y540-L544 VanDerWaalsContact O-N 3.1Å
541	L	68.9	Low	71.7	Confident	22 Å²	22	55.7 Å²	55.7	12%	0.115	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-48.2	176.5	-166.3	89.4	0	0	0	112.1	L537 H538 R543 L544 L545 F624 L625	L537-L541 PolarHBondContact O-N 2.78Å; H538-L541 PolarHBondContact O-N 3.26Å; L541-R543 PolarHBondContact O-N 3.47Å; L541-L544 PolarHBondContact O-N 3.44Å; L541-L545 PolarHBondContact O-N 3.3Å; L541-L545 VanDerWaalsContact O-N 3.16Å; L541-F624 HydrophobicContact CD2-CD1 3.84Å; L541-F624 HydrophobicContact CD2-CE1 4.34Å; L541-L625 HydrophobicContact CD1-CB 4.09Å; L541-L625 HydrophobicContact CD1-CD1 4.29Å; L541-L625 HydrophobicContact CD1-CD2 4.17Å; L541-L625 HydrophobicContact CD1-CG 4.43Å
542	L	69	Low	72.4	Confident	99 Å²	99	56.4 Å²	56.4	52%	0.518	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-28.4	178.9	-74.2	169.7	0	0	0	112.9	H538 Y540 P546	H538-L542 WeakPolarHBondContact O-CG 3.33Å; H538-L542 PolarHBondContact O-N 3.38Å; H538-L542 VanDerWaalsContact O-N 3.12Å; Y540-L542 PolarHBondContact O-N 3.09Å; L542-P546 WeakPolarHBondContact O-CD 3.45Å
543	R	70.5	Confident	73.2	Confident	54 Å²	54	57.2 Å²	57.2	20%	0.204	30%	0.296	C	S	.	.	H	α-helix	trans	-82.2	-27.8	177.9	-72.8	178.8	-178.2	-117.2	-1.2	112.9	M473 D474 K477 I539 Y540 L541 P546	M473-R543 PolarHBondContact O-NH1 3.5Å; D474-R543 IonicContact OD1-CZ 3.08Å; D474-R543 VanDerWaalsContact OD1-CZ 3.32Å; D474-R543 IonicContact OD1-NH1 2.69Å; D474-R543 PolarHBondContact OD1-NH1 3.19Å; D474-R543 IonicContact OD1-NH2 3.24Å; D474-R543 PolarHBondContact OD1-NH2 3.28Å; K477-R543 HydrophobicContact CD-CG 4.35Å; I539-R543 WeakPolarHBondContact O-CG 3.36Å; I539-R543 PolarHBondContact O-N 2.82Å; Y540-R543 PolarHBondContact O-N 2.86Å; Y540-R543 VanDerWaalsContact O-N 3.11Å; L541-R543 PolarHBondContact O-N 3.47Å; R543-P546 WeakPolarHBondContact O-CD 3.19Å
544	L	77.8	Confident	74.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-76.5	-26.6	174.4	-70.8	-178.1	0	0	0	113	L463 L480 F527 Y540 L541 V547 V548	L463-L544 HydrophobicContact CD2-CD2 3.67Å; L480-L544 HydrophobicContact CD2-CD2 3.98Å; F527-L544 HydrophobicContact CD1-CD2 4.03Å; Y540-L544 HydrophobicContact CD1-CD1 3.82Å; Y540-L544 HydrophobicContact CD1-CG 4.35Å; Y540-L544 HydrophobicContact CE1-CD1 3.39Å; Y540-L544 HydrophobicContact CE1-CG 4.11Å; Y540-L544 PolarHBondContact O-N 2.92Å; Y540-L544 VanDerWaalsContact O-N 3.1Å; L541-L544 PolarHBondContact O-N 3.44Å; L544-V547 WeakPolarHBondContact O-CB 3.36Å; L544-V547 PolarHBondContact O-N 3.36Å; L544-V548 PolarHBondContact O-N 2.85Å
545	L	80.9	Confident	75.2	Confident	28 Å²	28	49.5 Å²	49.5	15%	0.147	26%	0.257	C	S	.	.	H	α-helix	trans	-55	-48.6	-174.9	-172.3	66.9	0	0	0	114.3	L541 V547 V548 E549 F624 Q628	L541-L545 PolarHBondContact O-N 3.3Å; L541-L545 VanDerWaalsContact O-N 3.16Å; L545-V547 PolarHBondContact O-N 2.94Å; L545-V548 PolarHBondContact O-N 3.29Å; L545-E549 HydrophobicContact CG-CG 4.48Å; L545-E549 WeakPolarHBondContact O-CG 3.32Å; L545-E549 PolarHBondContact O-N 3.45Å; L545-F624 HydrophobicContact CD1-CE1 4.15Å; L545-F624 HydrophobicContact CD2-CE1 4.45Å; L545-F624 HydrophobicContact CD2-CZ 4.49Å; L545-Q628 HydrophobicContact CD1-CB 3.89Å; L545-Q628 HydrophobicContact CD1-CG 3.44Å; L545-Q628 VanDerWaalsContact CD1-CG 3.44Å
546	P	81.4	Confident	76.6	Confident	43 Å²	43	50.8 Å²	50.8	28%	0.279	26%	0.256	S	S	.	.	H	α-helix	trans	-63.7	-27.9	178.8	-21	33.9	0	0	0	113.3	L542 R543 K550	L542-P546 WeakPolarHBondContact O-CD 3.45Å; R543-P546 WeakPolarHBondContact O-CD 3.19Å; P546-K550 WeakPolarHBondContact O-CB 3.35Å; P546-K550 VanDerWaalsContact O-CG 3.28Å; P546-K550 WeakPolarHBondContact O-CG 3.46Å; P546-K550 PolarHBondContact O-N 3.04Å; P546-K550 VanDerWaalsContact O-N 3.15Å
547	V	83.6	Confident	77.7	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-71.2	-47.2	176.5	163.8	0	0	0	0	110.1	L480 L481 V484 F527 L544 L545 K550 I551	L480-V547 HydrophobicContact CD2-CG2 4.09Å; L480-V547 HydrophobicContact CG-CG2 4.17Å; L481-V547 HydrophobicContact CD2-CG2 3.72Å; L481-V547 HydrophobicContact CG-CG2 4.36Å; V484-V547 HydrophobicContact CB-CG1 4.31Å; V484-V547 HydrophobicContact CG1-CG1 4.13Å; V484-V547 HydrophobicContact CG2-CB 4.33Å; V484-V547 HydrophobicContact CG2-CG1 3.42Å; V484-V547 VanDerWaalsContact CG2-CG1 3.42Å; V484-V547 HydrophobicContact CG2-CG2 4.16Å; F527-V547 HydrophobicContact CD1-CG1 4.31Å; F527-V547 HydrophobicContact CD2-CG1 4.39Å; F527-V547 HydrophobicContact CE1-CG1 3.74Å; F527-V547 HydrophobicContact CE2-CG1 3.87Å; F527-V547 HydrophobicContact CZ-CG1 3.49Å; F527-V547 VanDerWaalsContact CZ-CG1 3.49Å; L544-V547 WeakPolarHBondContact O-CB 3.36Å; L544-V547 PolarHBondContact O-N 3.36Å; L545-V547 PolarHBondContact O-N 2.94Å; V547-K550 PolarHBondContact O-N 2.87Å; V547-I551 HydrophobicContact CG1-CD1 4.22Å; V547-I551 WeakPolarHBondContact O-CG1 3.28Å; V547-I551 PolarHBondContact O-N 2.82Å; V547-I551 VanDerWaalsContact O-N 3.13Å
548	V	85.5	Confident	78.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-45.9	176.7	171	0	0	0	0	110.7	L524 F527 L544 L545 K550 I551 N552 L625 Q628	L524-V548 HydrophobicContact CD2-CB 4.35Å; L524-V548 HydrophobicContact CD2-CG1 4.04Å; L524-V548 HydrophobicContact CD2-CG2 4.3Å; F527-V548 HydrophobicContact CB-CG2 4.33Å; L544-V548 PolarHBondContact O-N 2.85Å; L545-V548 PolarHBondContact O-N 3.29Å; V548-K550 PolarHBondContact O-N 3.36Å; V548-I551 PolarHBondContact O-N 3.14Å; V548-N552 WeakPolarHBondContact CG1-ND2 3.45Å; V548-N552 WeakPolarHBondContact O-CB 3.47Å; V548-N552 PolarHBondContact O-N 2.94Å; V548-N552 PolarHBondContact O-ND2 3.28Å; V548-L625 HydrophobicContact CG2-CD1 4.33Å; V548-Q628 HydrophobicContact CG1-CB 4.1Å
549	E	84.4	Confident	79.7	Confident	98 Å²	98	35 Å²	35	46%	0.458	19%	0.185	S	C	.	.	H	α-helix	trans	-59.7	-44.5	177.7	-73.3	175	173	0	0	112.6	L545 N552 G553	L545-E549 HydrophobicContact CG-CG 4.48Å; L545-E549 WeakPolarHBondContact O-CG 3.32Å; L545-E549 PolarHBondContact O-N 3.45Å; E549-N552 PolarHBondContact O-N 3.11Å; E549-G553 PolarHBondContact O-N 3.13Å
550	K	85.6	Confident	80.3	Confident	77 Å²	77	36.3 Å²	36.3	34%	0.335	18%	0.183	S	C	.	.	H	α-helix	trans	-60.5	-46.7	177.5	-83.2	-178.6	177.9	-173.5	0	112.3	V484 D485 V488 P546 V547 V548 N552 G553	V484-K550 HydrophobicContact CG1-CB 4.08Å; V484-K550 HydrophobicContact CG1-CD 4.45Å; D485-K550 WeakPolarHBondContact OD1-CD 3.5Å; D485-K550 WeakPolarHBondContact OD1-CE 3.44Å; D485-K550 IonicContact OD1-NZ 2.92Å; D485-K550 PolarHBondContact OD1-NZ 3.4Å; D485-K550 IonicContact OD2-NZ 3.34Å; D485-K550 PolarHBondContact OD2-NZ 3.37Å; V488-K550 HydrophobicContact CG2-CB 4.18Å; P546-K550 WeakPolarHBondContact O-CB 3.35Å; P546-K550 VanDerWaalsContact O-CG 3.28Å; P546-K550 WeakPolarHBondContact O-CG 3.46Å; P546-K550 PolarHBondContact O-N 3.04Å; P546-K550 VanDerWaalsContact O-N 3.15Å; V547-K550 PolarHBondContact O-N 2.87Å; V548-K550 PolarHBondContact O-N 3.36Å; K550-N552 VanDerWaalsContact C-N 3.32Å; K550-G553 PolarHBondContact O-N 3.41Å
551	I	87.6	Confident	80.5	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-41.1	177.1	-67	171	0	0	0	110.4	V484 L524 F527 V547 V548 G553 V554 I555	V484-I551 HydrophobicContact CG1-CD1 4.19Å; V484-I551 HydrophobicContact CG1-CG1 3.83Å; L524-I551 HydrophobicContact CD1-CG2 4.32Å; L524-I551 HydrophobicContact CD2-CB 3.97Å; L524-I551 HydrophobicContact CD2-CD1 4.3Å; L524-I551 HydrophobicContact CD2-CG2 3.77Å; L524-I551 HydrophobicContact CG-CG2 3.87Å; F527-I551 HydrophobicContact CD2-CD1 4.06Å; F527-I551 HydrophobicContact CE2-CD1 3.36Å; F527-I551 HydrophobicContact CZ-CD1 4.2Å; V547-I551 HydrophobicContact CG1-CD1 4.22Å; V547-I551 WeakPolarHBondContact O-CG1 3.28Å; V547-I551 PolarHBondContact O-N 2.82Å; V547-I551 VanDerWaalsContact O-N 3.13Å; V548-I551 PolarHBondContact O-N 3.14Å; I551-G553 VanDerWaalsContact C-N 3.29Å; I551-G553 PolarHBondContact O-N 3.3Å; I551-V554 WeakPolarHBondContact O-CB 3.35Å; I551-V554 PolarHBondContact O-N 2.91Å; I551-I555 HydrophobicContact CG2-CD1 3.75Å; I551-I555 HydrophobicContact CG2-CG1 4.28Å; I551-I555 WeakPolarHBondContact O-CG1 3.49Å; I551-I555 PolarHBondContact O-N 2.73Å
552	N	86.3	Confident	80.8	Confident	17 Å²	17	37.4 Å²	37.4	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-32.8	176.3	-86.8	-43.3	0	0	0	113.8	L524 V548 E549 K550 V554 I555 F556 Q628 C629	L524-N552 WeakPolarHBondContact CD1-OD1 3.18Å; V548-N552 WeakPolarHBondContact CG1-ND2 3.45Å; V548-N552 WeakPolarHBondContact O-CB 3.47Å; V548-N552 PolarHBondContact O-N 2.94Å; V548-N552 PolarHBondContact O-ND2 3.28Å; E549-N552 PolarHBondContact O-N 3.11Å; K550-N552 VanDerWaalsContact C-N 3.32Å; N552-V554 VanDerWaalsContact C-N 3.27Å; N552-V554 PolarHBondContact O-N 3.35Å; N552-I555 PolarHBondContact O-N 3.48Å; N552-F556 VanDerWaalsContact O-CB 3.3Å; N552-F556 WeakPolarHBondContact O-CB 3.37Å; N552-F556 PolarHBondContact O-N 3.36Å; N552-Q628 PolarHBondContact ND2-O 3.31Å; N552-C629 PolarHBondContact OD1-O 3.16Å
553	G	83.3	Confident	80.8	Confident	38 Å²	38	33.9 Å²	33.9	39%	0.392	18%	0.176	S	C	.	.	H	α-helix	trans	-57.8	-39.9	173.9	0	0	0	0	0	112.8	E549 K550 I551 S557	E549-G553 PolarHBondContact O-N 3.13Å; K550-G553 PolarHBondContact O-N 3.41Å; I551-G553 VanDerWaalsContact C-N 3.29Å; I551-G553 PolarHBondContact O-N 3.3Å; G553-S557 PolarHBondContact O-N 3.42Å; G553-S557 PolarHBondContact O-OG 3.1Å; G553-S557 VanDerWaalsContact O-OG 3.13Å
554	V	85	Confident	80.1	Confident	5 Å²	5	34.7 Å²	34.7	3%	0.03	18%	0.184	C	C	.	.	H	α-helix	trans	-72.3	-47.5	175	178.8	0	0	0	0	111.1	V488 L495 L520 I551 N552 F556 S557 L558	V488-V554 HydrophobicContact CB-CG2 4.08Å; V488-V554 HydrophobicContact CG1-CG2 3.71Å; V488-V554 HydrophobicContact CG2-CG2 3.95Å; L495-V554 HydrophobicContact CD1-CG1 4.05Å; L520-V554 HydrophobicContact CD1-CG1 3.8Å; I551-V554 WeakPolarHBondContact O-CB 3.35Å; I551-V554 PolarHBondContact O-N 2.91Å; N552-V554 VanDerWaalsContact C-N 3.27Å; N552-V554 PolarHBondContact O-N 3.35Å; V554-F556 PolarHBondContact O-N 3.1Å; V554-S557 PolarHBondContact O-N 2.81Å; V554-L558 WeakPolarHBondContact O-CB 3.34Å; V554-L558 PolarHBondContact O-N 3.31Å
555	I	87.5	Confident	78.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.1	-40.2	179	-72.6	175.6	0	0	0	110.8	L517 L520 Q521 L524 I551 N552 L558 R559	L517-I555 HydrophobicContact CD1-CG1 4.49Å; L517-I555 HydrophobicContact CD1-CG2 3.84Å; L520-I555 HydrophobicContact CB-CD1 3.91Å; L520-I555 HydrophobicContact CB-CG1 3.77Å; L520-I555 HydrophobicContact CD1-CG1 4.16Å; Q521-I555 HydrophobicContact CG-CD1 4.33Å; L524-I555 HydrophobicContact CD1-CD1 3.42Å; L524-I555 VanDerWaalsContact CD1-CD1 3.42Å; L524-I555 HydrophobicContact CG-CD1 4.1Å; I551-I555 HydrophobicContact CG2-CD1 3.75Å; I551-I555 HydrophobicContact CG2-CG1 4.28Å; I551-I555 WeakPolarHBondContact O-CG1 3.49Å; I551-I555 PolarHBondContact O-N 2.73Å; N552-I555 PolarHBondContact O-N 3.48Å; I555-L558 PolarHBondContact O-N 3.01Å; I555-R559 HydrophobicContact CG2-CG 4.12Å; I555-R559 WeakPolarHBondContact O-CB 3.38Å; I555-R559 VanDerWaalsContact O-CG 3.29Å; I555-R559 WeakPolarHBondContact O-CG 3.36Å; I555-R559 PolarHBondContact O-N 3.39Å
556	F	82.8	Confident	76.8	Confident	84 Å²	84	39.2 Å²	39.2	37%	0.368	21%	0.211	S	C	.	.	H	α-helix	trans	-58.3	-52.6	176	168.1	-117	0	0	0	111.4	N552 V554 L558 R559 R560 S633	N552-F556 VanDerWaalsContact O-CB 3.3Å; N552-F556 WeakPolarHBondContact O-CB 3.37Å; N552-F556 PolarHBondContact O-N 3.36Å; V554-F556 PolarHBondContact O-N 3.1Å; F556-L558 VanDerWaalsContact C-N 3.27Å; F556-L558 PolarHBondContact O-N 2.89Å; F556-R559 PolarHBondContact O-N 3.18Å; F556-R560 WeakPolarHBondContact O-CB 3.22Å; F556-R560 PolarHBondContact O-N 3.46Å; F556-S633 WeakPolarHBondContact CD2-OG 3.48Å; F556-S633 VanDerWaalsContact CE2-CB 3.41Å
557	S	79.4	Confident	74.8	Confident	47 Å²	47	43.3 Å²	43.3	33%	0.329	23%	0.226	S	C	.	.	H	α-helix	trans	-60.2	-40	179.4	-61.5	0	0	0	0	111.5	G553 V554 S561	G553-S557 PolarHBondContact O-N 3.42Å; G553-S557 PolarHBondContact O-OG 3.1Å; G553-S557 VanDerWaalsContact O-OG 3.13Å; V554-S557 PolarHBondContact O-N 2.81Å; S557-S561 WeakPolarHBondContact O-CB 3.39Å; S557-S561 PolarHBondContact O-N 3.12Å
558	L	80.8	Confident	72.6	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-68.9	-45.9	177.5	-169.3	63.5	0	0	0	112.2	L516 L517 L520 V554 I555 F556 R560 S561 L562	L516-L558 HydrophobicContact CB-CD2 4.27Å; L516-L558 HydrophobicContact CD2-CD1 4.38Å; L516-L558 HydrophobicContact CD2-CD2 4.04Å; L516-L558 HydrophobicContact CG-CD2 3.91Å; L517-L558 HydrophobicContact CB-CD2 3.62Å; L517-L558 HydrophobicContact CB-CG 4.34Å; L517-L558 HydrophobicContact CD1-CD2 4.15Å; L517-L558 HydrophobicContact CG-CD2 4.49Å; L520-L558 HydrophobicContact CD1-CD2 4.27Å; V554-L558 WeakPolarHBondContact O-CB 3.34Å; V554-L558 PolarHBondContact O-N 3.31Å; I555-L558 PolarHBondContact O-N 3.01Å; F556-L558 VanDerWaalsContact C-N 3.27Å; F556-L558 PolarHBondContact O-N 2.89Å; L558-R560 VanDerWaalsContact C-N 3.33Å; L558-R560 PolarHBondContact O-N 3.3Å; L558-S561 PolarHBondContact O-N 3.04Å; L558-L562 HydrophobicContact CG-CD1 4.14Å; L558-L562 WeakPolarHBondContact O-CB 3.43Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.14Å; L558-L562 PolarHBondContact O-N 3.19Å
559	R	82.1	Confident	70.4	Confident	1 Å²	1	53.7 Å²	53.7	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-44.1	174.5	-76.1	178.9	-177.9	148.8	1.6	110.8	L517 I555 F556 L562 S563 F596 F603 L630	L517-R559 HydrophobicContact CD1-CG 3.87Å; L517-R559 HydrophobicContact CD2-CG 4.24Å; I555-R559 HydrophobicContact CG2-CG 4.12Å; I555-R559 WeakPolarHBondContact O-CB 3.38Å; I555-R559 VanDerWaalsContact O-CG 3.29Å; I555-R559 WeakPolarHBondContact O-CG 3.36Å; I555-R559 PolarHBondContact O-N 3.39Å; F556-R559 PolarHBondContact O-N 3.18Å; R559-L562 CarbonylContact O-C 3.6Å; R559-L562 PolarHBondContact O-N 3.28Å; R559-S563 VanDerWaalsContact O-CB 3.29Å; R559-S563 WeakPolarHBondContact O-CB 3.45Å; R559-S563 PolarHBondContact O-N 3.27Å; R559-S563 PolarHBondContact O-OG 2.99Å; R559-F596 HydrophobicContact CB-CE2 4.49Å; R559-F596 HydrophobicContact CB-CZ 4.48Å; R559-F596 HydrophobicContact CG-CE2 4.19Å; R559-F596 HydrophobicContact CG-CZ 4.42Å; R559-F603 VanDerWaalsContact NH2-CE1 3.28Å; R559-L630 PolarHBondContact NH1-O 3.36Å
560	R	75.4	Confident	68.2	Low	138 Å²	138	53.3 Å²	53.3	52%	0.521	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-42.1	177.7	-170.3	-179.1	178.2	176.2	-0.3	111.9	F556 L558 L562 S563 L564	F556-R560 WeakPolarHBondContact O-CB 3.22Å; F556-R560 PolarHBondContact O-N 3.46Å; L558-R560 VanDerWaalsContact C-N 3.33Å; L558-R560 PolarHBondContact O-N 3.3Å; R560-L562 VanDerWaalsContact C-N 3.35Å; R560-S563 WeakPolarHBondContact CA-OG 3.34Å; R560-S563 PolarHBondContact O-N 2.86Å; R560-S563 PolarHBondContact O-OG 3.37Å; R560-L564 HydrophobicContact CG-CD1 3.68Å; R560-L564 HydrophobicContact CG-CG 4.2Å; R560-L564 VanDerWaalsContact O-CB 3.25Å; R560-L564 WeakPolarHBondContact O-CB 3.34Å; R560-L564 WeakPolarHBondContact O-CG 3.33Å; R560-L564 PolarHBondContact O-N 3.3Å
561	S	73	Confident	65.9	Low	38 Å²	38	55.2 Å²	55.2	27%	0.266	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-39.6	174.4	-179.2	0	0	0	0	112.1	L505 S557 L558	L505-S561 VanDerWaalsContact CD2-OG 3.25Å; L505-S561 WeakPolarHBondContact CD2-OG 3.47Å; S557-S561 WeakPolarHBondContact O-CB 3.39Å; S557-S561 PolarHBondContact O-N 3.12Å; L558-S561 PolarHBondContact O-N 3.04Å
562	L	74.1	Confident	63.3	Low	12 Å²	12	62.4 Å²	62.4	6%	0.063	34%	0.341	C	S	.	.	H	α-helix	trans	-72.5	-29.4	177.5	-68	172.2	0	0	0	112.7	L517 L558 R559 R560 S565 F596	L517-L562 HydrophobicContact CB-CD1 4.3Å; L517-L562 HydrophobicContact CD2-CD1 3.89Å; L558-L562 HydrophobicContact CG-CD1 4.14Å; L558-L562 WeakPolarHBondContact O-CB 3.43Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.14Å; L558-L562 PolarHBondContact O-N 3.19Å; R559-L562 CarbonylContact O-C 3.6Å; R559-L562 PolarHBondContact O-N 3.28Å; R560-L562 VanDerWaalsContact C-N 3.35Å; L562-S565 PolarHBondContact O-OG 3.18Å; L562-F596 HydrophobicContact CB-CD2 4Å; L562-F596 HydrophobicContact CB-CE2 4.05Å; L562-F596 HydrophobicContact CD1-CD2 3.99Å; L562-F596 HydrophobicContact CD1-CE2 4.25Å
563	S	69.3	Low	60.8	Low	25 Å²	25	65.5 Å²	65.5	18%	0.175	36%	0.364	C	S	.	.	H	α-helix	trans	-85.8	-43.1	179.7	73.5	0	0	0	0	113.7	R559 R560 S565 N566 S637	R559-S563 VanDerWaalsContact O-CB 3.29Å; R559-S563 WeakPolarHBondContact O-CB 3.45Å; R559-S563 PolarHBondContact O-N 3.27Å; R559-S563 PolarHBondContact O-OG 2.99Å; R560-S563 WeakPolarHBondContact CA-OG 3.34Å; R560-S563 PolarHBondContact O-N 2.86Å; R560-S563 PolarHBondContact O-OG 3.37Å; S563-S565 PolarHBondContact O-N 3.42Å; S563-S565 VanDerWaalsContact O-N 3.1Å; S563-N566 VanDerWaalsContact O-CB 3.24Å; S563-N566 WeakPolarHBondContact O-CB 2.94Å; S563-N566 PolarHBondContact O-N 3.27Å; S563-S637 VanDerWaalsContact CB-O 3.23Å; S563-S637 WeakPolarHBondContact CB-O 3.27Å
564	L	55.4	Low	58.5	Low	71 Å²	71	72.4 Å²	72.4	37%	0.372	39%	0.386	S	S	.	.	H	α-helix	trans	-58.9	-22.9	-178.4	-87.4	165.6	0	0	0	113.9	R560 N566 E567	R560-L564 HydrophobicContact CG-CD1 3.68Å; R560-L564 HydrophobicContact CG-CG 4.2Å; R560-L564 VanDerWaalsContact O-CB 3.25Å; R560-L564 WeakPolarHBondContact O-CB 3.34Å; R560-L564 WeakPolarHBondContact O-CG 3.33Å; R560-L564 PolarHBondContact O-N 3.3Å; L564-N566 PolarHBondContact O-N 2.87Å; L564-E567 WeakPolarHBondContact CD2-OE2 3.5Å; L564-E567 PolarHBondContact O-N 3Å
565	S	48.8	Very low	56	Low	36 Å²	36	81.6 Å²	81.6	25%	0.252	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-10	171	46.1	0	0	0	0	114	L562 S563 R592	L562-S565 PolarHBondContact O-OG 3.18Å; S563-S565 PolarHBondContact O-N 3.42Å; S563-S565 VanDerWaalsContact O-N 3.1Å; S565-R592 PolarHBondContact OG-NH1 3.4Å; S565-R592 PolarHBondContact OG-NH2 3.35Å; S565-R592 VanDerWaalsContact OG-NH2 3.14Å
566	N	42.4	Very low	53.5	Low	87 Å²	87	85.2 Å²	85.2	47%	0.465	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-38.6	167	-82.1	-18.4	0	0	0	113.7	S563 L564 I593	S563-N566 VanDerWaalsContact O-CB 3.24Å; S563-N566 WeakPolarHBondContact O-CB 2.94Å; S563-N566 PolarHBondContact O-N 3.27Å; L564-N566 PolarHBondContact O-N 2.87Å; N566-I593 WeakPolarHBondContact OD1-CD1 3.44Å
567	E	39.1	Very low	51	Low	128 Å²	128	89 Å²	89	60%	0.598	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-39.9	-169.8	-78.1	-175.1	164.9	0	0	112.5	L564 L569 S570	L564-E567 WeakPolarHBondContact CD2-OE2 3.5Å; L564-E567 PolarHBondContact O-N 3Å; E567-L569 PolarHBondContact O-N 3.28Å; E567-L569 VanDerWaalsContact O-N 3.08Å; E567-S570 PolarHBondContact O-N 3.29Å; E567-S570 PolarHBondContact O-OG 3.45Å
568	L	37.7	Very low	48.8	Very low	112 Å²	112	93 Å²	93	59%	0.586	50%	0.502	S	S	*	.	H	α-helix	trans	-61.5	-18.6	179.6	-87.1	152.7	0	0	0	114.1
569	L	39.5	Very low	46.6	Very low	107 Å²	107	104.2 Å²	104.2	56%	0.56	54%	0.544	S	S	*	.	H	α-helix	trans	-87.1	-14.5	175.5	-78.1	162.4	0	0	0	113.4	E567	E567-L569 PolarHBondContact O-N 3.28Å; E567-L569 VanDerWaalsContact O-N 3.08Å
570	S	37.4	Very low	44.2	Very low	91 Å²	91	115 Å²	115	64%	0.636	58%	0.584	S	S	*	*	H	α-helix	trans	-91	-22	-174.6	67.3	0	0	0	0	114.3	E567	E567-S570 PolarHBondContact O-N 3.29Å; E567-S570 PolarHBondContact O-OG 3.45Å
571	T	36.8	Very low	42.3	Very low	116 Å²	116	113.7 Å²	113.7	71%	0.712	59%	0.594	S	S	*	*	H	α-helix	trans	-118.1	-18.4	-170	49.1	0	0	0	0	116.9
572	E	33.9	Very low	40.7	Very low	152 Å²	152	116 Å²	116	71%	0.71	61%	0.606	S	S	*	*	S	Bend	trans	-124.7	-9.5	-172.4	-71.6	-169.2	161.5	0	0	116.8
573	S	33.4	Very low	38.9	Very low	83 Å²	83	118.5 Å²	118.5	58%	0.58	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	8.3	-171.8	64.5	0	0	0	0	116.9
574	E	34.2	Very low	37.1	Very low	182 Å²	182	125.8 Å²	125.8	85%	0.85	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-14.2	172.6	-96.9	-171.6	168.1	0	0	114.4
575	F	33.6	Very low	36.5	Very low	199 Å²	199	128 Å²	128	87%	0.873	67%	0.669	S	S	*	*	S	Bend	trans	-119.2	5.4	-170.7	-87.4	-77.7	0	0	0	118.3
576	A	33.7	Very low	35.8	Very low	76 Å²	76	135 Å²	135	63%	0.628	69%	0.69	S	S	*	*	S	Bend	trans	-146.8	127.4	175.5	0	0	0	0	0	114.8
577	L	31	Very low	35.4	Very low	162 Å²	162	136.2 Å²	136.2	85%	0.848	70%	0.696	S	S	*	*			trans	92.7	78.7	158.3	-56.2	163.6	0	0	0	117.1
578	T	34.1	Very low	35.9	Very low	132 Å²	132	133.1 Å²	133.1	81%	0.81	69%	0.689	S	S	*	*			trans	-36.4	137.5	134.5	40.5	0	0	0	0	112.2
579	R	33.6	Very low	36.6	Very low	240 Å²	240	130.1 Å²	130.1	91%	0.906	68%	0.675	S	S	*	*			trans	87.6	70.8	172.2	-52.4	-177.8	176.9	-169.5	-0.6	118
580	R	31.6	Very low	37.1	Very low	228 Å²	228	127.9 Å²	127.9	86%	0.86	67%	0.668	S	S	*	*	S	Bend	trans	-179.5	153.3	130.1	-100.4	169.8	-173.9	-178.4	2.9	110.1	V582	R580-V582 PolarHBondContact O-N 2.93Å
581	P	35.3	Very low	38.4	Very low	110 Å²	110	128 Å²	128	71%	0.714	66%	0.662	S	S	*	*			trans	-73	102.3	-162.5	28.8	-32.6	0	0	0	112.1	A583	P581-A583 PolarHBondContact O-N 3.03Å; P581-A583 VanDerWaalsContact O-N 3.16Å
582	V	39.6	Very low	39.7	Very low	87 Å²	87	124.4 Å²	124.4	53%	0.527	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.3	-15.3	178.3	176.8	0	0	0	0	113.3	R580 F584 N585 R586	R580-V582 PolarHBondContact O-N 2.93Å; V582-F584 PolarHBondContact O-N 3.49Å; V582-N585 PolarHBondContact O-N 3.15Å; V582-R586 HydrophobicContact CG1-CG 4.07Å; V582-R586 PolarHBondContact O-N 2.87Å; V582-R586 VanDerWaalsContact O-N 3.14Å
583	A	36.5	Very low	41.4	Very low	64 Å²	64	121 Å²	121	53%	0.529	62%	0.621	S	S	.	*	H	α-helix	trans	-60.6	-38.4	-176.2	0	0	0	0	0	113.9	P581 R586 L587	P581-A583 PolarHBondContact O-N 3.03Å; P581-A583 VanDerWaalsContact O-N 3.16Å; A583-R586 PolarHBondContact O-N 2.87Å; A583-L587 PolarHBondContact O-N 3.09Å
584	F	32	Very low	43.3	Very low	178 Å²	178	119.9 Å²	119.9	78%	0.781	61%	0.613	S	S	*	*	H	α-helix	trans	-71.6	-31.7	179.7	-110.5	-85.3	0	0	0	113	V582 S588	V582-F584 PolarHBondContact O-N 3.49Å; F584-S588 PolarHBondContact O-N 3.3Å; F584-S588 PolarHBondContact O-OG 3.11Å
585	N	41.5	Very low	45.3	Very low	117 Å²	117	113.3 Å²	113.3	63%	0.626	58%	0.584	S	S	*	*	H	α-helix	trans	-74.6	-33	175.7	-81.1	-1.6	0	0	0	111.9	V582 S588 T589	V582-N585 PolarHBondContact O-N 3.15Å; N585-S588 WeakPolarHBondContact CA-OG 3.17Å; N585-S588 PolarHBondContact O-OG 2.92Å; N585-S588 VanDerWaalsContact O-OG 3.1Å; N585-T589 WeakPolarHBondContact O-CB 3.45Å; N585-T589 VanDerWaalsContact O-CG2 3.26Å; N585-T589 WeakPolarHBondContact O-CG2 3.36Å; N585-T589 PolarHBondContact O-N 2.88Å; N585-T589 PolarHBondContact O-OG1 2.87Å
586	R	35	Very low	47.7	Very low	184 Å²	184	104.5 Å²	104.5	69%	0.694	55%	0.545	S	S	*	.	H	α-helix	trans	-68.6	-43.4	176.6	-74.5	-174.9	179.5	-178.1	0	112.8	V582 A583 T589 S590	V582-R586 HydrophobicContact CG1-CG 4.07Å; V582-R586 PolarHBondContact O-N 2.87Å; V582-R586 VanDerWaalsContact O-N 3.14Å; A583-R586 PolarHBondContact O-N 2.87Å; R586-T589 WeakPolarHBondContact CA-OG1 3.34Å; R586-T589 PolarHBondContact O-N 3.46Å; R586-T589 PolarHBondContact O-OG1 2.9Å; R586-S590 PolarHBondContact O-N 3.28Å; R586-S590 PolarHBondContact O-OG 3.12Å
587	L	34	Very low	50	Low	113 Å²	113	102.3 Å²	102.3	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-68	-35.6	178.5	-74.2	163.8	0	0	0	112.8	A583 S590 N591	A583-L587 PolarHBondContact O-N 3.09Å; L587-S590 PolarHBondContact O-OG 3.48Å; L587-S590 VanDerWaalsContact O-OG 3.08Å; L587-N591 PolarHBondContact O-N 3.38Å
588	S	49.3	Very low	52.5	Low	63 Å²	63	96.4 Å²	96.4	44%	0.441	50%	0.496	S	S	.	.	H	α-helix	trans	-73.5	-32.8	175.9	52	0	0	0	0	112.7	F584 N585 R592	F584-S588 PolarHBondContact O-N 3.3Å; F584-S588 PolarHBondContact O-OG 3.11Å; N585-S588 WeakPolarHBondContact CA-OG 3.17Å; N585-S588 PolarHBondContact O-OG 2.92Å; N585-S588 VanDerWaalsContact O-OG 3.1Å; S588-R592 WeakPolarHBondContact O-CB 3.42Å; S588-R592 PolarHBondContact O-N 2.91Å; S588-R592 VanDerWaalsContact O-N 3.1Å
589	T	51.6	Low	55	Low	49 Å²	49	90.4 Å²	90.4	30%	0.301	46%	0.459	S	S	.	.	H	α-helix	trans	-75	-38.5	176.4	45.8	0	0	0	0	112.9	N585 R586 R592 I593	N585-T589 WeakPolarHBondContact O-CB 3.45Å; N585-T589 VanDerWaalsContact O-CG2 3.26Å; N585-T589 WeakPolarHBondContact O-CG2 3.36Å; N585-T589 PolarHBondContact O-N 2.88Å; N585-T589 PolarHBondContact O-OG1 2.87Å; R586-T589 WeakPolarHBondContact CA-OG1 3.34Å; R586-T589 PolarHBondContact O-N 3.46Å; R586-T589 PolarHBondContact O-OG1 2.9Å; T589-R592 WeakPolarHBondContact O-CB 3.26Å; T589-R592 PolarHBondContact O-N 3.38Å; T589-I593 WeakPolarHBondContact O-CG1 3.4Å; T589-I593 PolarHBondContact O-N 2.9Å; T589-I593 VanDerWaalsContact O-N 3.07Å
590	S	51.9	Low	57.6	Low	59 Å²	59	79 Å²	79	41%	0.413	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-46.1	175	61.8	0	0	0	0	111.7	R586 L587 R592 I593 S594	R586-S590 PolarHBondContact O-N 3.28Å; R586-S590 PolarHBondContact O-OG 3.12Å; L587-S590 PolarHBondContact O-OG 3.48Å; L587-S590 VanDerWaalsContact O-OG 3.08Å; S590-R592 VanDerWaalsContact C-N 3.29Å; S590-R592 PolarHBondContact O-N 3.07Å; S590-I593 PolarHBondContact O-N 3.38Å; S590-S594 PolarHBondContact O-N 3.45Å; S590-S594 VanDerWaalsContact O-N 3.11Å; S590-S594 PolarHBondContact O-OG 3.05Å
591	N	63.3	Low	60.3	Low	94 Å²	94	68.8 Å²	68.8	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-64.1	-36.4	176.8	-71.5	2.8	0	0	0	111.3	L587 S594 D595	L587-N591 PolarHBondContact O-N 3.38Å; N591-S594 WeakPolarHBondContact CA-OG 3.28Å; N591-S594 PolarHBondContact O-N 3.35Å; N591-S594 PolarHBondContact O-OG 2.83Å; N591-D595 VanDerWaalsContact O-CB 3.25Å; N591-D595 WeakPolarHBondContact O-CB 3.45Å; N591-D595 PolarHBondContact O-N 2.9Å; N591-D595 VanDerWaalsContact O-OD1 3.1Å
592	R	65.1	Low	62.8	Low	41 Å²	41	64.7 Å²	64.7	16%	0.155	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-45.4	176.4	179.7	-168.2	173	169.9	2	112.6	P510 S565 S588 T589 S590 D595 F596	P510-R592 VanDerWaalsContact CB-CD 3.46Å; P510-R592 HydrophobicContact CB-CG 3.94Å; S565-R592 PolarHBondContact OG-NH1 3.4Å; S565-R592 PolarHBondContact OG-NH2 3.35Å; S565-R592 VanDerWaalsContact OG-NH2 3.14Å; S588-R592 WeakPolarHBondContact O-CB 3.42Å; S588-R592 PolarHBondContact O-N 2.91Å; S588-R592 VanDerWaalsContact O-N 3.1Å; T589-R592 WeakPolarHBondContact O-CB 3.26Å; T589-R592 PolarHBondContact O-N 3.38Å; S590-R592 VanDerWaalsContact C-N 3.29Å; S590-R592 PolarHBondContact O-N 3.07Å; R592-D595 PolarHBondContact O-N 3.29Å; R592-F596 WeakPolarHBondContact O-CB 3.41Å; R592-F596 PolarHBondContact O-N 2.88Å
593	I	69.9	Low	65.3	Low	80 Å²	80	60.6 Å²	60.6	41%	0.41	33%	0.325	S	S	.	.	H	α-helix	trans	-67.8	-42.2	-178.7	-65.7	167.9	0	0	0	110	N566 T589 S590 D595 F596 T597	N566-I593 WeakPolarHBondContact OD1-CD1 3.44Å; T589-I593 WeakPolarHBondContact O-CG1 3.4Å; T589-I593 PolarHBondContact O-N 2.9Å; T589-I593 VanDerWaalsContact O-N 3.07Å; S590-I593 PolarHBondContact O-N 3.38Å; I593-D595 VanDerWaalsContact C-N 3.3Å; I593-D595 PolarHBondContact O-N 2.89Å; I593-F596 PolarHBondContact O-N 2.87Å; I593-T597 VanDerWaalsContact O-CB 3.32Å; I593-T597 WeakPolarHBondContact O-CB 3.38Å; I593-T597 PolarHBondContact O-N 3.17Å; I593-T597 PolarHBondContact O-OG1 3.22Å
594	S	73	Confident	67.8	Low	60 Å²	60	57.6 Å²	57.6	42%	0.42	30%	0.3	S	S	.	.	H	α-helix	trans	-62.2	-39.7	174.8	59.2	0	0	0	0	111.7	S590 N591 S598	S590-S594 PolarHBondContact O-N 3.45Å; S590-S594 VanDerWaalsContact O-N 3.11Å; S590-S594 PolarHBondContact O-OG 3.05Å; N591-S594 WeakPolarHBondContact CA-OG 3.28Å; N591-S594 PolarHBondContact O-N 3.35Å; N591-S594 PolarHBondContact O-OG 2.83Å; S594-S598 WeakPolarHBondContact O-CB 3.37Å; S594-S598 PolarHBondContact O-N 2.78Å
595	D	76.5	Confident	70.5	Confident	43 Å²	43	50.6 Å²	50.6	23%	0.23	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-46.3	179.5	-69.4	-1.8	0	0	0	111.2	P393 N591 R592 I593 T597 S598 I599	P393-D595 HydrophobicContact CB-CB 4.13Å; P393-D595 HydrophobicContact CG-CB 3.75Å; P393-D595 VanDerWaalsContact CG-OD1 3.31Å; P393-D595 WeakPolarHBondContact CG-OD1 3.49Å; N591-D595 VanDerWaalsContact O-CB 3.25Å; N591-D595 WeakPolarHBondContact O-CB 3.45Å; N591-D595 PolarHBondContact O-N 2.9Å; N591-D595 VanDerWaalsContact O-OD1 3.1Å; R592-D595 PolarHBondContact O-N 3.29Å; I593-D595 VanDerWaalsContact C-N 3.3Å; I593-D595 PolarHBondContact O-N 2.89Å; D595-T597 VanDerWaalsContact C-N 3.35Å; D595-T597 PolarHBondContact O-N 3.4Å; D595-S598 PolarHBondContact O-N 3.23Å; D595-I599 WeakPolarHBondContact O-CB 3.25Å; D595-I599 WeakPolarHBondContact O-CD1 3.25Å; D595-I599 VanDerWaalsContact O-CG1 3.24Å; D595-I599 WeakPolarHBondContact O-CG1 3.29Å; D595-I599 PolarHBondContact O-N 2.89Å
596	F	83	Confident	72.6	Confident	15 Å²	15	45.6 Å²	45.6	7%	0.066	25%	0.245	C	C	.	.	H	α-helix	trans	-59.9	-44.6	175.6	171.3	-106.4	0	0	0	112.1	L517 R559 L562 R592 I593 S600 I638	L517-F596 HydrophobicContact CD2-CD2 3.76Å; L517-F596 HydrophobicContact CD2-CE2 3.62Å; R559-F596 HydrophobicContact CB-CE2 4.49Å; R559-F596 HydrophobicContact CB-CZ 4.48Å; R559-F596 HydrophobicContact CG-CE2 4.19Å; R559-F596 HydrophobicContact CG-CZ 4.42Å; L562-F596 HydrophobicContact CB-CD2 4Å; L562-F596 HydrophobicContact CB-CE2 4.05Å; L562-F596 HydrophobicContact CD1-CD2 3.99Å; L562-F596 HydrophobicContact CD1-CE2 4.25Å; R592-F596 WeakPolarHBondContact O-CB 3.41Å; R592-F596 PolarHBondContact O-N 2.88Å; I593-F596 PolarHBondContact O-N 2.87Å; F596-S600 WeakPolarHBondContact O-CB 3.41Å; F596-S600 PolarHBondContact O-N 3.07Å; F596-S600 PolarHBondContact O-OG 2.83Å; F596-I638 HydrophobicContact CE1-CB 4.48Å; F596-I638 HydrophobicContact CE1-CG1 4.02Å; F596-I638 HydrophobicContact CZ-CG1 3.89Å
597	T	82.5	Confident	75.1	Confident	30 Å²	30	36.9 Å²	36.9	18%	0.184	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-46	177.2	-51	0	0	0	0	110.2	I593 D595 I599 S600 I601 P641	I593-T597 VanDerWaalsContact O-CB 3.32Å; I593-T597 WeakPolarHBondContact O-CB 3.38Å; I593-T597 PolarHBondContact O-N 3.17Å; I593-T597 PolarHBondContact O-OG1 3.22Å; D595-T597 VanDerWaalsContact C-N 3.35Å; D595-T597 PolarHBondContact O-N 3.4Å; T597-I599 PolarHBondContact O-N 3.45Å; T597-S600 PolarHBondContact O-N 3.43Å; T597-I601 HydrophobicContact CG2-CD1 3.87Å; T597-I601 HydrophobicContact CG2-CG1 4.4Å; T597-I601 VanDerWaalsContact O-CG1 3.24Å; T597-I601 WeakPolarHBondContact O-CG1 3.25Å; T597-I601 PolarHBondContact O-N 3.4Å; T597-P641 HydrophobicContact CG2-CB 3.73Å; T597-P641 HydrophobicContact CG2-CG 4.23Å
598	S	83.8	Confident	77.5	Confident	37 Å²	37	31.9 Å²	31.9	26%	0.259	19%	0.186	S	C	.	.	H	α-helix	trans	-61.4	-43.5	178.3	-179.6	0	0	0	0	112.4	S594 D595 S600 I601 Q602	S594-S598 WeakPolarHBondContact O-CB 3.37Å; S594-S598 PolarHBondContact O-N 2.78Å; D595-S598 PolarHBondContact O-N 3.23Å; S598-S600 VanDerWaalsContact C-N 3.31Å; S598-I601 PolarHBondContact O-N 3.02Å; S598-Q602 VanDerWaalsContact O-CB 3.3Å; S598-Q602 WeakPolarHBondContact O-CB 3.38Å; S598-Q602 PolarHBondContact O-N 3.41Å
599	I	86.2	Confident	78.7	Confident	6 Å²	6	31 Å²	31	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-43.6	177	-73.5	161.6	0	0	0	109.8	P393 C514 Q518 Q521 D595 T597 Q602 F603	P393-I599 HydrophobicContact CB-CD1 4.27Å; P393-I599 HydrophobicContact CB-CG1 3.86Å; P393-I599 WeakPolarHBondContact O-CG1 3.47Å; C514-I599 HydrophobicContact CB-CD1 3.64Å; Q518-I599 HydrophobicContact CB-CD1 4.46Å; Q518-I599 HydrophobicContact CB-CG2 3.87Å; Q518-I599 HydrophobicContact CG-CG2 4.18Å; Q521-I599 VanDerWaalsContact OE1-CG2 3.27Å; D595-I599 WeakPolarHBondContact O-CB 3.25Å; D595-I599 WeakPolarHBondContact O-CD1 3.25Å; D595-I599 VanDerWaalsContact O-CG1 3.24Å; D595-I599 WeakPolarHBondContact O-CG1 3.29Å; D595-I599 PolarHBondContact O-N 2.89Å; T597-I599 PolarHBondContact O-N 3.45Å; I599-Q602 PolarHBondContact O-N 3.17Å; I599-F603 WeakPolarHBondContact O-CB 3.31Å; I599-F603 PolarHBondContact O-N 3.16Å
600	S	88.5	Confident	79	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.8	-43.8	179.6	-60.6	0	0	0	0	112	F596 T597 S598 F603 L604 Y634 I638	F596-S600 WeakPolarHBondContact O-CB 3.41Å; F596-S600 PolarHBondContact O-N 3.07Å; F596-S600 PolarHBondContact O-OG 2.83Å; T597-S600 PolarHBondContact O-N 3.43Å; S598-S600 VanDerWaalsContact C-N 3.31Å; S600-F603 WeakPolarHBondContact O-CB 3.48Å; S600-F603 PolarHBondContact O-N 3.38Å; S600-L604 PolarHBondContact O-N 3.06Å; S600-Y634 PolarHBondContact O-OH 3.23Å; S600-I638 VanDerWaalsContact CB-CD1 3.44Å
601	I	87.3	Confident	79.1	Confident	14 Å²	14	32.1 Å²	32.1	7%	0.072	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-46.9	173.9	-65.5	167.6	0	0	0	110.1	T597 S598 F603 L604 V605 P641 D643 K645 W646	T597-I601 HydrophobicContact CG2-CD1 3.87Å; T597-I601 HydrophobicContact CG2-CG1 4.4Å; T597-I601 VanDerWaalsContact O-CG1 3.24Å; T597-I601 WeakPolarHBondContact O-CG1 3.25Å; T597-I601 PolarHBondContact O-N 3.4Å; S598-I601 PolarHBondContact O-N 3.02Å; I601-F603 VanDerWaalsContact C-N 3.28Å; I601-F603 PolarHBondContact O-N 3.36Å; I601-L604 PolarHBondContact O-N 3.08Å; I601-L604 VanDerWaalsContact O-N 3.16Å; I601-V605 HydrophobicContact CG2-CG2 4.35Å; I601-V605 WeakPolarHBondContact O-CG2 3.12Å; I601-V605 PolarHBondContact O-N 2.63Å; I601-P641 HydrophobicContact CD1-CB 4.37Å; I601-P641 HydrophobicContact CD1-CG 4.34Å; I601-P641 HydrophobicContact CG1-CG 4.32Å; I601-D643 HydrophobicContact CD1-CB 3.61Å; I601-K645 HydrophobicContact CG2-CB 4.25Å; I601-W646 HydrophobicContact CD1-CB 4.43Å; I601-W646 HydrophobicContact CG1-CB 4.14Å; I601-W646 HydrophobicContact CG1-CE3 3.91Å; I601-W646 HydrophobicContact CG2-CB 4.46Å
602	Q	88.8	Confident	78.1	Confident	24 Å²	24	35.2 Å²	35.2	11%	0.112	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-35.1	-179.3	-170.7	56.7	50.2	0	0	112.2	S394 M395 S598 I599 V605 D606	S394-Q602 PolarHBondContact O-OE1 3.18Å; M395-Q602 VanDerWaalsContact O-CG 3.28Å; M395-Q602 WeakPolarHBondContact O-CG 3.25Å; S598-Q602 VanDerWaalsContact O-CB 3.3Å; S598-Q602 WeakPolarHBondContact O-CB 3.38Å; S598-Q602 PolarHBondContact O-N 3.41Å; I599-Q602 PolarHBondContact O-N 3.17Å; Q602-V605 WeakPolarHBondContact O-CB 3.29Å; Q602-V605 PolarHBondContact O-N 3.4Å; Q602-D606 PolarHBondContact NE2-OD1 3.42Å; Q602-D606 WeakPolarHBondContact O-CB 3.3Å; Q602-D606 PolarHBondContact O-N 3.4Å
603	F	91.4	Very high	77.1	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-45	172.6	173.6	-122.2	0	0	0	112.5	Q521 L524 V525 R559 I599 S600 I601 V605 D606 L607 C629 L630 Y634	Q521-F603 HydrophobicContact CB-CB 4.34Å; Q521-F603 HydrophobicContact CB-CD2 3.45Å; Q521-F603 VanDerWaalsContact CB-CD2 3.45Å; Q521-F603 HydrophobicContact CB-CE2 3.74Å; Q521-F603 HydrophobicContact CB-CG 3.87Å; Q521-F603 HydrophobicContact CB-CZ 4.39Å; Q521-F603 HydrophobicContact CG-CB 4.3Å; Q521-F603 HydrophobicContact CG-CD1 3.98Å; Q521-F603 HydrophobicContact CG-CD2 3.77Å; Q521-F603 HydrophobicContact CG-CE1 4.16Å; Q521-F603 HydrophobicContact CG-CE2 3.95Å; Q521-F603 HydrophobicContact CG-CG 3.74Å; Q521-F603 HydrophobicContact CG-CZ 4.12Å; Q521-F603 WeakPolarHBondContact O-CE2 3.48Å; L524-F603 HydrophobicContact CB-CE2 4.13Å; L524-F603 HydrophobicContact CB-CZ 4.24Å; L524-F603 HydrophobicContact CD1-CZ 4.04Å; V525-F603 HydrophobicContact CG2-CD2 3.89Å; V525-F603 HydrophobicContact CG2-CE2 3.92Å; R559-F603 VanDerWaalsContact NH2-CE1 3.28Å; I599-F603 WeakPolarHBondContact O-CB 3.31Å; I599-F603 PolarHBondContact O-N 3.16Å; S600-F603 WeakPolarHBondContact O-CB 3.48Å; S600-F603 PolarHBondContact O-N 3.38Å; I601-F603 VanDerWaalsContact C-N 3.28Å; I601-F603 PolarHBondContact O-N 3.36Å; F603-V605 VanDerWaalsContact C-N 3.32Å; F603-V605 PolarHBondContact O-N 2.8Å; F603-D606 PolarHBondContact O-N 2.84Å; F603-L607 HydrophobicContact CD1-CD1 4.25Å; F603-L607 HydrophobicContact CD2-CD1 4.23Å; F603-L607 HydrophobicContact CD2-CG 4.22Å; F603-L607 HydrophobicContact CE1-CD1 3.78Å; F603-L607 HydrophobicContact CE2-CD1 3.78Å; F603-L607 HydrophobicContact CE2-CD2 4.13Å; F603-L607 HydrophobicContact CE2-CG 3.9Å; F603-L607 HydrophobicContact CG-CD1 4.49Å; F603-L607 HydrophobicContact CZ-CD1 3.55Å; F603-L607 HydrophobicContact CZ-CD2 4.46Å; F603-L607 HydrophobicContact CZ-CG 4.2Å; F603-L607 WeakPolarHBondContact O-CG 3.12Å; F603-L607 PolarHBondContact O-N 3.45Å; F603-C629 HydrophobicContact CZ-CB 4.46Å; F603-L630 HydrophobicContact CD1-CD2 4.3Å; F603-L630 HydrophobicContact CE1-CD2 3.93Å; F603-Y634 AromaticContact CD1-CE2 3.93Å; F603-Y634 HydrophobicContact CD1-CE2 3.93Å; F603-Y634 HydrophobicContact CE1-CE2 4.35Å
604	L	89.5	Confident	75.8	Confident	1 Å²	1	38 Å²	38	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-41	175.4	-177.7	64.8	0	0	0	111.4	S600 I601 L608 L630 Y634 W646 C649 V650	S600-L604 PolarHBondContact O-N 3.06Å; I601-L604 PolarHBondContact O-N 3.08Å; I601-L604 VanDerWaalsContact O-N 3.16Å; L604-L608 HydrophobicContact CD1-CD1 4.08Å; L604-L608 HydrophobicContact CG-CD1 4.12Å; L604-L608 WeakPolarHBondContact O-CG 3.32Å; L604-L608 PolarHBondContact O-N 3.46Å; L604-L630 HydrophobicContact CD1-CD1 4.07Å; L604-L630 HydrophobicContact CD1-CD2 3.96Å; L604-Y634 WeakPolarHBondContact CB-OH 3.46Å; L604-W646 HydrophobicContact CD2-CD2 4.2Å; L604-W646 HydrophobicContact CD2-CE3 3.73Å; L604-W646 HydrophobicContact CD2-CZ3 3.97Å; L604-C649 HydrophobicContact CD2-CB 3.5Å; L604-C649 HydrophobicContact CG-CB 3.71Å; L604-V650 HydrophobicContact CD2-CG2 3.96Å
605	V	88.1	Confident	74.4	Confident	31 Å²	31	44.5 Å²	44.5	19%	0.188	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-52	174.8	171.2	0	0	0	0	110	I601 Q602 F603 L607 L608 V609 K645	I601-V605 HydrophobicContact CG2-CG2 4.35Å; I601-V605 WeakPolarHBondContact O-CG2 3.12Å; I601-V605 PolarHBondContact O-N 2.63Å; Q602-V605 WeakPolarHBondContact O-CB 3.29Å; Q602-V605 PolarHBondContact O-N 3.4Å; F603-V605 VanDerWaalsContact C-N 3.32Å; F603-V605 PolarHBondContact O-N 2.8Å; V605-L607 VanDerWaalsContact C-N 3.31Å; V605-L607 PolarHBondContact O-N 3.33Å; V605-L608 CarbonylContact O-C 3.59Å; V605-L608 PolarHBondContact O-N 3.02Å; V605-V609 HydrophobicContact CG1-CG2 4.22Å; V605-V609 VanDerWaalsContact O-CG2 3.32Å; V605-V609 WeakPolarHBondContact O-CG2 3.2Å; V605-V609 PolarHBondContact O-N 3.3Å; V605-K645 HydrophobicContact CG2-CB 4.49Å
606	D	86.9	Confident	73.1	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.064	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-37.7	-176.7	-72.9	-18.9	0	0	0	112.3	S396 F397 V525 Q602 F603 L608	S396-D606 WeakPolarHBondContact CA-OD2 3.35Å; S396-D606 VanDerWaalsContact CB-OD1 3.22Å; S396-D606 WeakPolarHBondContact CB-OD1 3.47Å; F397-D606 HydrophobicContact CB-CB 4.39Å; F397-D606 PolarHBondContact N-OD2 3.1Å; V525-D606 HydrophobicContact CG1-CB 4.34Å; V525-D606 HydrophobicContact CG2-CB 3.95Å; Q602-D606 PolarHBondContact NE2-OD1 3.42Å; Q602-D606 WeakPolarHBondContact O-CB 3.3Å; Q602-D606 PolarHBondContact O-N 3.4Å; F603-D606 PolarHBondContact O-N 2.84Å; D606-L608 VanDerWaalsContact C-N 3.27Å; D606-L608 PolarHBondContact O-N 3.34Å
607	L	86.6	Confident	72.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-29.4	173.6	-72.6	173.7	0	0	0	113.3	V525 E528 F603 V605 R622 I626 C629 L630	V525-L607 HydrophobicContact CG2-CD2 4.06Å; V525-L607 HydrophobicContact CG2-CG 4.31Å; E528-L607 HydrophobicContact CB-CD2 4.02Å; E528-L607 HydrophobicContact CG-CD2 4.09Å; F603-L607 HydrophobicContact CD1-CD1 4.25Å; F603-L607 HydrophobicContact CD2-CD1 4.23Å; F603-L607 HydrophobicContact CD2-CG 4.22Å; F603-L607 HydrophobicContact CE1-CD1 3.78Å; F603-L607 HydrophobicContact CE2-CD1 3.78Å; F603-L607 HydrophobicContact CE2-CD2 4.13Å; F603-L607 HydrophobicContact CE2-CG 3.9Å; F603-L607 HydrophobicContact CG-CD1 4.49Å; F603-L607 HydrophobicContact CZ-CD1 3.55Å; F603-L607 HydrophobicContact CZ-CD2 4.46Å; F603-L607 HydrophobicContact CZ-CG 4.2Å; F603-L607 WeakPolarHBondContact O-CG 3.12Å; F603-L607 PolarHBondContact O-N 3.45Å; V605-L607 VanDerWaalsContact C-N 3.31Å; V605-L607 PolarHBondContact O-N 3.33Å; L607-R622 PolarHBondContact O-NH2 3.27Å; L607-I626 HydrophobicContact CB-CG2 4.47Å; L607-I626 HydrophobicContact CD1-CG2 4.43Å; L607-C629 HydrophobicContact CD1-CB 4.22Å; L607-C629 HydrophobicContact CD2-CB 4.08Å; L607-L630 HydrophobicContact CD1-CD2 3.69Å; L607-L630 HydrophobicContact CD1-CG 4.19Å
608	L	83.9	Confident	71.5	Confident	9 Å²	9	49.6 Å²	49.6	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-97.6	-11.7	-176.6	-71.6	169.3	0	0	0	113.7	L604 V605 D606 P610 L618 I626 C649 L653	L604-L608 HydrophobicContact CD1-CD1 4.08Å; L604-L608 HydrophobicContact CG-CD1 4.12Å; L604-L608 WeakPolarHBondContact O-CG 3.32Å; L604-L608 PolarHBondContact O-N 3.46Å; V605-L608 CarbonylContact O-C 3.59Å; V605-L608 PolarHBondContact O-N 3.02Å; D606-L608 VanDerWaalsContact C-N 3.27Å; D606-L608 PolarHBondContact O-N 3.34Å; L608-P610 WeakPolarHBondContact O-CD 3.3Å; L608-P610 VanDerWaalsContact O-N 3.13Å; L608-L618 HydrophobicContact CD2-CD1 3.68Å; L608-L618 HydrophobicContact CD2-CD2 4.42Å; L608-I626 HydrophobicContact CD2-CD1 4.16Å; L608-C649 HydrophobicContact CD1-CB 3.46Å; L608-C649 VanDerWaalsContact CD1-CB 3.46Å; L608-C649 WeakPolarHBondContact CD1-O 3.39Å; L608-L653 HydrophobicContact CD2-CB 4.47Å; L608-L653 HydrophobicContact CD2-CD1 4.12Å
609	V	75.2	Confident	70.8	Confident	45 Å²	45	50.9 Å²	50.9	27%	0.273	29%	0.292	S	S	.	.			trans	-53.7	123.1	179.5	173.1	0	0	0	0	109	V605 R622	V605-V609 HydrophobicContact CG1-CG2 4.22Å; V605-V609 VanDerWaalsContact O-CG2 3.32Å; V605-V609 WeakPolarHBondContact O-CG2 3.2Å; V605-V609 PolarHBondContact O-N 3.3Å; V609-R622 PolarHBondContact O-NH2 3.41Å
610	P	58.7	Low	70.1	Confident	60 Å²	60	53.4 Å²	53.4	39%	0.39	31%	0.31	S	S	.	.			trans	-69.4	138.1	175	24.6	-30.1	0	0	0	110	L608 N612 S613	L608-P610 WeakPolarHBondContact O-CD 3.3Å; L608-P610 VanDerWaalsContact O-N 3.13Å; P610-N612 PolarHBondContact O-N 3.43Å; P610-S613 WeakPolarHBondContact CB-O 3.36Å
611	N	52.7	Low	69.4	Low	70 Å²	70	54.4 Å²	54.4	37%	0.374	32%	0.32	S	S	.	.	S	Bend	trans	-67.4	82.8	165.4	-74.2	-16.7	0	0	0	108.3	R398 S613	R398-N611 PolarHBondContact NH2-OD1 2.89Å; N611-S613 PolarHBondContact O-N 3Å
612	N	43.5	Very low	69	Low	160 Å²	160	55 Å²	55	86%	0.856	32%	0.322	S	S	*	.	S	Bend	trans	65	12.2	168.9	-64.5	-17.7	0	0	0	119.2	P610	P610-N612 PolarHBondContact O-N 3.43Å
613	S	43.5	Very low	68.7	Low	44 Å²	44	53.9 Å²	53.9	31%	0.308	32%	0.316	S	S	.	.			trans	-123.5	123.7	-179.9	60.5	0	0	0	0	113.1	P610 N611 H615 V616	P610-S613 WeakPolarHBondContact CB-O 3.36Å; N611-S613 PolarHBondContact O-N 3Å; S613-H615 PolarHBondContact O-N 3.45Å; S613-V616 WeakPolarHBondContact OG-CG2 3.31Å
614	T	41.7	Very low	68.2	Low	134 Å²	134	55 Å²	55	82%	0.822	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	118.7	169.5	45.2	0	0	0	0	109.7
615	H	43.4	Very low	67.9	Low	197 Å²	197	55.1 Å²	55.1	91%	0.912	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	45.5	170.1	-71	-80.6	0	0	0	118.1	S613	S613-H615 PolarHBondContact O-N 3.45Å
616	V	51.2	Low	67.8	Low	90 Å²	90	53.6 Å²	53.6	55%	0.545	31%	0.313	S	S	.	.			trans	-92.9	119.4	170.1	179.4	0	0	0	0	110	S613 L618	S613-V616 WeakPolarHBondContact OG-CG2 3.31Å; V616-L618 PolarHBondContact O-N 3.27Å
617	S	61.5	Low	67.8	Low	89 Å²	89	53.4 Å²	53.4	62%	0.622	31%	0.312	S	S	*	.			trans	-42.2	129	168.6	51	0	0	0	0	111.3	P619	S617-P619 WeakPolarHBondContact O-CD 3.39Å
618	L	68.7	Low	67.8	Low	17 Å²	17	55.1 Å²	55.1	9%	0.089	32%	0.32	C	S	.	.			trans	-66.1	118.6	175.3	-70.8	149.3	0	0	0	108.9	L608 V616 R622 I626 A656	L608-L618 HydrophobicContact CD2-CD1 3.68Å; L608-L618 HydrophobicContact CD2-CD2 4.42Å; V616-L618 PolarHBondContact O-N 3.27Å; L618-R622 HydrophobicContact CD2-CG 3.92Å; L618-I626 HydrophobicContact CD2-CD1 3.86Å; L618-A656 HydrophobicContact CB-CB 3.75Å; L618-A656 HydrophobicContact CD1-CB 3.62Å; L618-A656 HydrophobicContact CG-CB 4.23Å
619	P	70.8	Confident	68	Low	64 Å²	64	54.7 Å²	54.7	42%	0.416	32%	0.317	S	S	.	.			trans	-64.8	152.5	177	23.6	-30.2	0	0	0	111.2	S617 G621 R622 T623	S617-P619 WeakPolarHBondContact O-CD 3.39Å; P619-G621 VanDerWaalsContact C-N 3.32Å; P619-G621 PolarHBondContact O-N 3.27Å; P619-R622 HydrophobicContact CG-CB 3.87Å; P619-R622 WeakPolarHBondContact O-CA 3.48Å; P619-R622 WeakPolarHBondContact O-CB 3.46Å; P619-R622 PolarHBondContact O-N 3.42Å; P619-T623 PolarHBondContact O-N 3.22Å; P619-T623 PolarHBondContact O-OG1 3.03Å
620	S	71.2	Confident	68.6	Low	58 Å²	58	52.5 Å²	52.5	41%	0.406	30%	0.304	S	S	.	.	H	α-helix	trans	-51.9	-45.2	-173.2	60.2	0	0	0	0	114	R622 T623 F624	S620-R622 VanDerWaalsContact C-N 3.3Å; S620-R622 PolarHBondContact O-N 2.92Å; S620-T623 PolarHBondContact O-N 2.88Å; S620-F624 PolarHBondContact O-N 3.15Å
621	G	73.8	Confident	69.8	Low	21 Å²	21	50.4 Å²	50.4	22%	0.216	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-35.3	178.2	0	0	0	0	0	113.2	P619 L625	P619-G621 VanDerWaalsContact C-N 3.32Å; P619-G621 PolarHBondContact O-N 3.27Å; G621-L625 PolarHBondContact O-N 3.34Å; G621-L625 VanDerWaalsContact O-N 3.08Å
622	R	78.6	Confident	71.1	Confident	27 Å²	27	50.9 Å²	50.9	10%	0.102	30%	0.302	C	S	.	.	H	α-helix	trans	-69.8	-45.7	175.1	-180	170	-172.2	-155.7	0.5	111	E528 C532 L607 V609 L618 P619 S620 F624 L625 I626	E528-R622 IonicContact OE1-CZ 2.79Å; E528-R622 IonicContact OE1-NE 2.64Å; E528-R622 PolarHBondContact OE1-NE 3.43Å; E528-R622 IonicContact OE1-NH2 2.84Å; E528-R622 PolarHBondContact OE1-NH2 2.97Å; C532-R622 WeakPolarHBondContact SG-CD 3.26Å; C532-R622 WeakPolarHBondContact SG-CG 3.22Å; L607-R622 PolarHBondContact O-NH2 3.27Å; V609-R622 PolarHBondContact O-NH2 3.41Å; L618-R622 HydrophobicContact CD2-CG 3.92Å; P619-R622 HydrophobicContact CG-CB 3.87Å; P619-R622 WeakPolarHBondContact O-CA 3.48Å; P619-R622 WeakPolarHBondContact O-CB 3.46Å; P619-R622 PolarHBondContact O-N 3.42Å; S620-R622 VanDerWaalsContact C-N 3.3Å; S620-R622 PolarHBondContact O-N 2.92Å; R622-F624 VanDerWaalsContact C-N 3.28Å; R622-F624 PolarHBondContact O-N 2.97Å; R622-L625 PolarHBondContact O-N 2.82Å; R622-I626 HydrophobicContact CG-CD1 3.87Å; R622-I626 HydrophobicContact CG-CG1 4.41Å; R622-I626 VanDerWaalsContact O-CG1 3.31Å; R622-I626 WeakPolarHBondContact O-CG1 3.46Å; R622-I626 PolarHBondContact O-N 2.82Å
623	T	81.1	Confident	72.9	Confident	0 Å²	0	44 Å²	44	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58.7	-42.1	176.2	-56.8	0	0	0	0	111.6	P619 S620 I626 I627 L653 V657 L660 V669	P619-T623 PolarHBondContact O-N 3.22Å; P619-T623 PolarHBondContact O-OG1 3.03Å; S620-T623 PolarHBondContact O-N 2.88Å; T623-I626 PolarHBondContact O-N 2.8Å; T623-I627 HydrophobicContact CG2-CD1 4.12Å; T623-I627 WeakPolarHBondContact O-CD1 3.24Å; T623-I627 WeakPolarHBondContact O-CG1 3.4Å; T623-I627 PolarHBondContact O-N 3.34Å; T623-I627 VanDerWaalsContact O-N 3.1Å; T623-L653 HydrophobicContact CG2-CD1 4.41Å; T623-V657 HydrophobicContact CG2-CG2 3.62Å; T623-L660 HydrophobicContact CG2-CD1 4.2Å; T623-V669 HydrophobicContact CG2-CG1 4.17Å
624	F	82.7	Confident	75	Confident	27 Å²	27	41.9 Å²	41.9	12%	0.118	25%	0.252	C	S	.	.	H	α-helix	trans	-60.1	-48.7	174.8	-178.1	-96.3	0	0	0	112	L541 L545 S620 R622 I626 I627 Q628 E668 V669	L541-F624 HydrophobicContact CD2-CD1 3.84Å; L541-F624 HydrophobicContact CD2-CE1 4.34Å; L545-F624 HydrophobicContact CD1-CE1 4.15Å; L545-F624 HydrophobicContact CD2-CE1 4.45Å; L545-F624 HydrophobicContact CD2-CZ 4.49Å; S620-F624 PolarHBondContact O-N 3.15Å; R622-F624 VanDerWaalsContact C-N 3.28Å; R622-F624 PolarHBondContact O-N 2.97Å; F624-I626 PolarHBondContact O-N 3.34Å; F624-I627 PolarHBondContact O-N 3.04Å; F624-Q628 HydrophobicContact CD1-CG 4.25Å; F624-Q628 HydrophobicContact CE1-CG 3.91Å; F624-Q628 HydrophobicContact CZ-CG 4.1Å; F624-Q628 WeakPolarHBondContact O-CG 3.16Å; F624-Q628 PolarHBondContact O-N 3.36Å; F624-Q628 VanDerWaalsContact O-N 3.07Å; F624-E668 HydrophobicContact CE2-CB 4.01Å; F624-E668 WeakPolarHBondContact CE2-OE2 3.45Å; F624-E668 WeakPolarHBondContact CZ-OE2 3.24Å; F624-V669 HydrophobicContact CB-CG2 4.27Å; F624-V669 HydrophobicContact CD2-CG2 3.96Å
625	L	82.1	Confident	77.1	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-41.9	179.7	-169.1	58	0	0	0	112.4	E528 L541 V548 G621 R622 I627 Q628 C629	E528-L625 HydrophobicContact CB-CD2 4.34Å; E528-L625 HydrophobicContact CG-CD2 4.32Å; L541-L625 HydrophobicContact CD1-CB 4.09Å; L541-L625 HydrophobicContact CD1-CD1 4.29Å; L541-L625 HydrophobicContact CD1-CD2 4.17Å; L541-L625 HydrophobicContact CD1-CG 4.43Å; V548-L625 HydrophobicContact CG2-CD1 4.33Å; G621-L625 PolarHBondContact O-N 3.34Å; G621-L625 VanDerWaalsContact O-N 3.08Å; R622-L625 PolarHBondContact O-N 2.82Å; L625-I627 VanDerWaalsContact C-N 3.32Å; L625-I627 PolarHBondContact O-N 2.94Å; L625-Q628 PolarHBondContact O-N 3.45Å; L625-C629 PolarHBondContact O-N 3.48Å; L625-C629 PolarHBondContact O-SG 3.32Å; L625-C629 VanDerWaalsContact O-SG 3.36Å
626	I	86	Confident	78.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.3	-45.7	176.1	-70.4	168.4	0	0	0	110.5	E528 L607 L608 L618 R622 T623 F624 Q628 C629 L630 L653	E528-I626 HydrophobicContact CG-CG1 4.13Å; L607-I626 HydrophobicContact CB-CG2 4.47Å; L607-I626 HydrophobicContact CD1-CG2 4.43Å; L608-I626 HydrophobicContact CD2-CD1 4.16Å; L618-I626 HydrophobicContact CD2-CD1 3.86Å; R622-I626 HydrophobicContact CG-CD1 3.87Å; R622-I626 HydrophobicContact CG-CG1 4.41Å; R622-I626 VanDerWaalsContact O-CG1 3.31Å; R622-I626 WeakPolarHBondContact O-CG1 3.46Å; R622-I626 PolarHBondContact O-N 2.82Å; T623-I626 PolarHBondContact O-N 2.8Å; F624-I626 PolarHBondContact O-N 3.34Å; I626-Q628 VanDerWaalsContact C-N 3.31Å; I626-Q628 PolarHBondContact O-N 2.82Å; I626-C629 WeakPolarHBondContact O-CB 3.25Å; I626-C629 PolarHBondContact O-N 2.8Å; I626-L630 HydrophobicContact CG2-CD1 4.22Å; I626-L630 HydrophobicContact CG2-CG 4.42Å; I626-L630 WeakPolarHBondContact O-CG 3.47Å; I626-L630 PolarHBondContact O-N 2.82Å; I626-L653 HydrophobicContact CG2-CD1 3.89Å
627	I	87	Confident	80	Confident	7 Å²	7	27.8 Å²	27.8	4%	0.036	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-42.6	178.8	-73.4	166	0	0	0	111.3	T623 F624 L625 L630 G631 V669 F672 F673	T623-I627 HydrophobicContact CG2-CD1 4.12Å; T623-I627 WeakPolarHBondContact O-CD1 3.24Å; T623-I627 WeakPolarHBondContact O-CG1 3.4Å; T623-I627 PolarHBondContact O-N 3.34Å; T623-I627 VanDerWaalsContact O-N 3.1Å; F624-I627 PolarHBondContact O-N 3.04Å; L625-I627 VanDerWaalsContact C-N 3.32Å; L625-I627 PolarHBondContact O-N 2.94Å; I627-L630 PolarHBondContact O-N 3.1Å; I627-G631 PolarHBondContact O-N 3.36Å; I627-V669 HydrophobicContact CD1-CB 3.84Å; I627-V669 HydrophobicContact CD1-CG1 3.43Å; I627-V669 VanDerWaalsContact CD1-CG1 3.43Å; I627-V669 HydrophobicContact CD1-CG2 3.88Å; I627-F672 HydrophobicContact CB-CD1 4.34Å; I627-F672 HydrophobicContact CB-CG 4.49Å; I627-F672 HydrophobicContact CD1-CD1 4.32Å; I627-F672 HydrophobicContact CG1-CD1 3.92Å; I627-F672 HydrophobicContact CG1-CE1 4.17Å; I627-F672 HydrophobicContact CG1-CG 4.49Å; I627-F672 HydrophobicContact CG2-CB 3.67Å; I627-F672 HydrophobicContact CG2-CD1 3.66Å; I627-F672 HydrophobicContact CG2-CD2 3.62Å; I627-F672 HydrophobicContact CG2-CE1 4.14Å; I627-F672 HydrophobicContact CG2-CE2 4.09Å; I627-F672 HydrophobicContact CG2-CG 3.37Å; I627-F672 HydrophobicContact CG2-CZ 4.33Å; I627-F673 HydrophobicContact CD1-CD2 4.46Å; I627-F673 HydrophobicContact CD1-CE2 3.85Å; I627-F673 HydrophobicContact CG1-CE2 4.34Å
628	Q	86.4	Confident	80.8	Confident	36 Å²	36	24 Å²	24	17%	0.168	15%	0.149	C	C	.	.	H	α-helix	trans	-63.3	-44.8	175.6	-64.9	-67.2	-9.8	0	0	110.6	L545 V548 N552 F624 L625 I626 L630 G631	L545-Q628 HydrophobicContact CD1-CB 3.89Å; L545-Q628 HydrophobicContact CD1-CG 3.44Å; L545-Q628 VanDerWaalsContact CD1-CG 3.44Å; V548-Q628 HydrophobicContact CG1-CB 4.1Å; N552-Q628 PolarHBondContact ND2-O 3.31Å; F624-Q628 HydrophobicContact CD1-CG 4.25Å; F624-Q628 HydrophobicContact CE1-CG 3.91Å; F624-Q628 HydrophobicContact CZ-CG 4.1Å; F624-Q628 WeakPolarHBondContact O-CG 3.16Å; F624-Q628 PolarHBondContact O-N 3.36Å; F624-Q628 VanDerWaalsContact O-N 3.07Å; L625-Q628 PolarHBondContact O-N 3.45Å; I626-Q628 VanDerWaalsContact C-N 3.31Å; I626-Q628 PolarHBondContact O-N 2.82Å; Q628-L630 VanDerWaalsContact C-N 3.33Å; Q628-L630 PolarHBondContact O-N 2.66Å; Q628-G631 PolarHBondContact O-N 3.18Å
629	C	88.1	Confident	81.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-33	175.2	-71.9	0	0	0	0	114	L524 N552 F603 L607 L625 I626	L524-C629 HydrophobicContact CB-CB 4.39Å; L524-C629 HydrophobicContact CD1-CB 4.41Å; L524-C629 WeakPolarHBondContact CD1-O 3.11Å; N552-C629 PolarHBondContact OD1-O 3.16Å; F603-C629 HydrophobicContact CZ-CB 4.46Å; L607-C629 HydrophobicContact CD1-CB 4.22Å; L607-C629 HydrophobicContact CD2-CB 4.08Å; L625-C629 PolarHBondContact O-N 3.48Å; L625-C629 PolarHBondContact O-SG 3.32Å; L625-C629 VanDerWaalsContact O-SG 3.36Å; I626-C629 WeakPolarHBondContact O-CB 3.25Å; I626-C629 PolarHBondContact O-N 2.8Å
630	L	88.2	Confident	81.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.7	-48.8	174.9	-67.8	176.8	0	0	0	110.6	R559 F603 L604 L607 I626 I627 Q628 Y634 F635 L653 F672	R559-L630 PolarHBondContact NH1-O 3.36Å; F603-L630 HydrophobicContact CD1-CD2 4.3Å; F603-L630 HydrophobicContact CE1-CD2 3.93Å; L604-L630 HydrophobicContact CD1-CD1 4.07Å; L604-L630 HydrophobicContact CD1-CD2 3.96Å; L607-L630 HydrophobicContact CD1-CD2 3.69Å; L607-L630 HydrophobicContact CD1-CG 4.19Å; I626-L630 HydrophobicContact CG2-CD1 4.22Å; I626-L630 HydrophobicContact CG2-CG 4.42Å; I626-L630 WeakPolarHBondContact O-CG 3.47Å; I626-L630 PolarHBondContact O-N 2.82Å; I627-L630 PolarHBondContact O-N 3.1Å; Q628-L630 VanDerWaalsContact C-N 3.33Å; Q628-L630 PolarHBondContact O-N 2.66Å; L630-Y634 HydrophobicContact CB-CD1 4.34Å; L630-Y634 HydrophobicContact CB-CG 4.24Å; L630-Y634 HydrophobicContact CD2-CD1 3.85Å; L630-Y634 HydrophobicContact CD2-CD2 4.33Å; L630-Y634 HydrophobicContact CD2-CE1 3.68Å; L630-Y634 HydrophobicContact CD2-CE2 4.15Å; L630-Y634 HydrophobicContact CD2-CG 4.16Å; L630-Y634 HydrophobicContact CG-CD1 4.46Å; L630-Y634 WeakPolarHBondContact O-CB 3.47Å; L630-F635 HydrophobicContact CD1-CE2 4.31Å; L630-L653 HydrophobicContact CD1-CD2 4.12Å; L630-F672 HydrophobicContact CB-CZ 4.12Å; L630-F672 HydrophobicContact CD1-CE1 4.5Å; L630-F672 HydrophobicContact CD1-CZ 4.39Å
631	G	84.3	Confident	81.9	Confident	15 Å²	15	22.4 Å²	22.4	16%	0.155	14%	0.138	C	C	.	.			trans	77.6	151.7	-174.4	0	0	0	0	0	112.9	I627 Q628 S633 Y634 F672	I627-G631 PolarHBondContact O-N 3.36Å; Q628-G631 PolarHBondContact O-N 3.18Å; G631-S633 PolarHBondContact O-N 2.87Å; G631-S633 VanDerWaalsContact O-N 3.11Å; G631-Y634 WeakPolarHBondContact O-CB 3.28Å; G631-Y634 PolarHBondContact O-N 3.24Å; G631-Y634 VanDerWaalsContact O-N 3.09Å; G631-F672 WeakPolarHBondContact O-CE2 3.35Å
632	S	79	Confident	82.2	Confident	80 Å²	80	25.2 Å²	25.2	56%	0.559	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.2	-172.9	56.2	0	0	0	0	114.4	S676	S632-S676 WeakPolarHBondContact O-CB 3.24Å; S632-S676 PolarHBondContact O-OG 2.87Å
633	S	81.1	Confident	82.4	Confident	15 Å²	15	27 Å²	27	11%	0.105	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-5.8	-178.3	62.8	0	0	0	0	114.8	F556 G631 D636 S637	F556-S633 WeakPolarHBondContact CD2-OG 3.48Å; F556-S633 VanDerWaalsContact CE2-CB 3.41Å; G631-S633 PolarHBondContact O-N 2.87Å; G631-S633 VanDerWaalsContact O-N 3.11Å; S633-D636 PolarHBondContact O-N 2.67Å; S633-S637 VanDerWaalsContact O-CB 3.28Å; S633-S637 WeakPolarHBondContact O-CB 3.38Å; S633-S637 PolarHBondContact O-N 2.84Å; S633-S637 PolarHBondContact O-OG 3.28Å; S633-S637 VanDerWaalsContact O-OG 3.07Å
634	Y	88.1	Confident	82.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-54.8	-59	-171.7	-178.1	-115.6	0	0	0	111.6	S600 F603 L604 L630 G631 D636 S637 I638 W646	S600-Y634 PolarHBondContact O-OH 3.23Å; F603-Y634 AromaticContact CD1-CE2 3.93Å; F603-Y634 HydrophobicContact CD1-CE2 3.93Å; F603-Y634 HydrophobicContact CE1-CE2 4.35Å; L604-Y634 WeakPolarHBondContact CB-OH 3.46Å; L630-Y634 HydrophobicContact CB-CD1 4.34Å; L630-Y634 HydrophobicContact CB-CG 4.24Å; L630-Y634 HydrophobicContact CD2-CD1 3.85Å; L630-Y634 HydrophobicContact CD2-CD2 4.33Å; L630-Y634 HydrophobicContact CD2-CE1 3.68Å; L630-Y634 HydrophobicContact CD2-CE2 4.15Å; L630-Y634 HydrophobicContact CD2-CG 4.16Å; L630-Y634 HydrophobicContact CG-CD1 4.46Å; L630-Y634 WeakPolarHBondContact O-CB 3.47Å; G631-Y634 WeakPolarHBondContact O-CB 3.28Å; G631-Y634 PolarHBondContact O-N 3.24Å; G631-Y634 VanDerWaalsContact O-N 3.09Å; Y634-D636 VanDerWaalsContact C-N 3.32Å; Y634-D636 PolarHBondContact O-N 3.4Å; Y634-S637 PolarHBondContact O-N 3.14Å; Y634-S637 PolarHBondContact O-OG 2.85Å; Y634-I638 HydrophobicContact CD1-CD1 4.18Å; Y634-I638 HydrophobicContact CD2-CD1 3.3Å; Y634-I638 HydrophobicContact CE1-CD1 3.96Å; Y634-I638 HydrophobicContact CE2-CD1 3.07Å; Y634-I638 HydrophobicContact CG-CD1 3.9Å; Y634-I638 VanDerWaalsContact CZ-CD1 3.43Å; Y634-I638 WeakPolarHBondContact O-CD1 3.5Å; Y634-I638 PolarHBondContact O-N 2.79Å; Y634-I638 VanDerWaalsContact O-N 3.14Å; Y634-W646 AromaticContact CD1-CH2 4Å; Y634-W646 HydrophobicContact CD1-CH2 4Å; Y634-W646 AromaticContact CE1-CH2 3.28Å; Y634-W646 HydrophobicContact CE1-CH2 3.28Å; Y634-W646 HydrophobicContact CE1-CZ2 4.42Å; Y634-W646 AromaticContact CE1-CZ3 3.52Å; Y634-W646 HydrophobicContact CE1-CZ3 3.52Å; Y634-W646 AromaticContact CZ-CH2 3.88Å; Y634-W646 AromaticContact CZ-CZ3 3.7Å; Y634-W646 VanDerWaalsContact OH-CZ3 3.28Å; Y634-W646 WeakPolarHBondContact OH-CZ3 3.49Å
635	F	85.7	Confident	82.6	Confident	1 Å²	1	35.2 Å²	35.2	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-64.7	-35	-178	-68.4	-85.1	0	0	0	112.5	L630 S639 W640 W646 V650 F672 V677 A680	L630-F635 HydrophobicContact CD1-CE2 4.31Å; F635-S639 WeakPolarHBondContact O-CA 3.28Å; F635-S639 PolarHBondContact O-N 3.01Å; F635-S639 VanDerWaalsContact O-N 3.14Å; F635-W640 HydrophobicContact CD1-CZ3 4.37Å; F635-W646 HydrophobicContact CD1-CH2 4.13Å; F635-W646 AromaticContact CD1-CZ2 3.64Å; F635-W646 HydrophobicContact CD1-CZ2 3.64Å; F635-W646 AromaticContact CE1-CH2 3.97Å; F635-W646 HydrophobicContact CE1-CH2 3.97Å; F635-W646 AromaticContact CE1-CZ2 3.51Å; F635-W646 HydrophobicContact CE1-CZ2 3.51Å; F635-V650 HydrophobicContact CE1-CG2 4.01Å; F635-V650 HydrophobicContact CZ-CG2 4.45Å; F635-F672 HydrophobicContact CD2-CE1 4.49Å; F635-F672 HydrophobicContact CD2-CZ 4.13Å; F635-F672 AromaticContact CE2-CE1 3.9Å; F635-F672 HydrophobicContact CE2-CE1 3.9Å; F635-F672 AromaticContact CE2-CZ 3.82Å; F635-F672 HydrophobicContact CE2-CZ 3.82Å; F635-V677 HydrophobicContact CD1-CG1 4.45Å; F635-V677 HydrophobicContact CD2-CG2 3.89Å; F635-V677 HydrophobicContact CE1-CG1 4.1Å; F635-V677 HydrophobicContact CE2-CG2 3.56Å; F635-V677 HydrophobicContact CZ-CG1 4.16Å; F635-V677 HydrophobicContact CZ-CG2 3.9Å; F635-A680 HydrophobicContact CB-CB 3.73Å
636	D	78.4	Confident	82.9	Confident	109 Å²	109	35.1 Å²	35.1	58%	0.583	19%	0.194	S	C	*	.	H	α-helix	trans	-67.9	-40.4	176.3	-68.5	-25.1	0	0	0	112.2	S633 Y634	S633-D636 PolarHBondContact O-N 2.67Å; Y634-D636 VanDerWaalsContact C-N 3.32Å; Y634-D636 PolarHBondContact O-N 3.4Å
637	S	77.8	Confident	83.1	Confident	16 Å²	16	35.1 Å²	35.1	11%	0.112	19%	0.194	C	C	.	.	H	α-helix	trans	-75.2	-37.6	-175.4	67.4	0	0	0	0	113.8	S563 S633 Y634	S563-S637 VanDerWaalsContact CB-O 3.23Å; S563-S637 WeakPolarHBondContact CB-O 3.27Å; S633-S637 VanDerWaalsContact O-CB 3.28Å; S633-S637 WeakPolarHBondContact O-CB 3.38Å; S633-S637 PolarHBondContact O-N 2.84Å; S633-S637 PolarHBondContact O-OG 3.28Å; S633-S637 VanDerWaalsContact O-OG 3.07Å; Y634-S637 PolarHBondContact O-N 3.14Å; Y634-S637 PolarHBondContact O-OG 2.85Å
638	I	77	Confident	83.2	Confident	8 Å²	8	38.9 Å²	38.9	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-85	-22.6	-177.9	-63.6	154.5	0	0	0	111.1	F596 S600 Y634 P641 W646	F596-I638 HydrophobicContact CE1-CB 4.48Å; F596-I638 HydrophobicContact CE1-CG1 4.02Å; F596-I638 HydrophobicContact CZ-CG1 3.89Å; S600-I638 VanDerWaalsContact CB-CD1 3.44Å; Y634-I638 HydrophobicContact CD1-CD1 4.18Å; Y634-I638 HydrophobicContact CD2-CD1 3.3Å; Y634-I638 HydrophobicContact CE1-CD1 3.96Å; Y634-I638 HydrophobicContact CE2-CD1 3.07Å; Y634-I638 HydrophobicContact CG-CD1 3.9Å; Y634-I638 VanDerWaalsContact CZ-CD1 3.43Å; Y634-I638 WeakPolarHBondContact O-CD1 3.5Å; Y634-I638 PolarHBondContact O-N 2.79Å; Y634-I638 VanDerWaalsContact O-N 3.14Å; I638-P641 HydrophobicContact CG2-CG 4.39Å; I638-W646 HydrophobicContact CD1-CH2 4.33Å; I638-W646 HydrophobicContact CD1-CZ3 4.49Å
639	S	74.8	Confident	83.3	Confident	75 Å²	75	37.7 Å²	37.7	52%	0.524	21%	0.207	S	C	.	.			trans	61.3	-170.4	-158.2	75.8	0	0	0	0	111.8	F635 P641	F635-S639 WeakPolarHBondContact O-CA 3.28Å; F635-S639 PolarHBondContact O-N 3.01Å; F635-S639 VanDerWaalsContact O-N 3.14Å; S639-P641 WeakPolarHBondContact O-CD 3.37Å
640	W	82.1	Confident	83.4	Confident	16 Å²	16	37.8 Å²	37.8	6%	0.061	21%	0.207	C	C	.	.			trans	-99.7	99.1	179.8	-164.3	-76.8	0	0	0	110.8	F635 W646 N647 V650 V677 A680 F681 A684 L703 I706	F635-W640 HydrophobicContact CD1-CZ3 4.37Å; W640-W646 AromaticContact CE2-NE1 3.89Å; W640-N647 PolarHBondContact NE1-OD1 3.03Å; W640-V650 HydrophobicContact CH2-CG1 3.81Å; W640-V650 HydrophobicContact CZ2-CG1 4.28Å; W640-V677 HydrophobicContact CH2-CG1 4.39Å; W640-V677 HydrophobicContact CZ3-CG1 4.14Å; W640-A680 HydrophobicContact CE3-CB 3.94Å; W640-A680 HydrophobicContact CZ3-CB 4.42Å; W640-F681 VanDerWaalsContact CE3-CA 3.44Å; W640-F681 HydrophobicContact CE3-CB 4.03Å; W640-F681 VanDerWaalsContact CE3-N 3.31Å; W640-F681 HydrophobicContact CH2-CB 3.59Å; W640-F681 AromaticContact CH2-CD2 3.56Å; W640-F681 HydrophobicContact CH2-CD2 3.56Å; W640-F681 AromaticContact CH2-CG 3.97Å; W640-F681 HydrophobicContact CH2-CG 3.97Å; W640-F681 HydrophobicContact CZ2-CB 4.32Å; W640-F681 AromaticContact CZ2-CD2 3.49Å; W640-F681 HydrophobicContact CZ2-CD2 3.49Å; W640-F681 VanDerWaalsContact CZ2-CD2 3.49Å; W640-F681 HydrophobicContact CZ2-CE2 4.27Å; W640-F681 HydrophobicContact CZ2-CG 4.34Å; W640-F681 VanDerWaalsContact CZ3-CA 3.42Å; W640-F681 HydrophobicContact CZ3-CB 3.44Å; W640-F681 VanDerWaalsContact CZ3-CB 3.44Å; W640-F681 HydrophobicContact CZ3-CD2 4.2Å; W640-F681 HydrophobicContact CZ3-CG 4.3Å; W640-A684 HydrophobicContact CB-CB 3.37Å; W640-A684 HydrophobicContact CD2-CB 3.91Å; W640-A684 HydrophobicContact CG-CB 3.29Å; W640-L703 HydrophobicContact CZ2-CD2 4.45Å; W640-I706 HydrophobicContact CZ2-CD1 4.12Å
641	P	78.4	Confident	83.5	Confident	16 Å²	16	38.9 Å²	38.9	10%	0.104	21%	0.213	C	C	.	.			trans	-71.6	133.7	177.3	27.5	-33	0	0	0	111	T597 I601 I638 S639 D643 W646 N647	T597-P641 HydrophobicContact CG2-CB 3.73Å; T597-P641 HydrophobicContact CG2-CG 4.23Å; I601-P641 HydrophobicContact CD1-CB 4.37Å; I601-P641 HydrophobicContact CD1-CG 4.34Å; I601-P641 HydrophobicContact CG1-CG 4.32Å; I638-P641 HydrophobicContact CG2-CG 4.39Å; S639-P641 WeakPolarHBondContact O-CD 3.37Å; P641-D643 PolarHBondContact O-N 3.32Å; P641-W646 HydrophobicContact CG-CB 4.15Å; P641-W646 HydrophobicContact CG-CD2 3.54Å; P641-W646 HydrophobicContact CG-CE3 3.97Å; P641-W646 HydrophobicContact CG-CG 3.6Å; P641-W646 HydrophobicContact CG-CZ2 4.38Å; P641-W646 HydrophobicContact CG-CZ3 4.49Å; P641-N647 PolarHBondContact O-ND2 3.1Å
642	F	79	Confident	83.6	Confident	79 Å²	79	42.7 Å²	42.7	35%	0.346	23%	0.227	S	C	.	.			trans	-79.8	44.7	173	-65.9	-63.3	0	0	0	112.1	A684 I695 L699 L703	F642-A684 WeakPolarHBondContact CZ-O 3.43Å; F642-I695 HydrophobicContact CE1-CD1 4.38Å; F642-I695 HydrophobicContact CE1-CG1 3.98Å; F642-I695 HydrophobicContact CE1-CG2 4.45Å; F642-I695 HydrophobicContact CZ-CG1 4.13Å; F642-L699 HydrophobicContact CB-CD2 3.7Å; F642-L699 HydrophobicContact CD1-CD2 3.51Å; F642-L699 HydrophobicContact CG-CD2 4.08Å; F642-L703 HydrophobicContact CE1-CD1 4.42Å
643	D	83.2	Confident	84.1	Confident	65 Å²	65	38.9 Å²	38.9	35%	0.348	20%	0.2	S	C	.	.			trans	-94.6	140.1	174.5	-177.4	-86.6	0	0	0	110.4	I601 P641 K645 W646 N647	I601-D643 HydrophobicContact CD1-CB 3.61Å; P641-D643 PolarHBondContact O-N 3.32Å; D643-K645 WeakPolarHBondContact OD1-CA 3.46Å; D643-K645 WeakPolarHBondContact OD1-CB 3.34Å; D643-K645 PolarHBondContact OD1-N 3.13Å; D643-W646 HydrophobicContact CB-CB 4.1Å; D643-W646 PolarHBondContact O-N 3.1Å; D643-W646 PolarHBondContact OD1-N 3.03Å; D643-N647 PolarHBondContact O-N 3.5Å; D643-N647 PolarHBondContact O-ND2 3.14Å
644	I	83.9	Confident	84.5	Confident	76 Å²	76	38.2 Å²	38.2	39%	0.39	20%	0.195	S	C	.	.	H	α-helix	trans	-63.2	-46.2	-176.5	-64.6	171.4	0	0	0	110.9	W646 N647 E648 L699 I702	I644-W646 VanDerWaalsContact C-N 3.34Å; I644-W646 PolarHBondContact O-N 3.14Å; I644-N647 PolarHBondContact O-N 2.92Å; I644-E648 HydrophobicContact CG2-CG 4.26Å; I644-E648 WeakPolarHBondContact O-CG 3.42Å; I644-E648 PolarHBondContact O-N 2.84Å; I644-L699 HydrophobicContact CG1-CD1 4.1Å; I644-I702 HydrophobicContact CG2-CD1 4.04Å
645	K	85	Confident	84.5	Confident	123 Å²	123	43 Å²	43	54%	0.535	22%	0.218	S	C	.	.	H	α-helix	trans	-65.4	-39.1	-177.1	-65.2	-179.1	176.1	-178.7	0	111.6	I601 V605 D643 N647 E648 C649	I601-K645 HydrophobicContact CG2-CB 4.25Å; V605-K645 HydrophobicContact CG2-CB 4.49Å; D643-K645 WeakPolarHBondContact OD1-CA 3.46Å; D643-K645 WeakPolarHBondContact OD1-CB 3.34Å; D643-K645 PolarHBondContact OD1-N 3.13Å; K645-N647 PolarHBondContact O-N 3.04Å; K645-E648 PolarHBondContact O-N 3.02Å; K645-C649 WeakPolarHBondContact O-CB 3.41Å; K645-C649 PolarHBondContact O-N 3.13Å; K645-C649 PolarHBondContact O-SG 3.02Å
646	W	87.7	Confident	84.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-54.8	-52.1	173.3	173	-97.3	0	0	0	111.5	I601 L604 Y634 F635 I638 W640 P641 D643 I644 C649 V650	I601-W646 HydrophobicContact CD1-CB 4.43Å; I601-W646 HydrophobicContact CG1-CB 4.14Å; I601-W646 HydrophobicContact CG1-CE3 3.91Å; I601-W646 HydrophobicContact CG2-CB 4.46Å; L604-W646 HydrophobicContact CD2-CD2 4.2Å; L604-W646 HydrophobicContact CD2-CE3 3.73Å; L604-W646 HydrophobicContact CD2-CZ3 3.97Å; Y634-W646 AromaticContact CD1-CH2 4Å; Y634-W646 HydrophobicContact CD1-CH2 4Å; Y634-W646 AromaticContact CE1-CH2 3.28Å; Y634-W646 HydrophobicContact CE1-CH2 3.28Å; Y634-W646 HydrophobicContact CE1-CZ2 4.42Å; Y634-W646 AromaticContact CE1-CZ3 3.52Å; Y634-W646 HydrophobicContact CE1-CZ3 3.52Å; Y634-W646 AromaticContact CZ-CH2 3.88Å; Y634-W646 AromaticContact CZ-CZ3 3.7Å; Y634-W646 VanDerWaalsContact OH-CZ3 3.28Å; Y634-W646 WeakPolarHBondContact OH-CZ3 3.49Å; F635-W646 HydrophobicContact CD1-CH2 4.13Å; F635-W646 AromaticContact CD1-CZ2 3.64Å; F635-W646 HydrophobicContact CD1-CZ2 3.64Å; F635-W646 AromaticContact CE1-CH2 3.97Å; F635-W646 HydrophobicContact CE1-CH2 3.97Å; F635-W646 AromaticContact CE1-CZ2 3.51Å; F635-W646 HydrophobicContact CE1-CZ2 3.51Å; I638-W646 HydrophobicContact CD1-CH2 4.33Å; I638-W646 HydrophobicContact CD1-CZ3 4.49Å; W640-W646 AromaticContact CE2-NE1 3.89Å; P641-W646 HydrophobicContact CG-CB 4.15Å; P641-W646 HydrophobicContact CG-CD2 3.54Å; P641-W646 HydrophobicContact CG-CE3 3.97Å; P641-W646 HydrophobicContact CG-CG 3.6Å; P641-W646 HydrophobicContact CG-CZ2 4.38Å; P641-W646 HydrophobicContact CG-CZ3 4.49Å; D643-W646 HydrophobicContact CB-CB 4.1Å; D643-W646 PolarHBondContact O-N 3.1Å; D643-W646 PolarHBondContact OD1-N 3.03Å; I644-W646 VanDerWaalsContact C-N 3.34Å; I644-W646 PolarHBondContact O-N 3.14Å; W646-C649 WeakPolarHBondContact O-CB 3.24Å; W646-C649 PolarHBondContact O-N 2.98Å; W646-V650 HydrophobicContact CD2-CG2 4.38Å; W646-V650 HydrophobicContact CZ2-CG2 4.39Å; W646-V650 WeakPolarHBondContact O-CG2 3.38Å; W646-V650 PolarHBondContact O-N 3.34Å
647	N	90	Very high	84.9	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71.8	-33.8	-175.1	-71.2	-82.4	0	0	0	111.8	W640 P641 D643 I644 K645 L651 L699 I702 L703 I706	W640-N647 PolarHBondContact NE1-OD1 3.03Å; P641-N647 PolarHBondContact O-ND2 3.1Å; D643-N647 PolarHBondContact O-N 3.5Å; D643-N647 PolarHBondContact O-ND2 3.14Å; I644-N647 PolarHBondContact O-N 2.92Å; K645-N647 PolarHBondContact O-N 3.04Å; N647-L651 WeakPolarHBondContact O-CB 3.23Å; N647-L651 PolarHBondContact O-N 3.27Å; N647-L699 HydrophobicContact CB-CD1 3.98Å; N647-I702 HydrophobicContact CB-CB 4.45Å; N647-I702 HydrophobicContact CB-CG2 3.66Å; N647-L703 WeakPolarHBondContact OD1-CD2 3.49Å; N647-I706 HydrophobicContact CB-CD1 4.25Å
648	E	88.2	Confident	85.4	Confident	87 Å²	87	38.2 Å²	38.2	41%	0.407	19%	0.194	S	C	.	.	H	α-helix	trans	-61.2	-43.4	170.1	-73.6	176.7	166.9	0	0	112	I644 K645 L651 Q652 I702	I644-E648 HydrophobicContact CG2-CG 4.26Å; I644-E648 WeakPolarHBondContact O-CG 3.42Å; I644-E648 PolarHBondContact O-N 2.84Å; K645-E648 PolarHBondContact O-N 3.02Å; E648-L651 WeakPolarHBondContact O-CB 3.41Å; E648-L651 PolarHBondContact O-N 3.25Å; E648-Q652 VanDerWaalsContact O-CG 3.31Å; E648-Q652 WeakPolarHBondContact O-CG 3.41Å; E648-Q652 PolarHBondContact O-N 2.64Å; E648-I702 HydrophobicContact CG-CD1 4.01Å
649	C	88.7	Confident	85.7	Confident	11 Å²	11	41.5 Å²	41.5	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-65.3	-45.7	177.6	-74.1	0	0	0	0	112.4	L604 L608 K645 W646 L651 Q652 L653	L604-C649 HydrophobicContact CD2-CB 3.5Å; L604-C649 HydrophobicContact CG-CB 3.71Å; L608-C649 HydrophobicContact CD1-CB 3.46Å; L608-C649 VanDerWaalsContact CD1-CB 3.46Å; L608-C649 WeakPolarHBondContact CD1-O 3.39Å; K645-C649 WeakPolarHBondContact O-CB 3.41Å; K645-C649 PolarHBondContact O-N 3.13Å; K645-C649 PolarHBondContact O-SG 3.02Å; W646-C649 WeakPolarHBondContact O-CB 3.24Å; W646-C649 PolarHBondContact O-N 2.98Å; C649-L651 VanDerWaalsContact C-N 3.29Å; C649-L651 PolarHBondContact O-N 3.06Å; C649-Q652 PolarHBondContact O-N 2.99Å; C649-L653 WeakPolarHBondContact O-CB 3.24Å; C649-L653 PolarHBondContact O-N 3.4Å
650	V	90.5	Very high	85.9	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-39.4	175.7	174.1	0	0	0	0	110.9	L604 F635 W640 W646 L653 L654 V677 I706	L604-V650 HydrophobicContact CD2-CG2 3.96Å; F635-V650 HydrophobicContact CE1-CG2 4.01Å; F635-V650 HydrophobicContact CZ-CG2 4.45Å; W640-V650 HydrophobicContact CH2-CG1 3.81Å; W640-V650 HydrophobicContact CZ2-CG1 4.28Å; W646-V650 HydrophobicContact CD2-CG2 4.38Å; W646-V650 HydrophobicContact CZ2-CG2 4.39Å; W646-V650 WeakPolarHBondContact O-CG2 3.38Å; W646-V650 PolarHBondContact O-N 3.34Å; V650-L653 PolarHBondContact O-N 3.46Å; V650-L654 HydrophobicContact CG1-CD1 4.07Å; V650-L654 WeakPolarHBondContact O-CB 2.97Å; V650-L654 PolarHBondContact O-N 3.43Å; V650-V677 HydrophobicContact CG1-CG1 4.28Å; V650-I706 HydrophobicContact CB-CD1 4.46Å; V650-I706 HydrophobicContact CG1-CD1 4.27Å
651	L	89.9	Confident	85.5	Confident	23 Å²	23	41.7 Å²	41.7	12%	0.12	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-47.9	175.1	179.1	64	0	0	0	111.7	N647 E648 C649 L653 L654 E655 I702 K705 I706 Y709	N647-L651 WeakPolarHBondContact O-CB 3.23Å; N647-L651 PolarHBondContact O-N 3.27Å; E648-L651 WeakPolarHBondContact O-CB 3.41Å; E648-L651 PolarHBondContact O-N 3.25Å; C649-L651 VanDerWaalsContact C-N 3.29Å; C649-L651 PolarHBondContact O-N 3.06Å; L651-L653 VanDerWaalsContact C-N 3.32Å; L651-L653 PolarHBondContact O-N 3.5Å; L651-L654 PolarHBondContact O-N 2.97Å; L651-E655 WeakPolarHBondContact O-CB 3.36Å; L651-E655 PolarHBondContact O-N 3.22Å; L651-I702 HydrophobicContact CB-CG2 4.43Å; L651-I702 HydrophobicContact CD2-CG2 4.18Å; L651-K705 HydrophobicContact CD1-CB 3.78Å; L651-K705 HydrophobicContact CD2-CB 4.16Å; L651-K705 HydrophobicContact CD2-CD 4.09Å; L651-I706 HydrophobicContact CB-CD1 4.49Å; L651-I706 HydrophobicContact CB-CG1 4.03Å; L651-I706 HydrophobicContact CD1-CG1 3.98Å; L651-Y709 HydrophobicContact CD1-CD2 3.39Å; L651-Y709 HydrophobicContact CD1-CE2 3.53Å
652	Q	87.9	Confident	85.1	Confident	95 Å²	95	42.2 Å²	42.2	44%	0.444	22%	0.224	S	C	.	.	H	α-helix	trans	-60.4	-41.4	176.8	-73.4	173.5	20.8	0	0	112.1	E648 C649 E655 A656	E648-Q652 VanDerWaalsContact O-CG 3.31Å; E648-Q652 WeakPolarHBondContact O-CG 3.41Å; E648-Q652 PolarHBondContact O-N 2.64Å; C649-Q652 PolarHBondContact O-N 2.99Å; Q652-E655 PolarHBondContact O-N 3Å; Q652-A656 PolarHBondContact O-N 2.87Å
653	L	88.7	Confident	84.7	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-42.3	178.2	-170.3	69.8	0	0	0	111.4	L608 T623 I626 L630 C649 V650 L651 A656 V657 F673	L608-L653 HydrophobicContact CD2-CB 4.47Å; L608-L653 HydrophobicContact CD2-CD1 4.12Å; T623-L653 HydrophobicContact CG2-CD1 4.41Å; I626-L653 HydrophobicContact CG2-CD1 3.89Å; L630-L653 HydrophobicContact CD1-CD2 4.12Å; C649-L653 WeakPolarHBondContact O-CB 3.24Å; C649-L653 PolarHBondContact O-N 3.4Å; V650-L653 PolarHBondContact O-N 3.46Å; L651-L653 VanDerWaalsContact C-N 3.32Å; L651-L653 PolarHBondContact O-N 3.5Å; L653-A656 PolarHBondContact O-N 3.2Å; L653-V657 WeakPolarHBondContact O-CG2 3.35Å; L653-V657 PolarHBondContact O-N 3.43Å; L653-F673 HydrophobicContact CD2-CE1 4.49Å; L653-F673 HydrophobicContact CD2-CE2 4.5Å; L653-F673 HydrophobicContact CD2-CZ 3.67Å; L653-F673 HydrophobicContact CG-CZ 3.76Å
654	L	89.8	Confident	83.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-42	174.4	-86.5	167.7	0	0	0	112.7	V650 L651 A656 V657 C658 F673 I706 Y709 F710	V650-L654 HydrophobicContact CG1-CD1 4.07Å; V650-L654 WeakPolarHBondContact O-CB 2.97Å; V650-L654 PolarHBondContact O-N 3.43Å; L651-L654 PolarHBondContact O-N 2.97Å; L654-A656 VanDerWaalsContact C-N 3.35Å; L654-V657 PolarHBondContact O-N 3.3Å; L654-C658 WeakPolarHBondContact O-CB 3.47Å; L654-C658 PolarHBondContact O-N 3.15Å; L654-C658 PolarHBondContact O-SG 3.27Å; L654-F673 HydrophobicContact CD2-CD1 3.33Å; L654-F673 HydrophobicContact CD2-CE1 3.44Å; L654-F673 VanDerWaalsContact CD2-CE1 3.44Å; L654-F673 HydrophobicContact CD2-CG 4.32Å; L654-F673 HydrophobicContact CD2-CZ 4.5Å; L654-F673 HydrophobicContact CG-CD1 4.07Å; L654-F673 HydrophobicContact CG-CE1 3.67Å; L654-I706 HydrophobicContact CD1-CB 4.29Å; L654-I706 HydrophobicContact CD1-CG1 4.33Å; L654-I706 HydrophobicContact CD1-CG2 3.64Å; L654-Y709 HydrophobicContact CB-CG 4.43Å; L654-F710 HydrophobicContact CD1-CD2 4.36Å; L654-F710 HydrophobicContact CD1-CE2 3.95Å; L654-F710 HydrophobicContact CD1-CZ 4.21Å; L654-F710 HydrophobicContact CD2-CD1 4.4Å; L654-F710 HydrophobicContact CD2-CE1 4.04Å; L654-F710 HydrophobicContact CD2-CZ 4.12Å
655	E	88.1	Confident	83.2	Confident	100 Å²	100	44.4 Å²	44.4	47%	0.467	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-46.2	176.4	177.3	168.7	-174	0	0	111	L651 Q652 V657 C658 S659 Y709	L651-E655 WeakPolarHBondContact O-CB 3.36Å; L651-E655 PolarHBondContact O-N 3.22Å; Q652-E655 PolarHBondContact O-N 3Å; E655-V657 PolarHBondContact O-N 2.84Å; E655-C658 PolarHBondContact O-N 2.69Å; E655-S659 PolarHBondContact O-N 2.94Å; E655-Y709 HydrophobicContact CB-CE1 3.82Å; E655-Y709 HydrophobicContact CB-CE2 4.25Å; E655-Y709 HydrophobicContact CG-CE1 3.98Å; E655-Y709 VanDerWaalsContact CG-OH 3.28Å; E655-Y709 WeakPolarHBondContact CG-OH 3.36Å; E655-Y709 PolarHBondContact OE1-OH 3.44Å; E655-Y709 PolarHBondContact OE2-OH 2.94Å
656	A	85.3	Confident	82.8	Confident	6 Å²	6	39.2 Å²	39.2	5%	0.05	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-45	174	0	0	0	0	0	112.3	L618 Q652 L653 L654 C658 S659 L660	L618-A656 HydrophobicContact CB-CB 3.75Å; L618-A656 HydrophobicContact CD1-CB 3.62Å; L618-A656 HydrophobicContact CG-CB 4.23Å; Q652-A656 PolarHBondContact O-N 2.87Å; L653-A656 PolarHBondContact O-N 3.2Å; L654-A656 VanDerWaalsContact C-N 3.35Å; A656-C658 VanDerWaalsContact C-N 3.32Å; A656-C658 PolarHBondContact O-N 3.07Å; A656-S659 WeakPolarHBondContact O-CB 3.4Å; A656-S659 PolarHBondContact O-N 3.48Å; A656-S659 VanDerWaalsContact O-N 3.08Å; A656-S659 PolarHBondContact O-OG 3.2Å; A656-L660 WeakPolarHBondContact O-CG 3.48Å; A656-L660 PolarHBondContact O-N 2.99Å
657	V	87.6	Confident	82.4	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-39.2	179	173.2	0	0	0	0	111.6	T623 L653 L654 E655 S659 L660 V669 F670 F673 L713	T623-V657 HydrophobicContact CG2-CG2 3.62Å; L653-V657 WeakPolarHBondContact O-CG2 3.35Å; L653-V657 PolarHBondContact O-N 3.43Å; L654-V657 PolarHBondContact O-N 3.3Å; E655-V657 PolarHBondContact O-N 2.84Å; V657-S659 PolarHBondContact O-N 2.81Å; V657-L660 WeakPolarHBondContact O-CB 3.41Å; V657-L660 PolarHBondContact O-N 3.32Å; V657-L660 VanDerWaalsContact O-N 3.16Å; V657-V669 HydrophobicContact CB-CG1 4.44Å; V657-V669 HydrophobicContact CG1-CG1 3.86Å; V657-V669 HydrophobicContact CG2-CG1 3.85Å; V657-F670 HydrophobicContact CG1-CD1 3.84Å; V657-F670 HydrophobicContact CG1-CE1 3.83Å; V657-F673 HydrophobicContact CB-CE2 4.27Å; V657-F673 HydrophobicContact CG1-CD2 4.12Å; V657-F673 HydrophobicContact CG1-CE2 4.3Å; V657-F673 HydrophobicContact CG2-CD2 4Å; V657-F673 HydrophobicContact CG2-CE2 3.34Å; V657-F673 HydrophobicContact CG2-CZ 3.72Å; V657-L713 HydrophobicContact CG1-CD1 3.99Å
658	C	86.7	Confident	81.9	Confident	21 Å²	21	45.2 Å²	45.2	14%	0.142	25%	0.251	C	S	.	.	H	α-helix	trans	-69.7	-19.8	175.8	-66.9	0	0	0	0	113	L654 E655 A656 L660 Y709 I716	L654-C658 WeakPolarHBondContact O-CB 3.47Å; L654-C658 PolarHBondContact O-N 3.15Å; L654-C658 PolarHBondContact O-SG 3.27Å; E655-C658 PolarHBondContact O-N 2.69Å; A656-C658 VanDerWaalsContact C-N 3.32Å; A656-C658 PolarHBondContact O-N 3.07Å; C658-L660 VanDerWaalsContact C-N 3.33Å; C658-Y709 HydrophobicContact CB-CD1 3.96Å; C658-Y709 HydrophobicContact CB-CE1 4.32Å; C658-I716 HydrophobicContact CB-CD1 4.12Å; C658-I716 VanDerWaalsContact O-CD1 3.3Å; C658-I716 WeakPolarHBondContact O-CD1 3.05Å
659	S	83.9	Confident	81.7	Confident	76 Å²	76	41 Å²	41	53%	0.531	23%	0.232	S	C	.	.	H	α-helix	trans	-82	-11.2	173.1	77.7	0	0	0	0	113.6	E655 A656 V657	E655-S659 PolarHBondContact O-N 2.94Å; A656-S659 WeakPolarHBondContact O-CB 3.4Å; A656-S659 PolarHBondContact O-N 3.48Å; A656-S659 VanDerWaalsContact O-N 3.08Å; A656-S659 PolarHBondContact O-OG 3.2Å; V657-S659 PolarHBondContact O-N 2.81Å
660	L	80.2	Confident	81.6	Confident	16 Å²	16	40.5 Å²	40.5	8%	0.084	23%	0.228	C	C	.	.	S	Bend	trans	-73.8	132.2	178.5	-59.4	-178.8	0	0	0	110.8	T623 A656 V657 C658 V669 F670	T623-L660 HydrophobicContact CG2-CD1 4.2Å; A656-L660 WeakPolarHBondContact O-CG 3.48Å; A656-L660 PolarHBondContact O-N 2.99Å; V657-L660 WeakPolarHBondContact O-CB 3.41Å; V657-L660 PolarHBondContact O-N 3.32Å; V657-L660 VanDerWaalsContact O-N 3.16Å; C658-L660 VanDerWaalsContact C-N 3.33Å; L660-V669 HydrophobicContact CD1-CG1 4Å; L660-F670 HydrophobicContact CB-CZ 4.44Å
661	A	72.9	Confident	81.3	Confident	79 Å²	79	42.9 Å²	42.9	65%	0.653	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-64.1	138.6	165.2	0	0	0	0	0	109.4	S663 N666	A661-S663 PolarHBondContact O-N 3.45Å; A661-N666 PolarHBondContact O-ND2 2.92Å
662	Y	69.4	Low	81.1	Confident	27 Å²	27	42.4 Å²	42.4	11%	0.106	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-67.6	122.7	175.5	-171.7	-82.1	0	0	0	109.9	L667 F670 Y720 E723 L726	Y662-L667 HydrophobicContact CE2-CD2 4.43Å; Y662-L667 WeakPolarHBondContact OH-CD2 3.49Å; Y662-F670 AromaticContact CD2-CD2 3.76Å; Y662-F670 HydrophobicContact CD2-CD2 3.76Å; Y662-F670 AromaticContact CD2-CE2 3.41Å; Y662-F670 HydrophobicContact CD2-CE2 3.41Å; Y662-F670 VanDerWaalsContact CD2-CE2 3.41Å; Y662-F670 HydrophobicContact CD2-CZ 4.25Å; Y662-F670 AromaticContact CE2-CD2 3.87Å; Y662-F670 HydrophobicContact CE2-CD2 3.87Å; Y662-F670 AromaticContact CE2-CE2 4Å; Y662-F670 HydrophobicContact CE2-CE2 4Å; Y662-F670 HydrophobicContact CG-CE2 4.12Å; Y662-Y720 AromaticContact CD1-CD1 3.94Å; Y662-Y720 HydrophobicContact CD1-CD1 3.94Å; Y662-Y720 AromaticContact CD1-CD2 3.85Å; Y662-Y720 HydrophobicContact CD1-CD2 3.85Å; Y662-Y720 AromaticContact CD1-CG 3.52Å; Y662-Y720 HydrophobicContact CD1-CG 3.52Å; Y662-Y720 HydrophobicContact CD2-CD2 4.1Å; Y662-Y720 HydrophobicContact CD2-CG 4.41Å; Y662-Y720 HydrophobicContact CE1-CG 4.02Å; Y662-Y720 HydrophobicContact CG-CD1 4.46Å; Y662-Y720 AromaticContact CG-CD2 3.55Å; Y662-Y720 HydrophobicContact CG-CD2 3.55Å; Y662-Y720 HydrophobicContact CG-CE2 4.14Å; Y662-Y720 AromaticContact CG-CG 3.75Å; Y662-Y720 HydrophobicContact CG-CG 3.75Å; Y662-E723 VanDerWaalsContact CE1-OE2 3.29Å; Y662-E723 WeakPolarHBondContact CE1-OE2 3.48Å; Y662-E723 PolarHBondContact OH-OE2 3.28Å; Y662-L726 HydrophobicContact CE2-CD1 3.67Å; Y662-L726 WeakPolarHBondContact OH-CD1 3.35Å
663	S	70.6	Confident	81.2	Confident	40 Å²	40	37.9 Å²	37.9	28%	0.28	22%	0.221	S	C	.	.			trans	-146.4	156.4	175.4	60.5	0	0	0	0	109.2	A661 S665 N666 L667	A661-S663 PolarHBondContact O-N 3.45Å; S663-S665 PolarHBondContact O-N 3.39Å; S663-S665 VanDerWaalsContact O-N 3.12Å; S663-S665 PolarHBondContact OG-OG 2.93Å; S663-N666 WeakPolarHBondContact O-CA 3.28Å; S663-N666 PolarHBondContact O-N 2.97Å; S663-N666 VanDerWaalsContact OG-CG 3.23Å; S663-N666 PolarHBondContact OG-ND2 3.44Å; S663-N666 VanDerWaalsContact OG-ND2 3.14Å; S663-L667 PolarHBondContact O-N 3.31Å
664	E	67.4	Low	81.2	Confident	149 Å²	149	38.1 Å²	38.1	70%	0.696	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-54.4	-32.8	175.3	-75.3	-171.1	158.7	0	0	112.1	N666 L667 E723	E664-N666 PolarHBondContact O-N 2.9Å; E664-L667 HydrophobicContact CB-CD1 4.25Å; E664-L667 HydrophobicContact CG-CD1 4.32Å; E664-L667 WeakPolarHBondContact O-CB 3.38Å; E664-L667 PolarHBondContact O-N 3.37Å; E664-E723 WeakPolarHBondContact CG-OE1 3.31Å
665	S	68.3	Low	81	Confident	78 Å²	78	40.7 Å²	40.7	55%	0.545	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-64.7	-25.5	175.7	66.3	0	0	0	0	113.6	S663	S663-S665 PolarHBondContact O-N 3.39Å; S663-S665 VanDerWaalsContact O-N 3.12Å; S663-S665 PolarHBondContact OG-OG 2.93Å
666	N	77.1	Confident	80.9	Confident	13 Å²	13	36.1 Å²	36.1	7%	0.07	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-99.2	-2.2	-177.1	-63.3	-14.7	0	0	0	112.3	A661 S663 E664 E668 V669 F670	A661-N666 PolarHBondContact O-ND2 2.92Å; S663-N666 WeakPolarHBondContact O-CA 3.28Å; S663-N666 PolarHBondContact O-N 2.97Å; S663-N666 VanDerWaalsContact OG-CG 3.23Å; S663-N666 PolarHBondContact OG-ND2 3.44Å; S663-N666 VanDerWaalsContact OG-ND2 3.14Å; E664-N666 PolarHBondContact O-N 2.9Å; N666-E668 VanDerWaalsContact C-N 3.28Å; N666-E668 PolarHBondContact O-N 3.26Å; N666-V669 VanDerWaalsContact O-CB 3.28Å; N666-V669 WeakPolarHBondContact O-CB 3.25Å; N666-V669 PolarHBondContact O-N 2.98Å; N666-V669 VanDerWaalsContact O-N 3.1Å; N666-F670 HydrophobicContact CB-CD2 4.43Å; N666-F670 HydrophobicContact CB-CE2 3.87Å; N666-F670 HydrophobicContact CB-CZ 4.37Å; N666-F670 WeakPolarHBondContact O-CD2 3.32Å; N666-F670 PolarHBondContact O-N 3.47Å; N666-F670 VanDerWaalsContact O-N 3.13Å
667	L	78.6	Confident	81.2	Confident	18 Å²	18	35.8 Å²	35.8	9%	0.094	22%	0.216	C	C	.	.	H	α-helix	trans	-54.3	-42.3	177.2	-87.5	167.2	0	0	0	113	Y662 S663 E664 V669 F670 S671 E723 L726	Y662-L667 HydrophobicContact CE2-CD2 4.43Å; Y662-L667 WeakPolarHBondContact OH-CD2 3.49Å; S663-L667 PolarHBondContact O-N 3.31Å; E664-L667 HydrophobicContact CB-CD1 4.25Å; E664-L667 HydrophobicContact CG-CD1 4.32Å; E664-L667 WeakPolarHBondContact O-CB 3.38Å; E664-L667 PolarHBondContact O-N 3.37Å; L667-V669 VanDerWaalsContact C-N 3.3Å; L667-V669 PolarHBondContact O-N 2.94Å; L667-F670 PolarHBondContact O-N 3.15Å; L667-S671 WeakPolarHBondContact O-CB 3.35Å; L667-S671 PolarHBondContact O-N 2.96Å; L667-E723 WeakPolarHBondContact CD1-OE2 3.2Å; L667-E723 WeakPolarHBondContact CD2-OE2 3.38Å; L667-L726 HydrophobicContact CD2-CD1 3.57Å; L667-L726 HydrophobicContact CD2-CG 3.85Å
668	E	79.7	Confident	81.3	Confident	108 Å²	108	36.4 Å²	36.4	51%	0.505	22%	0.218	S	C	.	.	H	α-helix	trans	-64.2	-38	179.6	-67.8	-174.3	-175.2	0	0	111.6	F624 N666 S671 F672	F624-E668 HydrophobicContact CE2-CB 4.01Å; F624-E668 WeakPolarHBondContact CE2-OE2 3.45Å; F624-E668 WeakPolarHBondContact CZ-OE2 3.24Å; N666-E668 VanDerWaalsContact C-N 3.28Å; N666-E668 PolarHBondContact O-N 3.26Å; E668-S671 PolarHBondContact O-N 2.87Å; E668-F672 PolarHBondContact O-N 2.99Å
669	V	84.8	Confident	81.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.5	-53.1	174.5	171.8	0	0	0	0	109.6	T623 F624 I627 V657 L660 N666 L667 S671 F672 F673	T623-V669 HydrophobicContact CG2-CG1 4.17Å; F624-V669 HydrophobicContact CB-CG2 4.27Å; F624-V669 HydrophobicContact CD2-CG2 3.96Å; I627-V669 HydrophobicContact CD1-CB 3.84Å; I627-V669 HydrophobicContact CD1-CG1 3.43Å; I627-V669 VanDerWaalsContact CD1-CG1 3.43Å; I627-V669 HydrophobicContact CD1-CG2 3.88Å; V657-V669 HydrophobicContact CB-CG1 4.44Å; V657-V669 HydrophobicContact CG1-CG1 3.86Å; V657-V669 HydrophobicContact CG2-CG1 3.85Å; L660-V669 HydrophobicContact CD1-CG1 4Å; N666-V669 VanDerWaalsContact O-CB 3.28Å; N666-V669 WeakPolarHBondContact O-CB 3.25Å; N666-V669 PolarHBondContact O-N 2.98Å; N666-V669 VanDerWaalsContact O-N 3.1Å; L667-V669 VanDerWaalsContact C-N 3.3Å; L667-V669 PolarHBondContact O-N 2.94Å; V669-S671 VanDerWaalsContact C-N 3.34Å; V669-S671 PolarHBondContact O-N 3.15Å; V669-F672 PolarHBondContact O-N 2.89Å; V669-F673 WeakPolarHBondContact O-CD2 3.42Å; V669-F673 PolarHBondContact O-N 3.3Å
670	F	86.1	Confident	81.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-40.2	179.7	-59.8	-48.6	0	0	0	112.5	V657 L660 Y662 N666 L667 F672 F673 W674 L713 I716 L726	V657-F670 HydrophobicContact CG1-CD1 3.84Å; V657-F670 HydrophobicContact CG1-CE1 3.83Å; L660-F670 HydrophobicContact CB-CZ 4.44Å; Y662-F670 AromaticContact CD2-CD2 3.76Å; Y662-F670 HydrophobicContact CD2-CD2 3.76Å; Y662-F670 AromaticContact CD2-CE2 3.41Å; Y662-F670 HydrophobicContact CD2-CE2 3.41Å; Y662-F670 VanDerWaalsContact CD2-CE2 3.41Å; Y662-F670 HydrophobicContact CD2-CZ 4.25Å; Y662-F670 AromaticContact CE2-CD2 3.87Å; Y662-F670 HydrophobicContact CE2-CD2 3.87Å; Y662-F670 AromaticContact CE2-CE2 4Å; Y662-F670 HydrophobicContact CE2-CE2 4Å; Y662-F670 HydrophobicContact CG-CE2 4.12Å; N666-F670 HydrophobicContact CB-CD2 4.43Å; N666-F670 HydrophobicContact CB-CE2 3.87Å; N666-F670 HydrophobicContact CB-CZ 4.37Å; N666-F670 WeakPolarHBondContact O-CD2 3.32Å; N666-F670 PolarHBondContact O-N 3.47Å; N666-F670 VanDerWaalsContact O-N 3.13Å; L667-F670 PolarHBondContact O-N 3.15Å; F670-F672 VanDerWaalsContact C-N 3.32Å; F670-F672 PolarHBondContact O-N 3.4Å; F670-F673 PolarHBondContact O-N 3.46Å; F670-W674 PolarHBondContact O-N 3.03Å; F670-L713 HydrophobicContact CD1-CD1 3.61Å; F670-L713 HydrophobicContact CE1-CD1 3.88Å; F670-I716 HydrophobicContact CZ-CG2 4.41Å; F670-L726 HydrophobicContact CB-CD1 4.41Å; F670-L726 HydrophobicContact CB-CD2 4.06Å
671	S	83.6	Confident	82	Confident	50 Å²	50	34 Å²	34	35%	0.35	20%	0.202	S	C	.	.	H	α-helix	trans	-58.8	-43.8	177.3	-173.9	0	0	0	0	111.6	L667 E668 V669 F673 W674 S675	L667-S671 WeakPolarHBondContact O-CB 3.35Å; L667-S671 PolarHBondContact O-N 2.96Å; E668-S671 PolarHBondContact O-N 2.87Å; V669-S671 VanDerWaalsContact C-N 3.34Å; V669-S671 PolarHBondContact O-N 3.15Å; S671-F673 VanDerWaalsContact C-N 3.33Å; S671-F673 PolarHBondContact O-N 3.47Å; S671-W674 PolarHBondContact O-N 3.47Å; S671-S675 WeakPolarHBondContact O-CB 3.34Å; S671-S675 PolarHBondContact O-N 2.78Å; S671-S675 PolarHBondContact O-OG 3.23Å
672	F	87.3	Confident	82.7	Confident	14 Å²	14	34 Å²	34	6%	0.061	19%	0.188	C	C	.	.	H	α-helix	trans	-59.4	-41.6	179.3	175.9	-97.5	0	0	0	112.8	I627 L630 G631 F635 E668 V669 F670 S675 S676 V677	I627-F672 HydrophobicContact CB-CD1 4.34Å; I627-F672 HydrophobicContact CB-CG 4.49Å; I627-F672 HydrophobicContact CD1-CD1 4.32Å; I627-F672 HydrophobicContact CG1-CD1 3.92Å; I627-F672 HydrophobicContact CG1-CE1 4.17Å; I627-F672 HydrophobicContact CG1-CG 4.49Å; I627-F672 HydrophobicContact CG2-CB 3.67Å; I627-F672 HydrophobicContact CG2-CD1 3.66Å; I627-F672 HydrophobicContact CG2-CD2 3.62Å; I627-F672 HydrophobicContact CG2-CE1 4.14Å; I627-F672 HydrophobicContact CG2-CE2 4.09Å; I627-F672 HydrophobicContact CG2-CG 3.37Å; I627-F672 HydrophobicContact CG2-CZ 4.33Å; L630-F672 HydrophobicContact CB-CZ 4.12Å; L630-F672 HydrophobicContact CD1-CE1 4.5Å; L630-F672 HydrophobicContact CD1-CZ 4.39Å; G631-F672 WeakPolarHBondContact O-CE2 3.35Å; F635-F672 HydrophobicContact CD2-CE1 4.49Å; F635-F672 HydrophobicContact CD2-CZ 4.13Å; F635-F672 AromaticContact CE2-CE1 3.9Å; F635-F672 HydrophobicContact CE2-CE1 3.9Å; F635-F672 AromaticContact CE2-CZ 3.82Å; F635-F672 HydrophobicContact CE2-CZ 3.82Å; E668-F672 PolarHBondContact O-N 2.99Å; V669-F672 PolarHBondContact O-N 2.89Å; F670-F672 VanDerWaalsContact C-N 3.32Å; F670-F672 PolarHBondContact O-N 3.4Å; F672-S675 PolarHBondContact O-OG 2.88Å; F672-S676 WeakPolarHBondContact O-CB 3.46Å; F672-S676 PolarHBondContact O-N 3.02Å; F672-V677 HydrophobicContact CD1-CG2 3.94Å; F672-V677 HydrophobicContact CE1-CG2 3.66Å; F672-V677 HydrophobicContact CZ-CG2 4.48Å; F672-V677 PolarHBondContact O-N 3.38Å
673	F	89.3	Confident	83.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-64.9	-41.4	178.3	-85.8	-86.9	0	0	0	112.6	I627 L653 L654 V657 V669 F670 S671 V677 Y678 F710 L713	I627-F673 HydrophobicContact CD1-CD2 4.46Å; I627-F673 HydrophobicContact CD1-CE2 3.85Å; I627-F673 HydrophobicContact CG1-CE2 4.34Å; L653-F673 HydrophobicContact CD2-CE1 4.49Å; L653-F673 HydrophobicContact CD2-CE2 4.5Å; L653-F673 HydrophobicContact CD2-CZ 3.67Å; L653-F673 HydrophobicContact CG-CZ 3.76Å; L654-F673 HydrophobicContact CD2-CD1 3.33Å; L654-F673 HydrophobicContact CD2-CE1 3.44Å; L654-F673 VanDerWaalsContact CD2-CE1 3.44Å; L654-F673 HydrophobicContact CD2-CG 4.32Å; L654-F673 HydrophobicContact CD2-CZ 4.5Å; L654-F673 HydrophobicContact CG-CD1 4.07Å; L654-F673 HydrophobicContact CG-CE1 3.67Å; V657-F673 HydrophobicContact CB-CE2 4.27Å; V657-F673 HydrophobicContact CG1-CD2 4.12Å; V657-F673 HydrophobicContact CG1-CE2 4.3Å; V657-F673 HydrophobicContact CG2-CD2 4Å; V657-F673 HydrophobicContact CG2-CE2 3.34Å; V657-F673 HydrophobicContact CG2-CZ 3.72Å; V669-F673 WeakPolarHBondContact O-CD2 3.42Å; V669-F673 PolarHBondContact O-N 3.3Å; F670-F673 PolarHBondContact O-N 3.46Å; S671-F673 VanDerWaalsContact C-N 3.33Å; S671-F673 PolarHBondContact O-N 3.47Å; F673-V677 HydrophobicContact CD1-CB 3.8Å; F673-V677 HydrophobicContact CD1-CG1 4.06Å; F673-V677 HydrophobicContact CD1-CG2 3.67Å; F673-V677 HydrophobicContact CE1-CB 4.23Å; F673-V677 HydrophobicContact CE1-CG1 4.14Å; F673-V677 HydrophobicContact CE1-CG2 3.83Å; F673-V677 HydrophobicContact CG-CB 4.5Å; F673-V677 HydrophobicContact CG-CG2 4.16Å; F673-V677 HydrophobicContact CZ-CG2 4.41Å; F673-V677 PolarHBondContact O-N 3.36Å; F673-Y678 WeakPolarHBondContact O-CB 3.48Å; F673-Y678 PolarHBondContact O-N 3.45Å; F673-F710 HydrophobicContact CD1-CE1 4.41Å; F673-L713 HydrophobicContact CB-CD2 3.82Å; F673-L713 HydrophobicContact CG-CD2 4.37Å
674	W	88.2	Confident	84	Confident	6 Å²	6	38.3 Å²	38.3	2%	0.023	20%	0.204	C	C	.	.	I	π-helix	trans	-75.9	-33	178.8	-70.1	114	0	0	0	113.4	F670 S671 Y678 P679 F710 L713 C729 L730 L731 L736	F670-W674 PolarHBondContact O-N 3.03Å; S671-W674 PolarHBondContact O-N 3.47Å; W674-Y678 HydrophobicContact CE3-CD1 4.27Å; W674-Y678 HydrophobicContact CE3-CD2 4.44Å; W674-Y678 AromaticContact CE3-CG 3.98Å; W674-Y678 HydrophobicContact CE3-CG 3.98Å; W674-Y678 HydrophobicContact CZ3-CD1 4.38Å; W674-Y678 AromaticContact CZ3-CD2 3.93Å; W674-Y678 HydrophobicContact CZ3-CD2 3.93Å; W674-Y678 HydrophobicContact CZ3-CE2 4.35Å; W674-Y678 AromaticContact CZ3-CG 3.93Å; W674-Y678 HydrophobicContact CZ3-CG 3.93Å; W674-P679 WeakPolarHBondContact O-CD 3.38Å; W674-F710 HydrophobicContact CH2-CD1 4.2Å; W674-F710 HydrophobicContact CZ3-CD1 4.28Å; W674-L713 HydrophobicContact CZ2-CB 4.24Å; W674-L713 HydrophobicContact CZ2-CD2 4.04Å; W674-L713 HydrophobicContact CZ2-CG 3.94Å; W674-C729 HydrophobicContact CB-CB 4.01Å; W674-L730 HydrophobicContact CZ2-CD1 4.46Å; W674-L731 HydrophobicContact CZ3-CB 4.39Å; W674-L731 HydrophobicContact CZ3-CD1 4.31Å; W674-L736 HydrophobicContact CH2-CD1 3.54Å; W674-L736 HydrophobicContact CZ3-CD1 4.02Å; W674-L736 HydrophobicContact CZ3-CD2 4.43Å
675	S	86	Confident	84.8	Confident	53 Å²	53	31.2 Å²	31.2	37%	0.371	17%	0.17	S	C	.	.	I	π-helix	trans	-85.2	-30.3	-177.5	67.7	0	0	0	0	114.1	S671 F672	S671-S675 WeakPolarHBondContact O-CB 3.34Å; S671-S675 PolarHBondContact O-N 2.78Å; S671-S675 PolarHBondContact O-OG 3.23Å; F672-S675 PolarHBondContact O-OG 2.88Å
676	S	86.6	Confident	85.5	Confident	4 Å²	4	28.9 Å²	28.9	3%	0.028	15%	0.154	C	C	.	.	I	π-helix	trans	-123.3	-46.8	-168.5	-60.5	0	0	0	0	112.9	S632 F672	S632-S676 WeakPolarHBondContact O-CB 3.24Å; S632-S676 PolarHBondContact O-OG 2.87Å; F672-S676 WeakPolarHBondContact O-CB 3.46Å; F672-S676 PolarHBondContact O-N 3.02Å
677	V	90.6	Very high	85.1	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-78.8	-49.3	-174.6	-168.3	0	0	0	0	111.6	F635 W640 V650 F672 F673 A680 F681 F710	F635-V677 HydrophobicContact CD1-CG1 4.45Å; F635-V677 HydrophobicContact CD2-CG2 3.89Å; F635-V677 HydrophobicContact CE1-CG1 4.1Å; F635-V677 HydrophobicContact CE2-CG2 3.56Å; F635-V677 HydrophobicContact CZ-CG1 4.16Å; F635-V677 HydrophobicContact CZ-CG2 3.9Å; W640-V677 HydrophobicContact CH2-CG1 4.39Å; W640-V677 HydrophobicContact CZ3-CG1 4.14Å; V650-V677 HydrophobicContact CG1-CG1 4.28Å; F672-V677 HydrophobicContact CD1-CG2 3.94Å; F672-V677 HydrophobicContact CE1-CG2 3.66Å; F672-V677 HydrophobicContact CZ-CG2 4.48Å; F672-V677 PolarHBondContact O-N 3.38Å; F673-V677 HydrophobicContact CD1-CB 3.8Å; F673-V677 HydrophobicContact CD1-CG1 4.06Å; F673-V677 HydrophobicContact CD1-CG2 3.67Å; F673-V677 HydrophobicContact CE1-CB 4.23Å; F673-V677 HydrophobicContact CE1-CG1 4.14Å; F673-V677 HydrophobicContact CE1-CG2 3.83Å; F673-V677 HydrophobicContact CG-CB 4.5Å; F673-V677 HydrophobicContact CG-CG2 4.16Å; F673-V677 HydrophobicContact CZ-CG2 4.41Å; F673-V677 PolarHBondContact O-N 3.36Å; V677-A680 PolarHBondContact O-N 2.95Å; V677-F681 WeakPolarHBondContact O-CB 3.3Å; V677-F681 PolarHBondContact O-N 3.47Å; V677-F710 HydrophobicContact CB-CZ 4.26Å; V677-F710 HydrophobicContact CG1-CZ 3.94Å
678	Y	90.3	Very high	84.4	Confident	12 Å²	12	34.5 Å²	34.5	5%	0.047	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-44.9	-178	173.7	-95.7	0	0	0	113.2	F673 W674 A680 F681 K682 F710 L731 L736 L739 F740	F673-Y678 WeakPolarHBondContact O-CB 3.48Å; F673-Y678 PolarHBondContact O-N 3.45Å; W674-Y678 HydrophobicContact CE3-CD1 4.27Å; W674-Y678 HydrophobicContact CE3-CD2 4.44Å; W674-Y678 AromaticContact CE3-CG 3.98Å; W674-Y678 HydrophobicContact CE3-CG 3.98Å; W674-Y678 HydrophobicContact CZ3-CD1 4.38Å; W674-Y678 AromaticContact CZ3-CD2 3.93Å; W674-Y678 HydrophobicContact CZ3-CD2 3.93Å; W674-Y678 HydrophobicContact CZ3-CE2 4.35Å; W674-Y678 AromaticContact CZ3-CG 3.93Å; W674-Y678 HydrophobicContact CZ3-CG 3.93Å; Y678-A680 VanDerWaalsContact C-N 3.32Å; Y678-A680 PolarHBondContact O-N 3.32Å; Y678-F681 WeakPolarHBondContact O-CB 3.42Å; Y678-F681 PolarHBondContact O-N 2.8Å; Y678-K682 HydrophobicContact CE1-CB 4.37Å; Y678-K682 HydrophobicContact CE1-CD 4.06Å; Y678-K682 VanDerWaalsContact O-CB 3.31Å; Y678-K682 WeakPolarHBondContact O-CB 3.31Å; Y678-K682 PolarHBondContact O-N 3.46Å; Y678-F710 AromaticContact CD2-CD1 4Å; Y678-F710 HydrophobicContact CD2-CD1 4Å; Y678-F710 HydrophobicContact CD2-CD2 4.37Å; Y678-F710 HydrophobicContact CD2-CE1 4.17Å; Y678-F710 HydrophobicContact CD2-CG 4.12Å; Y678-F710 HydrophobicContact CD2-CZ 4.41Å; Y678-F710 HydrophobicContact CG-CE1 4.4Å; Y678-L731 HydrophobicContact CD1-CD1 4.01Å; Y678-L731 HydrophobicContact CE1-CD1 3.2Å; Y678-L731 HydrophobicContact CE2-CD1 4.25Å; Y678-L731 VanDerWaalsContact OH-CD1 3.3Å; Y678-L731 WeakPolarHBondContact OH-CD1 2.97Å; Y678-L736 HydrophobicContact CD2-CD2 4.45Å; Y678-L736 HydrophobicContact CE2-CD2 3.45Å; Y678-L736 VanDerWaalsContact CE2-CD2 3.45Å; Y678-L736 WeakPolarHBondContact OH-CD2 3.36Å; Y678-L739 WeakPolarHBondContact OH-CD2 3.5Å; Y678-F740 HydrophobicContact CE2-CZ 4.26Å
679	P	88.2	Confident	83.1	Confident	53 Å²	53	35.5 Å²	35.5	34%	0.344	20%	0.195	S	C	.	.	H	α-helix	trans	-62.2	-39.4	177.7	-25.9	37.9	0	0	0	112.7	W674 K683	W674-P679 WeakPolarHBondContact O-CD 3.38Å; P679-K683 WeakPolarHBondContact O-CB 3.35Å; P679-K683 PolarHBondContact O-N 2.85Å
680	A	86.9	Confident	81.3	Confident	9 Å²	9	39.6 Å²	39.6	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-66	-43.2	174.7	0	0	0	0	0	111.7	F635 W640 V677 Y678 K683 A684	F635-A680 HydrophobicContact CB-CB 3.73Å; W640-A680 HydrophobicContact CE3-CB 3.94Å; W640-A680 HydrophobicContact CZ3-CB 4.42Å; V677-A680 PolarHBondContact O-N 2.95Å; Y678-A680 VanDerWaalsContact C-N 3.32Å; Y678-A680 PolarHBondContact O-N 3.32Å; A680-K683 PolarHBondContact O-N 2.71Å; A680-A684 WeakPolarHBondContact O-CB 3.3Å; A680-A684 PolarHBondContact O-N 2.93Å
681	F	90.1	Very high	79.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-51.6	174.5	177.8	-117.5	0	0	0	111.1	W640 V677 Y678 K683 A684 I685 L703 I706 A707 F710 F740 F750	W640-F681 VanDerWaalsContact CE3-CA 3.44Å; W640-F681 HydrophobicContact CE3-CB 4.03Å; W640-F681 VanDerWaalsContact CE3-N 3.31Å; W640-F681 HydrophobicContact CH2-CB 3.59Å; W640-F681 AromaticContact CH2-CD2 3.56Å; W640-F681 HydrophobicContact CH2-CD2 3.56Å; W640-F681 AromaticContact CH2-CG 3.97Å; W640-F681 HydrophobicContact CH2-CG 3.97Å; W640-F681 HydrophobicContact CZ2-CB 4.32Å; W640-F681 AromaticContact CZ2-CD2 3.49Å; W640-F681 HydrophobicContact CZ2-CD2 3.49Å; W640-F681 VanDerWaalsContact CZ2-CD2 3.49Å; W640-F681 HydrophobicContact CZ2-CE2 4.27Å; W640-F681 HydrophobicContact CZ2-CG 4.34Å; W640-F681 VanDerWaalsContact CZ3-CA 3.42Å; W640-F681 HydrophobicContact CZ3-CB 3.44Å; W640-F681 VanDerWaalsContact CZ3-CB 3.44Å; W640-F681 HydrophobicContact CZ3-CD2 4.2Å; W640-F681 HydrophobicContact CZ3-CG 4.3Å; V677-F681 WeakPolarHBondContact O-CB 3.3Å; V677-F681 PolarHBondContact O-N 3.47Å; Y678-F681 WeakPolarHBondContact O-CB 3.42Å; Y678-F681 PolarHBondContact O-N 2.8Å; F681-K683 VanDerWaalsContact C-N 3.32Å; F681-K683 PolarHBondContact O-N 3.48Å; F681-A684 WeakPolarHBondContact O-CA 3.05Å; F681-A684 WeakPolarHBondContact O-CB 3.49Å; F681-A684 PolarHBondContact O-N 3.46Å; F681-I685 HydrophobicContact CD1-CD1 4.34Å; F681-I685 HydrophobicContact CD2-CG2 4.21Å; F681-I685 HydrophobicContact CE1-CD1 3.87Å; F681-I685 HydrophobicContact CE1-CG2 4.48Å; F681-I685 HydrophobicContact CE2-CG2 3.69Å; F681-I685 HydrophobicContact CZ-CD1 4.21Å; F681-I685 HydrophobicContact CZ-CG2 3.85Å; F681-I685 WeakPolarHBondContact O-CG1 3.49Å; F681-I685 PolarHBondContact O-N 3.36Å; F681-L703 HydrophobicContact CE2-CB 4.36Å; F681-L703 HydrophobicContact CE2-CD2 3.95Å; F681-I706 HydrophobicContact CD1-CG2 4.42Å; F681-I706 HydrophobicContact CD2-CG2 3.78Å; F681-I706 HydrophobicContact CE1-CG2 4.21Å; F681-I706 HydrophobicContact CE2-CB 4.12Å; F681-I706 HydrophobicContact CE2-CG2 3.52Å; F681-I706 HydrophobicContact CG-CG2 4.21Å; F681-I706 HydrophobicContact CZ-CB 4.28Å; F681-I706 HydrophobicContact CZ-CG2 3.75Å; F681-A707 HydrophobicContact CE1-CB 4.09Å; F681-A707 HydrophobicContact CZ-CB 4.03Å; F681-F710 HydrophobicContact CB-CE2 4.02Å; F681-F710 AromaticContact CD1-CD2 3.79Å; F681-F710 HydrophobicContact CD1-CD2 3.79Å; F681-F710 AromaticContact CD1-CE2 3.69Å; F681-F710 HydrophobicContact CD1-CE2 3.69Å; F681-F710 HydrophobicContact CE1-CD2 4.05Å; F681-F710 HydrophobicContact CE1-CE2 4.33Å; F681-F710 HydrophobicContact CG-CD2 4.42Å; F681-F710 AromaticContact CG-CE2 3.89Å; F681-F710 HydrophobicContact CG-CE2 3.89Å; F681-F740 AromaticContact CE1-CE1 3.97Å; F681-F740 HydrophobicContact CE1-CE1 3.97Å; F681-F740 HydrophobicContact CE1-CZ 4.08Å; F681-F750 HydrophobicContact CE1-CZ 4.42Å; F681-F750 HydrophobicContact CZ-CE2 4.24Å; F681-F750 AromaticContact CZ-CZ 3.83Å; F681-F750 HydrophobicContact CZ-CZ 3.83Å
682	K	88.2	Confident	77.5	Confident	80 Å²	80	51.2 Å²	51.2	35%	0.348	27%	0.274	S	S	.	.	H	α-helix	trans	-54.2	-49.1	177.5	-175.7	179.1	-179.3	178.1	0	110.3	Y678 A684 I685 S686 L739	Y678-K682 HydrophobicContact CE1-CB 4.37Å; Y678-K682 HydrophobicContact CE1-CD 4.06Å; Y678-K682 VanDerWaalsContact O-CB 3.31Å; Y678-K682 WeakPolarHBondContact O-CB 3.31Å; Y678-K682 PolarHBondContact O-N 3.46Å; K682-A684 PolarHBondContact O-N 2.9Å; K682-I685 WeakPolarHBondContact O-CG1 3.12Å; K682-I685 PolarHBondContact O-N 3.47Å; K682-S686 WeakPolarHBondContact O-CB 3.24Å; K682-S686 PolarHBondContact O-N 3.11Å; K682-S686 PolarHBondContact O-OG 3.07Å; K682-L739 HydrophobicContact CD-CD2 4.29Å; K682-L739 HydrophobicContact CG-CD2 4.44Å
683	K	83.3	Confident	75.9	Confident	150 Å²	150	54.1 Å²	54.1	65%	0.652	30%	0.301	S	S	*	.	H	α-helix	trans	-61.1	-29.3	176.7	-171.8	177.8	-179.9	179.9	0	113.4	P679 A680 F681 Q688	P679-K683 WeakPolarHBondContact O-CB 3.35Å; P679-K683 PolarHBondContact O-N 2.85Å; A680-K683 PolarHBondContact O-N 2.71Å; F681-K683 VanDerWaalsContact C-N 3.32Å; F681-K683 PolarHBondContact O-N 3.48Å; K683-Q688 PolarHBondContact O-NE2 2.87Å
684	A	82.9	Confident	74.5	Confident	8 Å²	8	57.6 Å²	57.6	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-74.3	-44.1	178	0	0	0	0	0	112.6	W640 F642 A680 F681 K682	W640-A684 HydrophobicContact CB-CB 3.37Å; W640-A684 HydrophobicContact CD2-CB 3.91Å; W640-A684 HydrophobicContact CG-CB 3.29Å; F642-A684 WeakPolarHBondContact CZ-O 3.43Å; A680-A684 WeakPolarHBondContact O-CB 3.3Å; A680-A684 PolarHBondContact O-N 2.93Å; F681-A684 WeakPolarHBondContact O-CA 3.05Å; F681-A684 WeakPolarHBondContact O-CB 3.49Å; F681-A684 PolarHBondContact O-N 3.46Å; K682-A684 PolarHBondContact O-N 2.9Å
685	I	85.2	Confident	73.6	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-82.8	-16.4	178.1	61.6	161	0	0	0	112.3	F681 K682 F740 I746 D747 F750	F681-I685 HydrophobicContact CD1-CD1 4.34Å; F681-I685 HydrophobicContact CD2-CG2 4.21Å; F681-I685 HydrophobicContact CE1-CD1 3.87Å; F681-I685 HydrophobicContact CE1-CG2 4.48Å; F681-I685 HydrophobicContact CE2-CG2 3.69Å; F681-I685 HydrophobicContact CZ-CD1 4.21Å; F681-I685 HydrophobicContact CZ-CG2 3.85Å; F681-I685 WeakPolarHBondContact O-CG1 3.49Å; F681-I685 PolarHBondContact O-N 3.36Å; K682-I685 WeakPolarHBondContact O-CG1 3.12Å; K682-I685 PolarHBondContact O-N 3.47Å; I685-F740 HydrophobicContact CD1-CD1 3.95Å; I685-F740 HydrophobicContact CD1-CE1 3.74Å; I685-I746 HydrophobicContact CB-CG2 4.38Å; I685-I746 HydrophobicContact CD1-CD1 3.78Å; I685-I746 HydrophobicContact CD1-CG2 4.24Å; I685-I746 HydrophobicContact CG1-CD1 3.89Å; I685-D747 PolarHBondContact O-N 3.44Å; I685-F750 HydrophobicContact CB-CD1 4.4Å; I685-F750 HydrophobicContact CB-CE1 4.21Å; I685-F750 HydrophobicContact CB-CZ 4.27Å; I685-F750 HydrophobicContact CD1-CD1 4.29Å; I685-F750 HydrophobicContact CD1-CE1 3.47Å; I685-F750 VanDerWaalsContact CD1-CE1 3.47Å; I685-F750 HydrophobicContact CD1-CZ 3.75Å; I685-F750 HydrophobicContact CG1-CE1 4.43Å; I685-F750 HydrophobicContact CG2-CD2 4.16Å; I685-F750 HydrophobicContact CG2-CE1 4.25Å; I685-F750 HydrophobicContact CG2-CE2 3.83Å; I685-F750 HydrophobicContact CG2-CG 4.5Å; I685-F750 HydrophobicContact CG2-CZ 3.8Å
686	S	82.1	Confident	72.8	Confident	29 Å²	29	58.4 Å²	58.4	20%	0.203	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-69	145.3	174.7	-76.7	0	0	0	0	111.7	K682 Q688 S745	K682-S686 WeakPolarHBondContact O-CB 3.24Å; K682-S686 PolarHBondContact O-N 3.11Å; K682-S686 PolarHBondContact O-OG 3.07Å; S686-Q688 PolarHBondContact O-N 2.81Å; S686-S745 CarbonylContact C-O 3.48Å; S686-S745 VanDerWaalsContact CA-O 3.24Å; S686-S745 WeakPolarHBondContact CA-O 3.38Å
687	R	69.5	Low	71.9	Confident	65 Å²	65	60.4 Å²	60.4	25%	0.245	34%	0.339	C	S	.	.			trans	-63.2	123.3	176.7	-58	-178	84.7	-138.8	-3	109.6	P744 S745 I746 G890	R687-P744 WeakPolarHBondContact CD-O 3.34Å; R687-S745 PolarHBondContact N-O 3.48Å; R687-I746 VanDerWaalsContact CD-O 3.32Å; R687-I746 WeakPolarHBondContact CD-O 3.48Å; R687-I746 VanDerWaalsContact CG-C 3.46Å; R687-I746 VanDerWaalsContact CG-O 3.3Å; R687-I746 WeakPolarHBondContact CG-O 3.45Å; R687-G890 PolarHBondContact NH1-O 2.85Å; R687-G890 PolarHBondContact NH2-O 3.44Å
688	Q	63	Low	71.1	Confident	84 Å²	84	66 Å²	66	39%	0.393	37%	0.369	S	S	.	.			trans	-100.9	105.2	173.8	-64.4	-175.9	14.2	0	0	108.1	K683 S686 A690 K691	K683-Q688 PolarHBondContact O-NE2 2.87Å; S686-Q688 PolarHBondContact O-N 2.81Å; Q688-A690 PolarHBondContact O-N 3.34Å; Q688-K691 HydrophobicContact CB-CB 4.29Å; Q688-K691 PolarHBondContact O-N 3.25Å; Q688-K691 VanDerWaalsContact O-N 3.09Å
689	S	53.3	Low	70.8	Confident	128 Å²	128	65.4 Å²	65.4	90%	0.895	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-22.9	-178.5	54.4	0	0	0	0	114.3
690	A	46.9	Very low	70.5	Confident	87 Å²	87	63.6 Å²	63.6	72%	0.719	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-4.5	-176.4	0	0	0	0	0	115.5	Q688	Q688-A690 PolarHBondContact O-N 3.34Å
691	K	45	Very low	70.3	Confident	149 Å²	149	66 Å²	66	65%	0.648	37%	0.37	S	S	*	.			trans	-132.5	101.1	-175.1	-72.7	-172.8	-177.2	174.8	0	111.9	Q688 A693	Q688-K691 HydrophobicContact CB-CB 4.29Å; Q688-K691 PolarHBondContact O-N 3.25Å; Q688-K691 VanDerWaalsContact O-N 3.09Å; K691-A693 PolarHBondContact O-N 3.1Å; K691-A693 VanDerWaalsContact O-N 3.11Å
692	F	44.4	Very low	70.2	Confident	145 Å²	145	66.7 Å²	66.7	64%	0.636	37%	0.374	S	S	*	.			trans	-71.6	10.6	175.7	-69.7	-82.4	0	0	0	115.1	P694 H895	F692-P694 WeakPolarHBondContact O-CD 3.31Å; F692-H895 AromaticContact CE1-ND1 3.59Å
693	A	53.3	Low	70.3	Confident	75 Å²	75	62.9 Å²	62.9	62%	0.62	36%	0.357	S	S	*	.			trans	-75	111.7	-176.6	0	0	0	0	0	109.4	K691	K691-A693 PolarHBondContact O-N 3.1Å; K691-A693 VanDerWaalsContact O-N 3.11Å
694	P	59.6	Low	70.6	Confident	73 Å²	73	56 Å²	56	47%	0.474	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-65.2	149.2	-177.2	26	-33.3	0	0	0	111.7	F692 P696 T897	F692-P694 WeakPolarHBondContact O-CD 3.31Å; P694-P696 WeakPolarHBondContact O-CD 3.37Å; P694-T897 HydrophobicContact CB-CG2 4.08Å; P694-T897 WeakPolarHBondContact CB-OG1 3.16Å; P694-T897 HydrophobicContact CG-CG2 4.32Å
695	I	69.7	Low	70.9	Confident	13 Å²	13	60.9 Å²	60.9	7%	0.067	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-66.1	122.2	167.1	-57.2	178	0	0	0	107.8	F642 V697 L699 L700 L703 D747	F642-I695 HydrophobicContact CE1-CD1 4.38Å; F642-I695 HydrophobicContact CE1-CG1 3.98Å; F642-I695 HydrophobicContact CE1-CG2 4.45Å; F642-I695 HydrophobicContact CZ-CG1 4.13Å; I695-V697 PolarHBondContact O-N 3.41Å; I695-L699 HydrophobicContact CG2-CB 4.34Å; I695-L699 HydrophobicContact CG2-CD2 4.41Å; I695-L700 HydrophobicContact CB-CD2 3.95Å; I695-L700 HydrophobicContact CB-CG 4.42Å; I695-L700 HydrophobicContact CD1-CD2 4.32Å; I695-L700 HydrophobicContact CG2-CD2 3.65Å; I695-L700 HydrophobicContact CG2-CG 3.94Å; I695-L703 HydrophobicContact CD1-CD1 4.25Å; I695-L703 HydrophobicContact CG2-CD1 3.53Å; I695-D747 HydrophobicContact CD1-CB 3.99Å
696	P	69.2	Low	71.2	Confident	62 Å²	62	60.9 Å²	60.9	40%	0.403	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-58.2	137.4	179.2	-22.9	32.6	0	0	0	111.6	P694 N698 L699 L700	P694-P696 WeakPolarHBondContact O-CD 3.37Å; P696-N698 VanDerWaalsContact C-N 3.27Å; P696-N698 PolarHBondContact O-N 2.67Å; P696-L699 HydrophobicContact CB-CB 4.26Å; P696-L699 WeakPolarHBondContact O-CA 3.32Å; P696-L699 VanDerWaalsContact O-CB 3.25Å; P696-L699 WeakPolarHBondContact O-CB 3.25Å; P696-L699 PolarHBondContact O-N 2.95Å; P696-L700 PolarHBondContact O-N 3.1Å
697	V	68.2	Low	71.6	Confident	47 Å²	47	59.5 Å²	59.5	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-55.2	-41.8	-176.1	179.2	0	0	0	0	112.3	I695 L699 L700 F901	I695-V697 PolarHBondContact O-N 3.41Å; V697-L699 PolarHBondContact O-N 3.05Å; V697-L700 PolarHBondContact O-N 2.85Å; V697-F901 HydrophobicContact CG1-CD2 4.17Å
698	N	74.4	Confident	72.6	Confident	116 Å²	116	58 Å²	58	62%	0.62	33%	0.334	S	S	*	.	H	α-helix	trans	-59.6	-30.7	178	-61.7	-1.9	0	0	0	111.8	P696 S701	P696-N698 VanDerWaalsContact C-N 3.27Å; P696-N698 PolarHBondContact O-N 2.67Å; N698-S701 PolarHBondContact O-OG 3.3Å
699	L	82.3	Confident	74	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-83.4	-29.4	-177.7	-154.4	75.2	0	0	0	113.1	F642 I644 N647 I695 P696 V697 S701 I702 L703	F642-L699 HydrophobicContact CB-CD2 3.7Å; F642-L699 HydrophobicContact CD1-CD2 3.51Å; F642-L699 HydrophobicContact CG-CD2 4.08Å; I644-L699 HydrophobicContact CG1-CD1 4.1Å; N647-L699 HydrophobicContact CB-CD1 3.98Å; I695-L699 HydrophobicContact CG2-CB 4.34Å; I695-L699 HydrophobicContact CG2-CD2 4.41Å; P696-L699 HydrophobicContact CB-CB 4.26Å; P696-L699 WeakPolarHBondContact O-CA 3.32Å; P696-L699 VanDerWaalsContact O-CB 3.25Å; P696-L699 WeakPolarHBondContact O-CB 3.25Å; P696-L699 PolarHBondContact O-N 2.95Å; V697-L699 PolarHBondContact O-N 3.05Å; L699-S701 PolarHBondContact O-N 3.39Å; L699-I702 HydrophobicContact CD1-CD1 4.42Å; L699-I702 PolarHBondContact O-N 2.82Å; L699-L703 HydrophobicContact CD2-CD1 4.15Å; L699-L703 HydrophobicContact CD2-CG 4.45Å; L699-L703 HydrophobicContact CG-CD1 4.26Å; L699-L703 HydrophobicContact CG-CG 4.2Å; L699-L703 WeakPolarHBondContact O-CG 3.48Å; L699-L703 PolarHBondContact O-N 3.25Å
700	L	83.1	Confident	75.8	Confident	14 Å²	14	49.2 Å²	49.2	7%	0.073	28%	0.278	C	S	.	.	H	α-helix	trans	-55.3	-38.4	178.3	-73.1	171.7	0	0	0	112.1	I695 P696 V697 I702 L703 S704 F750 S753	I695-L700 HydrophobicContact CB-CD2 3.95Å; I695-L700 HydrophobicContact CB-CG 4.42Å; I695-L700 HydrophobicContact CD1-CD2 4.32Å; I695-L700 HydrophobicContact CG2-CD2 3.65Å; I695-L700 HydrophobicContact CG2-CG 3.94Å; P696-L700 PolarHBondContact O-N 3.1Å; V697-L700 PolarHBondContact O-N 2.85Å; L700-I702 VanDerWaalsContact C-N 3.3Å; L700-I702 PolarHBondContact O-N 2.95Å; L700-L703 PolarHBondContact O-N 2.65Å; L700-S704 WeakPolarHBondContact O-CB 3.45Å; L700-S704 PolarHBondContact O-N 2.7Å; L700-S704 PolarHBondContact O-OG 3.48Å; L700-F750 HydrophobicContact CD2-CB 4.25Å; L700-S753 PolarHBondContact O-OG 2.79Å
701	S	82.8	Confident	77.9	Confident	59 Å²	59	45.1 Å²	45.1	41%	0.413	24%	0.244	S	C	.	.	H	α-helix	trans	-63.5	-34	176.5	74.8	0	0	0	0	113.3	N698 L699 S704 K705	N698-S701 PolarHBondContact O-OG 3.3Å; L699-S701 PolarHBondContact O-N 3.39Å; S701-S704 WeakPolarHBondContact CA-OG 3.36Å; S701-S704 PolarHBondContact O-OG 2.99Å; S701-K705 WeakPolarHBondContact O-CG 3.37Å; S701-K705 PolarHBondContact O-N 3.25Å
702	I	88.1	Confident	80	Confident	16 Å²	16	41.4 Å²	41.4	8%	0.082	23%	0.226	C	C	.	.	H	α-helix	trans	-80.5	-44.4	179.7	-59.3	169.5	0	0	0	109.5	I644 N647 E648 L651 L699 L700 S704 K705 I706	I644-I702 HydrophobicContact CG2-CD1 4.04Å; N647-I702 HydrophobicContact CB-CB 4.45Å; N647-I702 HydrophobicContact CB-CG2 3.66Å; E648-I702 HydrophobicContact CG-CD1 4.01Å; L651-I702 HydrophobicContact CB-CG2 4.43Å; L651-I702 HydrophobicContact CD2-CG2 4.18Å; L699-I702 HydrophobicContact CD1-CD1 4.42Å; L699-I702 PolarHBondContact O-N 2.82Å; L700-I702 VanDerWaalsContact C-N 3.3Å; L700-I702 PolarHBondContact O-N 2.95Å; I702-S704 VanDerWaalsContact C-N 3.31Å; I702-S704 PolarHBondContact O-N 3.08Å; I702-K705 WeakPolarHBondContact O-CB 3.35Å; I702-K705 PolarHBondContact O-N 3.36Å; I702-K705 VanDerWaalsContact O-N 3.16Å; I702-I706 HydrophobicContact CG2-CD1 4.22Å; I702-I706 WeakPolarHBondContact O-CG1 3.14Å; I702-I706 PolarHBondContact O-N 2.9Å
703	L	89.9	Confident	82	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-37.6	178.1	-62.4	172.5	0	0	0	111.9	W640 F642 N647 F681 I695 L699 L700 I706 A707 F750	W640-L703 HydrophobicContact CZ2-CD2 4.45Å; F642-L703 HydrophobicContact CE1-CD1 4.42Å; N647-L703 WeakPolarHBondContact OD1-CD2 3.49Å; F681-L703 HydrophobicContact CE2-CB 4.36Å; F681-L703 HydrophobicContact CE2-CD2 3.95Å; I695-L703 HydrophobicContact CD1-CD1 4.25Å; I695-L703 HydrophobicContact CG2-CD1 3.53Å; L699-L703 HydrophobicContact CD2-CD1 4.15Å; L699-L703 HydrophobicContact CD2-CG 4.45Å; L699-L703 HydrophobicContact CG-CD1 4.26Å; L699-L703 HydrophobicContact CG-CG 4.2Å; L699-L703 WeakPolarHBondContact O-CG 3.48Å; L699-L703 PolarHBondContact O-N 3.25Å; L700-L703 PolarHBondContact O-N 2.65Å; L703-I706 HydrophobicContact CD2-CD1 4.4Å; L703-I706 WeakPolarHBondContact O-CB 3.42Å; L703-I706 PolarHBondContact O-N 2.92Å; L703-A707 PolarHBondContact O-N 3.23Å; L703-F750 HydrophobicContact CB-CD2 4.13Å; L703-F750 HydrophobicContact CB-CE2 3.68Å
704	S	88.7	Confident	83.7	Confident	5 Å²	5	31 Å²	31	4%	0.035	17%	0.166	C	C	.	.	H	α-helix	trans	-65.2	-38.1	174.8	49.8	0	0	0	0	112.1	L700 S701 I702 A707 L708 S753	L700-S704 WeakPolarHBondContact O-CB 3.45Å; L700-S704 PolarHBondContact O-N 2.7Å; L700-S704 PolarHBondContact O-OG 3.48Å; S701-S704 WeakPolarHBondContact CA-OG 3.36Å; S701-S704 PolarHBondContact O-OG 2.99Å; I702-S704 VanDerWaalsContact C-N 3.31Å; I702-S704 PolarHBondContact O-N 3.08Å; S704-A707 PolarHBondContact O-N 2.92Å; S704-L708 WeakPolarHBondContact O-CG 3.01Å; S704-L708 PolarHBondContact O-N 3.07Å; S704-S753 PolarHBondContact OG-OG 3.11Å
705	K	89.4	Confident	84.9	Confident	111 Å²	111	29.2 Å²	29.2	48%	0.483	15%	0.153	S	C	.	.	H	α-helix	trans	-63.7	-41.9	169.8	-70.3	175.6	-178.8	-178.9	0	112.3	L651 S701 I702 A707 L708 Y709	L651-K705 HydrophobicContact CD1-CB 3.78Å; L651-K705 HydrophobicContact CD2-CB 4.16Å; L651-K705 HydrophobicContact CD2-CD 4.09Å; S701-K705 WeakPolarHBondContact O-CG 3.37Å; S701-K705 PolarHBondContact O-N 3.25Å; I702-K705 WeakPolarHBondContact O-CB 3.35Å; I702-K705 PolarHBondContact O-N 3.36Å; I702-K705 VanDerWaalsContact O-N 3.16Å; K705-A707 VanDerWaalsContact C-N 3.31Å; K705-A707 PolarHBondContact O-N 3.38Å; K705-L708 WeakPolarHBondContact O-CB 3.26Å; K705-L708 PolarHBondContact O-N 3.49Å; K705-Y709 VanDerWaalsContact O-CD2 3.22Å; K705-Y709 WeakPolarHBondContact O-CD2 3.49Å; K705-Y709 PolarHBondContact O-N 2.59Å
706	I	91.8	Very high	85.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.2	-44.4	175.1	-71.7	172.6	0	0	0	110.8	W640 N647 V650 L651 L654 F681 I702 L703 L708 Y709 F710	W640-I706 HydrophobicContact CZ2-CD1 4.12Å; N647-I706 HydrophobicContact CB-CD1 4.25Å; V650-I706 HydrophobicContact CB-CD1 4.46Å; V650-I706 HydrophobicContact CG1-CD1 4.27Å; L651-I706 HydrophobicContact CB-CD1 4.49Å; L651-I706 HydrophobicContact CB-CG1 4.03Å; L651-I706 HydrophobicContact CD1-CG1 3.98Å; L654-I706 HydrophobicContact CD1-CB 4.29Å; L654-I706 HydrophobicContact CD1-CG1 4.33Å; L654-I706 HydrophobicContact CD1-CG2 3.64Å; F681-I706 HydrophobicContact CD1-CG2 4.42Å; F681-I706 HydrophobicContact CD2-CG2 3.78Å; F681-I706 HydrophobicContact CE1-CG2 4.21Å; F681-I706 HydrophobicContact CE2-CB 4.12Å; F681-I706 HydrophobicContact CE2-CG2 3.52Å; F681-I706 HydrophobicContact CG-CG2 4.21Å; F681-I706 HydrophobicContact CZ-CB 4.28Å; F681-I706 HydrophobicContact CZ-CG2 3.75Å; I702-I706 HydrophobicContact CG2-CD1 4.22Å; I702-I706 WeakPolarHBondContact O-CG1 3.14Å; I702-I706 PolarHBondContact O-N 2.9Å; L703-I706 HydrophobicContact CD2-CD1 4.4Å; L703-I706 WeakPolarHBondContact O-CB 3.42Å; L703-I706 PolarHBondContact O-N 2.92Å; I706-L708 PolarHBondContact O-N 3.32Å; I706-Y709 PolarHBondContact O-N 3.43Å; I706-F710 HydrophobicContact CG2-CD2 3.92Å; I706-F710 HydrophobicContact CG2-CE2 3.71Å; I706-F710 WeakPolarHBondContact O-CD2 3.48Å; I706-F710 PolarHBondContact O-N 3.09Å
707	A	91.6	Very high	86	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-40.3	176.2	0	0	0	0	0	113.2	F681 L703 S704 K705 Y709 F710 L711 F740 F750 I754	F681-A707 HydrophobicContact CE1-CB 4.09Å; F681-A707 HydrophobicContact CZ-CB 4.03Å; L703-A707 PolarHBondContact O-N 3.23Å; S704-A707 PolarHBondContact O-N 2.92Å; K705-A707 VanDerWaalsContact C-N 3.31Å; K705-A707 PolarHBondContact O-N 3.38Å; A707-Y709 VanDerWaalsContact C-N 3.31Å; A707-Y709 PolarHBondContact O-N 3.49Å; A707-F710 PolarHBondContact O-N 3.29Å; A707-L711 PolarHBondContact O-N 2.56Å; A707-F740 HydrophobicContact CB-CD1 4.46Å; A707-F740 HydrophobicContact CB-CD2 3.98Å; A707-F740 HydrophobicContact CB-CE1 4.3Å; A707-F740 HydrophobicContact CB-CE2 3.8Å; A707-F740 HydrophobicContact CB-CG 4.32Å; A707-F740 HydrophobicContact CB-CZ 3.98Å; A707-F750 HydrophobicContact CB-CZ 3.94Å; A707-I754 HydrophobicContact CB-CD1 3.44Å; A707-I754 VanDerWaalsContact CB-CD1 3.44Å; A707-I754 HydrophobicContact CB-CG1 4.38Å
708	L	90.1	Very high	86.4	Confident	32 Å²	32	26.1 Å²	26.1	17%	0.168	13%	0.131	C	C	.	.	H	α-helix	trans	-57.5	-43.9	171.9	-78.8	162.4	0	0	0	111.6	S704 K705 I706 L711 R712 A757 F758	S704-L708 WeakPolarHBondContact O-CG 3.01Å; S704-L708 PolarHBondContact O-N 3.07Å; K705-L708 WeakPolarHBondContact O-CB 3.26Å; K705-L708 PolarHBondContact O-N 3.49Å; I706-L708 PolarHBondContact O-N 3.32Å; L708-L711 WeakPolarHBondContact O-CB 3.41Å; L708-L711 PolarHBondContact O-N 3.08Å; L708-R712 WeakPolarHBondContact O-CG 3.47Å; L708-R712 PolarHBondContact O-N 2.94Å; L708-A757 HydrophobicContact CD1-CB 3.87Å; L708-F758 HydrophobicContact CD2-CD1 3.43Å; L708-F758 VanDerWaalsContact CD2-CD1 3.43Å; L708-F758 HydrophobicContact CD2-CE1 3.24Å; L708-F758 HydrophobicContact CD2-CZ 4.38Å; L708-F758 HydrophobicContact CG-CD1 4.43Å; L708-F758 HydrophobicContact CG-CE1 4.05Å
709	Y	91.3	Very high	86.2	Confident	28 Å²	28	24.1 Å²	24.1	11%	0.11	13%	0.126	C	C	.	.	H	α-helix	trans	-66.7	-34.5	176.2	-81.5	-72.7	0	0	0	112.9	L651 L654 E655 C658 K705 I706 A707 L711 R712 L713	L651-Y709 HydrophobicContact CD1-CD2 3.39Å; L651-Y709 HydrophobicContact CD1-CE2 3.53Å; L654-Y709 HydrophobicContact CB-CG 4.43Å; E655-Y709 HydrophobicContact CB-CE1 3.82Å; E655-Y709 HydrophobicContact CB-CE2 4.25Å; E655-Y709 HydrophobicContact CG-CE1 3.98Å; E655-Y709 VanDerWaalsContact CG-OH 3.28Å; E655-Y709 WeakPolarHBondContact CG-OH 3.36Å; E655-Y709 PolarHBondContact OE1-OH 3.44Å; E655-Y709 PolarHBondContact OE2-OH 2.94Å; C658-Y709 HydrophobicContact CB-CD1 3.96Å; C658-Y709 HydrophobicContact CB-CE1 4.32Å; K705-Y709 VanDerWaalsContact O-CD2 3.22Å; K705-Y709 WeakPolarHBondContact O-CD2 3.49Å; K705-Y709 PolarHBondContact O-N 2.59Å; I706-Y709 PolarHBondContact O-N 3.43Å; A707-Y709 VanDerWaalsContact C-N 3.31Å; A707-Y709 PolarHBondContact O-N 3.49Å; Y709-L711 VanDerWaalsContact C-N 3.3Å; Y709-L711 PolarHBondContact O-N 3.42Å; Y709-R712 PolarHBondContact O-N 3.1Å; Y709-R712 PolarHBondContact OH-NH1 3.46Å; Y709-L713 VanDerWaalsContact O-CB 3.24Å; Y709-L713 WeakPolarHBondContact O-CB 3.22Å; Y709-L713 PolarHBondContact O-N 3.5Å
710	F	92.4	Very high	85.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.4	-34.1	171	-82.8	-63.5	0	0	0	113	L654 F673 W674 V677 Y678 F681 I706 A707 L713 S714	L654-F710 HydrophobicContact CD1-CD2 4.36Å; L654-F710 HydrophobicContact CD1-CE2 3.95Å; L654-F710 HydrophobicContact CD1-CZ 4.21Å; L654-F710 HydrophobicContact CD2-CD1 4.4Å; L654-F710 HydrophobicContact CD2-CE1 4.04Å; L654-F710 HydrophobicContact CD2-CZ 4.12Å; F673-F710 HydrophobicContact CD1-CE1 4.41Å; W674-F710 HydrophobicContact CH2-CD1 4.2Å; W674-F710 HydrophobicContact CZ3-CD1 4.28Å; V677-F710 HydrophobicContact CB-CZ 4.26Å; V677-F710 HydrophobicContact CG1-CZ 3.94Å; Y678-F710 AromaticContact CD2-CD1 4Å; Y678-F710 HydrophobicContact CD2-CD1 4Å; Y678-F710 HydrophobicContact CD2-CD2 4.37Å; Y678-F710 HydrophobicContact CD2-CE1 4.17Å; Y678-F710 HydrophobicContact CD2-CG 4.12Å; Y678-F710 HydrophobicContact CD2-CZ 4.41Å; Y678-F710 HydrophobicContact CG-CE1 4.4Å; F681-F710 HydrophobicContact CB-CE2 4.02Å; F681-F710 AromaticContact CD1-CD2 3.79Å; F681-F710 HydrophobicContact CD1-CD2 3.79Å; F681-F710 AromaticContact CD1-CE2 3.69Å; F681-F710 HydrophobicContact CD1-CE2 3.69Å; F681-F710 HydrophobicContact CE1-CD2 4.05Å; F681-F710 HydrophobicContact CE1-CE2 4.33Å; F681-F710 HydrophobicContact CG-CD2 4.42Å; F681-F710 AromaticContact CG-CE2 3.89Å; F681-F710 HydrophobicContact CG-CE2 3.89Å; I706-F710 HydrophobicContact CG2-CD2 3.92Å; I706-F710 HydrophobicContact CG2-CE2 3.71Å; I706-F710 WeakPolarHBondContact O-CD2 3.48Å; I706-F710 PolarHBondContact O-N 3.09Å; A707-F710 PolarHBondContact O-N 3.29Å; F710-L713 HydrophobicContact CD1-CD2 4.23Å; F710-L713 HydrophobicContact CE1-CD2 4.47Å; F710-S714 WeakPolarHBondContact O-CB 3.44Å; F710-S714 PolarHBondContact O-N 3.21Å
711	L	90.3	Very high	84.2	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-67.9	-43.9	172.1	-81.7	170.2	0	0	0	112.4	A707 L708 Y709 L713 S714 N715 P733 L736 F737 F740 F758 I771	A707-L711 PolarHBondContact O-N 2.56Å; L708-L711 WeakPolarHBondContact O-CB 3.41Å; L708-L711 PolarHBondContact O-N 3.08Å; Y709-L711 VanDerWaalsContact C-N 3.3Å; Y709-L711 PolarHBondContact O-N 3.42Å; L711-L713 VanDerWaalsContact C-N 3.32Å; L711-L713 PolarHBondContact O-N 3.03Å; L711-S714 WeakPolarHBondContact O-CB 3.41Å; L711-S714 PolarHBondContact O-N 2.9Å; L711-N715 PolarHBondContact O-N 3.41Å; L711-P733 VanDerWaalsContact CD2-O 3.3Å; L711-P733 WeakPolarHBondContact CD2-O 3.49Å; L711-L736 HydrophobicContact CD2-CB 3.6Å; L711-L736 HydrophobicContact CG-CB 4.41Å; L711-F737 HydrophobicContact CD2-CB 4.25Å; L711-F740 HydrophobicContact CD1-CD2 4.22Å; L711-F740 HydrophobicContact CG-CD2 4.31Å; L711-F740 HydrophobicContact CG-CE2 4.23Å; L711-F758 HydrophobicContact CD1-CE1 3.44Å; L711-F758 VanDerWaalsContact CD1-CE1 3.44Å; L711-F758 HydrophobicContact CD1-CE2 4.39Å; L711-F758 HydrophobicContact CD1-CZ 3.23Å; L711-I771 HydrophobicContact CB-CD1 4.4Å; L711-I771 HydrophobicContact CB-CG2 4.29Å; L711-I771 HydrophobicContact CD2-CG2 4.49Å
712	R	88.8	Confident	82.9	Confident	72 Å²	72	38.7 Å²	38.7	27%	0.272	19%	0.187	S	C	.	.	H	α-helix	trans	-58.1	-46.2	172.6	-70.8	173.7	177.3	-165.3	-10.3	111.1	L708 Y709 S714 N715 I716 E767 I771	L708-R712 WeakPolarHBondContact O-CG 3.47Å; L708-R712 PolarHBondContact O-N 2.94Å; Y709-R712 PolarHBondContact O-N 3.1Å; Y709-R712 PolarHBondContact OH-NH1 3.46Å; R712-S714 VanDerWaalsContact C-N 3.31Å; R712-S714 PolarHBondContact O-N 3.19Å; R712-N715 WeakPolarHBondContact O-CB 3.2Å; R712-N715 PolarHBondContact O-N 3.05Å; R712-I716 WeakPolarHBondContact O-CG1 3.33Å; R712-I716 PolarHBondContact O-N 3.49Å; R712-E767 WeakPolarHBondContact CD-OE1 3.47Å; R712-E767 IonicContact CZ-OE1 3.47Å; R712-E767 IonicContact CZ-OE2 2.75Å; R712-E767 VanDerWaalsContact NE-CD 3.33Å; R712-E767 IonicContact NE-OE1 3.37Å; R712-E767 PolarHBondContact NE-OE1 3.11Å; R712-E767 IonicContact NE-OE2 3.53Å; R712-E767 IonicContact NH2-OE1 2.78Å; R712-E767 PolarHBondContact NH2-OE1 3.2Å; R712-E767 IonicContact NH2-OE2 3.96Å; R712-E767 PolarHBondContact NH2-OE2 2.98Å; R712-I771 HydrophobicContact CG-CD1 3.85Å
713	L	87.9	Confident	81.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-41.1	178.3	-176	62	0	0	0	111.7	V657 F670 F673 W674 Y709 F710 L711 I716 C717	V657-L713 HydrophobicContact CG1-CD1 3.99Å; F670-L713 HydrophobicContact CD1-CD1 3.61Å; F670-L713 HydrophobicContact CE1-CD1 3.88Å; F673-L713 HydrophobicContact CB-CD2 3.82Å; F673-L713 HydrophobicContact CG-CD2 4.37Å; W674-L713 HydrophobicContact CZ2-CB 4.24Å; W674-L713 HydrophobicContact CZ2-CD2 4.04Å; W674-L713 HydrophobicContact CZ2-CG 3.94Å; Y709-L713 VanDerWaalsContact O-CB 3.24Å; Y709-L713 WeakPolarHBondContact O-CB 3.22Å; Y709-L713 PolarHBondContact O-N 3.5Å; F710-L713 HydrophobicContact CD1-CD2 4.23Å; F710-L713 HydrophobicContact CE1-CD2 4.47Å; L711-L713 VanDerWaalsContact C-N 3.32Å; L711-L713 PolarHBondContact O-N 3.03Å; L713-I716 PolarHBondContact O-N 3.3Å; L713-C717 PolarHBondContact O-N 2.93Å; L713-C717 PolarHBondContact O-SG 2.98Å
714	S	88	Confident	79.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-46.9	175	177	0	0	0	0	111	F710 L711 R712 I716 C717 F718 L731 P733	F710-S714 WeakPolarHBondContact O-CB 3.44Å; F710-S714 PolarHBondContact O-N 3.21Å; L711-S714 WeakPolarHBondContact O-CB 3.41Å; L711-S714 PolarHBondContact O-N 2.9Å; R712-S714 VanDerWaalsContact C-N 3.31Å; R712-S714 PolarHBondContact O-N 3.19Å; S714-I716 PolarHBondContact O-N 3.15Å; S714-C717 PolarHBondContact O-N 2.96Å; S714-F718 VanDerWaalsContact O-CB 3.31Å; S714-F718 WeakPolarHBondContact O-CB 3.3Å; S714-F718 WeakPolarHBondContact O-CD2 3.41Å; S714-F718 PolarHBondContact O-N 3.46Å; S714-L731 PolarHBondContact OG-O 3.24Å; S714-P733 VanDerWaalsContact OG-CD 3.25Å; S714-P733 WeakPolarHBondContact OG-CD 3.5Å; S714-P733 WeakPolarHBondContact OG-CG 3.46Å
715	N	85.9	Confident	78.2	Confident	36 Å²	36	56.4 Å²	56.4	19%	0.193	27%	0.266	C	S	.	.	H	α-helix	trans	-58.1	-47.3	175.8	-177.9	27.5	0	0	0	112.9	L711 R712 C717 F718 S719 I771 S774	L711-N715 PolarHBondContact O-N 3.41Å; R712-N715 WeakPolarHBondContact O-CB 3.2Å; R712-N715 PolarHBondContact O-N 3.05Å; N715-C717 PolarHBondContact O-N 3.47Å; N715-F718 PolarHBondContact O-N 2.93Å; N715-S719 PolarHBondContact O-N 3.33Å; N715-S719 VanDerWaalsContact O-N 3.1Å; N715-S719 PolarHBondContact O-OG 3.21Å; N715-I771 HydrophobicContact CB-CB 4.3Å; N715-I771 HydrophobicContact CB-CG1 4.02Å; N715-I771 HydrophobicContact CB-CG2 4.09Å; N715-S774 WeakPolarHBondContact OD1-CB 3.5Å; N715-S774 PolarHBondContact OD1-OG 3.42Å
716	I	82	Confident	76.7	Confident	37 Å²	37	51.7 Å²	51.7	19%	0.19	25%	0.246	C	C	.	.	H	α-helix	trans	-57.4	-51.4	178.5	-67.1	164.7	0	0	0	109.8	C658 F670 R712 L713 S714 S719 Y720	C658-I716 HydrophobicContact CB-CD1 4.12Å; C658-I716 VanDerWaalsContact O-CD1 3.3Å; C658-I716 WeakPolarHBondContact O-CD1 3.05Å; F670-I716 HydrophobicContact CZ-CG2 4.41Å; R712-I716 WeakPolarHBondContact O-CG1 3.33Å; R712-I716 PolarHBondContact O-N 3.49Å; L713-I716 PolarHBondContact O-N 3.3Å; S714-I716 PolarHBondContact O-N 3.15Å; I716-S719 PolarHBondContact O-N 2.95Å; I716-Y720 WeakPolarHBondContact O-CD2 3.34Å
717	C	79.6	Confident	75.1	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-70.4	-33.1	-178.5	-67.9	0	0	0	0	113.2	L713 S714 N715 S719 Y720 L730	L713-C717 PolarHBondContact O-N 2.93Å; L713-C717 PolarHBondContact O-SG 2.98Å; S714-C717 PolarHBondContact O-N 2.96Å; N715-C717 PolarHBondContact O-N 3.47Å; C717-S719 VanDerWaalsContact C-N 3.29Å; C717-S719 PolarHBondContact O-N 2.86Å; C717-Y720 PolarHBondContact O-N 2.77Å; C717-L730 HydrophobicContact CB-CD1 3.28Å; C717-L730 HydrophobicContact CB-CD2 4.38Å; C717-L730 HydrophobicContact CB-CG 4.46Å
718	F	76.5	Confident	73.6	Confident	18 Å²	18	63 Å²	63	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-66.6	-31.6	177.4	-101.9	-103.3	0	0	0	112.9	S714 N715 Y720 L730 L731 D732 P733 K776	S714-F718 VanDerWaalsContact O-CB 3.31Å; S714-F718 WeakPolarHBondContact O-CB 3.3Å; S714-F718 WeakPolarHBondContact O-CD2 3.41Å; S714-F718 PolarHBondContact O-N 3.46Å; N715-F718 PolarHBondContact O-N 2.93Å; F718-Y720 PolarHBondContact O-N 3.21Å; F718-Y720 VanDerWaalsContact O-N 3.14Å; F718-L730 HydrophobicContact CD2-CD1 4.34Å; F718-L730 HydrophobicContact CD2-CD2 3.24Å; F718-L730 HydrophobicContact CD2-CG 3.73Å; F718-L730 HydrophobicContact CE2-CD1 4.45Å; F718-L730 HydrophobicContact CE2-CD2 3.21Å; F718-L730 HydrophobicContact CE2-CG 3.46Å; F718-L730 VanDerWaalsContact CE2-CG 3.46Å; F718-L730 HydrophobicContact CG-CD2 4Å; F718-L730 HydrophobicContact CZ-CD2 3.98Å; F718-L730 HydrophobicContact CZ-CG 4.44Å; F718-L731 VanDerWaalsContact CE2-O 3.25Å; F718-L731 WeakPolarHBondContact CE2-O 3.41Å; F718-D732 HydrophobicContact CE1-CB 4.33Å; F718-D732 VanDerWaalsContact CE1-OD2 3.3Å; F718-D732 WeakPolarHBondContact CE1-OD2 3.37Å; F718-D732 VanDerWaalsContact CE2-CA 3.49Å; F718-D732 HydrophobicContact CE2-CB 4.41Å; F718-D732 HydrophobicContact CZ-CB 3.78Å; F718-P733 HydrophobicContact CD2-CG 4.39Å; F718-P733 HydrophobicContact CG-CG 4.46Å; F718-K776 HydrophobicContact CD1-CD 4.47Å; F718-K776 HydrophobicContact CD1-CG 4.31Å; F718-K776 HydrophobicContact CE1-CD 3.65Å; F718-K776 HydrophobicContact CE1-CG 3.77Å; F718-K776 HydrophobicContact CZ-CD 4.45Å
719	S	70.6	Confident	72.4	Confident	73 Å²	73	64.5 Å²	64.5	51%	0.51	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.7	178.5	-59.6	0	0	0	0	113.4	N715 I716 C717	N715-S719 PolarHBondContact O-N 3.33Å; N715-S719 VanDerWaalsContact O-N 3.1Å; N715-S719 PolarHBondContact O-OG 3.21Å; I716-S719 PolarHBondContact O-N 2.95Å; C717-S719 VanDerWaalsContact C-N 3.29Å; C717-S719 PolarHBondContact O-N 2.86Å
720	Y	65	Low	71.6	Confident	121 Å²	121	64.7 Å²	64.7	48%	0.475	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	37.4	-174.5	-63.1	-84.9	0	0	0	113.6	Y662 I716 C717 F718 S722	Y662-Y720 AromaticContact CD1-CD1 3.94Å; Y662-Y720 HydrophobicContact CD1-CD1 3.94Å; Y662-Y720 AromaticContact CD1-CD2 3.85Å; Y662-Y720 HydrophobicContact CD1-CD2 3.85Å; Y662-Y720 AromaticContact CD1-CG 3.52Å; Y662-Y720 HydrophobicContact CD1-CG 3.52Å; Y662-Y720 HydrophobicContact CD2-CD2 4.1Å; Y662-Y720 HydrophobicContact CD2-CG 4.41Å; Y662-Y720 HydrophobicContact CE1-CG 4.02Å; Y662-Y720 HydrophobicContact CG-CD1 4.46Å; Y662-Y720 AromaticContact CG-CD2 3.55Å; Y662-Y720 HydrophobicContact CG-CD2 3.55Å; Y662-Y720 HydrophobicContact CG-CE2 4.14Å; Y662-Y720 AromaticContact CG-CG 3.75Å; Y662-Y720 HydrophobicContact CG-CG 3.75Å; I716-Y720 WeakPolarHBondContact O-CD2 3.34Å; C717-Y720 PolarHBondContact O-N 2.77Å; F718-Y720 PolarHBondContact O-N 3.21Å; F718-Y720 VanDerWaalsContact O-N 3.14Å; Y720-S722 PolarHBondContact O-N 3.24Å
721	R	58.3	Low	71	Confident	157 Å²	157	67.3 Å²	67.3	59%	0.592	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-16.4	-175.3	-169.5	179.3	176.8	172.3	2.7	117.2	E723 K776	R721-E723 PolarHBondContact O-N 3.42Å; R721-K776 VanDerWaalsContact NE-CE 3.29Å
722	S	55.6	Low	70.8	Confident	103 Å²	103	67.8 Å²	67.8	72%	0.72	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-15.2	-175.6	46.6	0	0	0	0	114.7	Y720	Y720-S722 PolarHBondContact O-N 3.24Å
723	E	53.6	Low	70.8	Confident	49 Å²	49	64.4 Å²	64.4	23%	0.229	33%	0.327	C	S	.	.			trans	-100.9	112.8	-174.9	-70.9	175	-176.7	0	0	112.8	Y662 E664 L667 R721 K725	Y662-E723 VanDerWaalsContact CE1-OE2 3.29Å; Y662-E723 WeakPolarHBondContact CE1-OE2 3.48Å; Y662-E723 PolarHBondContact OH-OE2 3.28Å; E664-E723 WeakPolarHBondContact CG-OE1 3.31Å; L667-E723 WeakPolarHBondContact CD1-OE2 3.2Å; L667-E723 WeakPolarHBondContact CD2-OE2 3.38Å; R721-E723 PolarHBondContact O-N 3.42Å; E723-K725 PolarHBondContact O-N 3.48Å; E723-K725 VanDerWaalsContact O-N 3.08Å
724	H	54.7	Low	70.8	Confident	168 Å²	168	64.4 Å²	64.4	78%	0.778	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-56.2	-26.3	-175.9	-78	-68.9	0	0	0	115.1	L726 T727	H724-L726 PolarHBondContact O-N 2.91Å; H724-T727 PolarHBondContact O-N 2.86Å; H724-T727 PolarHBondContact O-OG1 2.62Å
725	K	59.2	Low	70.9	Confident	176 Å²	176	67.5 Å²	67.5	77%	0.765	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-64.5	-34	-170.8	-77.7	-177.2	176.6	177.6	0	114.2	E723	E723-K725 PolarHBondContact O-N 3.48Å; E723-K725 VanDerWaalsContact O-N 3.08Å
726	L	58.6	Low	71.1	Confident	11 Å²	11	65.9 Å²	65.9	6%	0.058	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-85.6	-19.1	-179.4	-80	165.9	0	0	0	113.8	Y662 L667 F670 H724 L728 C729 L730	Y662-L726 HydrophobicContact CE2-CD1 3.67Å; Y662-L726 WeakPolarHBondContact OH-CD1 3.35Å; L667-L726 HydrophobicContact CD2-CD1 3.57Å; L667-L726 HydrophobicContact CD2-CG 3.85Å; F670-L726 HydrophobicContact CB-CD1 4.41Å; F670-L726 HydrophobicContact CB-CD2 4.06Å; H724-L726 PolarHBondContact O-N 2.91Å; L726-L728 PolarHBondContact O-N 2.99Å; L726-C729 PolarHBondContact O-N 3.32Å; L726-L730 WeakPolarHBondContact O-CB 3.31Å; L726-L730 PolarHBondContact O-N 2.94Å
727	T	57.2	Low	71.6	Confident	72 Å²	72	64.1 Å²	64.1	44%	0.442	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-21.8	-167.2	53.7	0	0	0	0	115.1	H724	H724-T727 PolarHBondContact O-N 2.86Å; H724-T727 PolarHBondContact O-OG1 2.62Å
728	L	59.9	Low	72.1	Confident	165 Å²	165	64.9 Å²	64.9	86%	0.864	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-23.6	-179.3	-73	168.9	0	0	0	114.2	L726	L726-L728 PolarHBondContact O-N 2.99Å
729	C	64.8	Low	72.7	Confident	64 Å²	64	64.6 Å²	64.6	43%	0.432	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-10.9	-175	-59.8	0	0	0	0	113.7	W674 L726 L731	W674-C729 HydrophobicContact CB-CB 4.01Å; L726-C729 PolarHBondContact O-N 3.32Å; C729-L731 PolarHBondContact O-N 3.36Å
730	L	74.2	Confident	73.7	Confident	32 Å²	32	61.1 Å²	61.1	17%	0.168	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-74.5	122.7	-175	-167.7	79.6	0	0	0	111.6	W674 C717 F718 L726	W674-L730 HydrophobicContact CZ2-CD1 4.46Å; C717-L730 HydrophobicContact CB-CD1 3.28Å; C717-L730 HydrophobicContact CB-CD2 4.38Å; C717-L730 HydrophobicContact CB-CG 4.46Å; F718-L730 HydrophobicContact CD2-CD1 4.34Å; F718-L730 HydrophobicContact CD2-CD2 3.24Å; F718-L730 HydrophobicContact CD2-CG 3.73Å; F718-L730 HydrophobicContact CE2-CD1 4.45Å; F718-L730 HydrophobicContact CE2-CD2 3.21Å; F718-L730 HydrophobicContact CE2-CG 3.46Å; F718-L730 VanDerWaalsContact CE2-CG 3.46Å; F718-L730 HydrophobicContact CG-CD2 4Å; F718-L730 HydrophobicContact CZ-CD2 3.98Å; F718-L730 HydrophobicContact CZ-CG 4.44Å; L726-L730 WeakPolarHBondContact O-CB 3.31Å; L726-L730 PolarHBondContact O-N 2.94Å
731	L	80.6	Confident	74.7	Confident	55 Å²	55	55.4 Å²	55.4	29%	0.288	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-96.2	135.2	176.9	-71	165.8	0	0	0	111.4	W674 Y678 S714 F718 C729 L736	W674-L731 HydrophobicContact CZ3-CB 4.39Å; W674-L731 HydrophobicContact CZ3-CD1 4.31Å; Y678-L731 HydrophobicContact CD1-CD1 4.01Å; Y678-L731 HydrophobicContact CE1-CD1 3.2Å; Y678-L731 HydrophobicContact CE2-CD1 4.25Å; Y678-L731 VanDerWaalsContact OH-CD1 3.3Å; Y678-L731 WeakPolarHBondContact OH-CD1 2.97Å; S714-L731 PolarHBondContact OG-O 3.24Å; F718-L731 VanDerWaalsContact CE2-O 3.25Å; F718-L731 WeakPolarHBondContact CE2-O 3.41Å; C729-L731 PolarHBondContact O-N 3.36Å; L731-L736 HydrophobicContact CB-CD1 3.97Å; L731-L736 HydrophobicContact CB-CD2 4.05Å; L731-L736 HydrophobicContact CB-CG 3.77Å; L731-L736 HydrophobicContact CD1-CD2 3.75Å; L731-L736 HydrophobicContact CD1-CG 4.4Å
732	D	86	Confident	76	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.064	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-59.6	138.4	178.3	-170	-83.9	0	0	0	111.4	F718 A734 D735 L736 S775 K776	F718-D732 HydrophobicContact CE1-CB 4.33Å; F718-D732 VanDerWaalsContact CE1-OD2 3.3Å; F718-D732 WeakPolarHBondContact CE1-OD2 3.37Å; F718-D732 VanDerWaalsContact CE2-CA 3.49Å; F718-D732 HydrophobicContact CE2-CB 4.41Å; F718-D732 HydrophobicContact CZ-CB 3.78Å; D732-A734 PolarHBondContact O-N 2.97Å; D732-A734 VanDerWaalsContact O-N 3.15Å; D732-A734 VanDerWaalsContact OD1-CB 3.24Å; D732-A734 WeakPolarHBondContact OD1-CB 3.16Å; D732-A734 PolarHBondContact OD1-N 3.25Å; D732-D735 HydrophobicContact CB-CB 4.24Å; D732-D735 WeakPolarHBondContact CB-OD2 3.22Å; D732-D735 WeakPolarHBondContact O-CB 3.25Å; D732-D735 PolarHBondContact O-N 2.85Å; D732-L736 PolarHBondContact O-N 2.79Å; D732-S775 VanDerWaalsContact CG-OG 3.29Å; D732-S775 WeakPolarHBondContact OD1-CB 3.44Å; D732-S775 PolarHBondContact OD1-OG 2.9Å; D732-S775 PolarHBondContact OD2-OG 2.84Å; D732-K776 PolarHBondContact OD2-N 3.48Å
733	P	88.6	Confident	77.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-53.5	-36.3	178.6	-23.6	28.8	0	0	0	112.8	L711 S714 F718 F737 I771 S774	L711-P733 VanDerWaalsContact CD2-O 3.3Å; L711-P733 WeakPolarHBondContact CD2-O 3.49Å; S714-P733 VanDerWaalsContact OG-CD 3.25Å; S714-P733 WeakPolarHBondContact OG-CD 3.5Å; S714-P733 WeakPolarHBondContact OG-CG 3.46Å; F718-P733 HydrophobicContact CD2-CG 4.39Å; F718-P733 HydrophobicContact CG-CG 4.46Å; P733-F737 VanDerWaalsContact O-CB 3.25Å; P733-F737 WeakPolarHBondContact O-CB 3.23Å; P733-F737 PolarHBondContact O-N 2.98Å; P733-I771 HydrophobicContact CB-CG2 3.89Å; P733-S774 WeakPolarHBondContact CG-OG 3.43Å
734	A	88.4	Confident	78.6	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-72.3	-33.6	178.3	0	0	0	0	0	112.5	D732 D738 L772 S775 K777 V782 L785	D732-A734 PolarHBondContact O-N 2.97Å; D732-A734 VanDerWaalsContact O-N 3.15Å; D732-A734 VanDerWaalsContact OD1-CB 3.24Å; D732-A734 WeakPolarHBondContact OD1-CB 3.16Å; D732-A734 PolarHBondContact OD1-N 3.25Å; A734-D738 VanDerWaalsContact O-CB 3.22Å; A734-D738 WeakPolarHBondContact O-CB 3.45Å; A734-D738 PolarHBondContact O-N 3.32Å; A734-L772 HydrophobicContact CB-CD2 4.49Å; A734-S775 WeakPolarHBondContact CB-OG 3.47Å; A734-K777 HydrophobicContact CB-CD 3.96Å; A734-K777 HydrophobicContact CB-CG 4.36Å; A734-V782 HydrophobicContact CB-CG2 4.14Å; A734-L785 HydrophobicContact CB-CD1 4.31Å
735	D	89.3	Confident	79.8	Confident	66 Å²	66	39.2 Å²	39.2	35%	0.353	21%	0.212	S	C	.	.	H	α-helix	trans	-69.7	-39.7	175	-70.5	-33.7	0	0	0	111.7	D732 D738 L739 K777	D732-D735 HydrophobicContact CB-CB 4.24Å; D732-D735 WeakPolarHBondContact CB-OD2 3.22Å; D732-D735 WeakPolarHBondContact O-CB 3.25Å; D732-D735 PolarHBondContact O-N 2.85Å; D735-D738 PolarHBondContact O-N 3.43Å; D735-L739 WeakPolarHBondContact O-CB 3.17Å; D735-L739 PolarHBondContact O-N 3.29Å; D735-K777 WeakPolarHBondContact OD1-CE 3.3Å; D735-K777 IonicContact OD1-NZ 2.85Å; D735-K777 PolarHBondContact OD1-NZ 3.16Å
736	L	90.7	Very high	80.9	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-44.1	174.2	-76	169.1	0	0	0	111.8	W674 Y678 L711 L731 D732 D738 L739 F740	W674-L736 HydrophobicContact CH2-CD1 3.54Å; W674-L736 HydrophobicContact CZ3-CD1 4.02Å; W674-L736 HydrophobicContact CZ3-CD2 4.43Å; Y678-L736 HydrophobicContact CD2-CD2 4.45Å; Y678-L736 HydrophobicContact CE2-CD2 3.45Å; Y678-L736 VanDerWaalsContact CE2-CD2 3.45Å; Y678-L736 WeakPolarHBondContact OH-CD2 3.36Å; L711-L736 HydrophobicContact CD2-CB 3.6Å; L711-L736 HydrophobicContact CG-CB 4.41Å; L731-L736 HydrophobicContact CB-CD1 3.97Å; L731-L736 HydrophobicContact CB-CD2 4.05Å; L731-L736 HydrophobicContact CB-CG 3.77Å; L731-L736 HydrophobicContact CD1-CD2 3.75Å; L731-L736 HydrophobicContact CD1-CG 4.4Å; D732-L736 PolarHBondContact O-N 2.79Å; L736-D738 VanDerWaalsContact C-N 3.3Å; L736-D738 PolarHBondContact O-N 3.34Å; L736-L739 WeakPolarHBondContact O-CB 3.49Å; L736-L739 PolarHBondContact O-N 3.34Å; L736-F740 HydrophobicContact CB-CE2 4.25Å; L736-F740 HydrophobicContact CD2-CE2 4.35Å; L736-F740 HydrophobicContact CD2-CZ 4.19Å; L736-F740 WeakPolarHBondContact O-CB 3.34Å; L736-F740 WeakPolarHBondContact O-CD2 3.17Å; L736-F740 VanDerWaalsContact O-CG 3.23Å; L736-F740 WeakPolarHBondContact O-CG 3.36Å; L736-F740 PolarHBondContact O-N 3.08Å
737	F	92.1	Very high	81.9	Confident	1 Å²	1	32 Å²	32	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-59.4	-45.3	176.3	174.9	-103.7	0	0	0	111	L711 P733 F740 T741 F758 L768 L772 L785 A789	L711-F737 HydrophobicContact CD2-CB 4.25Å; P733-F737 VanDerWaalsContact O-CB 3.25Å; P733-F737 WeakPolarHBondContact O-CB 3.23Å; P733-F737 PolarHBondContact O-N 2.98Å; F737-F740 PolarHBondContact O-N 3.26Å; F737-T741 HydrophobicContact CD2-CG2 3.97Å; F737-T741 HydrophobicContact CE1-CG2 4.34Å; F737-T741 HydrophobicContact CE2-CG2 3.6Å; F737-T741 HydrophobicContact CZ-CG2 3.81Å; F737-T741 WeakPolarHBondContact O-CB 3.4Å; F737-T741 WeakPolarHBondContact O-CG2 3.21Å; F737-T741 PolarHBondContact O-N 3.14Å; F737-T741 PolarHBondContact O-OG1 3.41Å; F737-F758 HydrophobicContact CD2-CD2 4.34Å; F737-F758 AromaticContact CD2-CE2 3.83Å; F737-F758 HydrophobicContact CD2-CE2 3.83Å; F737-F758 HydrophobicContact CD2-CZ 4.19Å; F737-F758 AromaticContact CE2-CD2 3.9Å; F737-F758 HydrophobicContact CE2-CD2 3.9Å; F737-F758 AromaticContact CE2-CE2 3.84Å; F737-F758 HydrophobicContact CE2-CE2 3.84Å; F737-L768 HydrophobicContact CD2-CD1 3.74Å; F737-L768 HydrophobicContact CD2-CD2 4.36Å; F737-L768 HydrophobicContact CE2-CD1 3.94Å; F737-L768 HydrophobicContact CE2-CD2 3.69Å; F737-L768 HydrophobicContact CE2-CG 4.39Å; F737-L768 HydrophobicContact CZ-CD2 4.36Å; F737-L772 HydrophobicContact CB-CD2 3.9Å; F737-L772 HydrophobicContact CD1-CD2 4.43Å; F737-L772 HydrophobicContact CG-CD2 4.1Å; F737-L785 HydrophobicContact CD1-CB 4.48Å; F737-L785 HydrophobicContact CE1-CB 4.42Å; F737-A789 HydrophobicContact CE1-CB 3.87Å; F737-A789 HydrophobicContact CZ-CB 3.53Å
738	D	89.9	Confident	82.8	Confident	18 Å²	18	28.8 Å²	28.8	10%	0.096	16%	0.162	C	C	.	.	H	α-helix	trans	-63.1	-44.3	176.9	-174.5	56	0	0	0	112.6	A734 D735 L736 F740 T741 M742 N743 R871	A734-D738 VanDerWaalsContact O-CB 3.22Å; A734-D738 WeakPolarHBondContact O-CB 3.45Å; A734-D738 PolarHBondContact O-N 3.32Å; D735-D738 PolarHBondContact O-N 3.43Å; L736-D738 VanDerWaalsContact C-N 3.3Å; L736-D738 PolarHBondContact O-N 3.34Å; D738-F740 VanDerWaalsContact C-N 3.31Å; D738-F740 PolarHBondContact O-N 3.34Å; D738-T741 PolarHBondContact O-N 2.71Å; D738-M742 PolarHBondContact O-N 3.16Å; D738-N743 PolarHBondContact O-N 3.01Å; D738-R871 VanDerWaalsContact CG-NH1 3.27Å; D738-R871 VanDerWaalsContact CG-NH2 3.28Å; D738-R871 IonicContact OD1-CZ 3.32Å; D738-R871 IonicContact OD1-NH1 2.64Å; D738-R871 PolarHBondContact OD1-NH1 3.15Å; D738-R871 IonicContact OD1-NH2 2.78Å; D738-R871 PolarHBondContact OD1-NH2 2.94Å; D738-R871 VanDerWaalsContact OD1-NH2 3.08Å; D738-R871 IonicContact OD2-CZ 3.3Å; D738-R871 IonicContact OD2-NH1 3.03Å; D738-R871 PolarHBondContact OD2-NH1 3.46Å; D738-R871 IonicContact OD2-NH2 2.9Å; D738-R871 PolarHBondContact OD2-NH2 2.85Å
739	L	90.4	Very high	83.6	Confident	13 Å²	13	21.6 Å²	21.6	7%	0.068	13%	0.125	C	C	.	.	H	α-helix	trans	-55.3	-47.2	173.8	179.8	70	0	0	0	111.7	Y678 K682 D735 L736 N743 I746	Y678-L739 WeakPolarHBondContact OH-CD2 3.5Å; K682-L739 HydrophobicContact CD-CD2 4.29Å; K682-L739 HydrophobicContact CG-CD2 4.44Å; D735-L739 WeakPolarHBondContact O-CB 3.17Å; D735-L739 PolarHBondContact O-N 3.29Å; L736-L739 WeakPolarHBondContact O-CB 3.49Å; L736-L739 PolarHBondContact O-N 3.34Å; L739-N743 HydrophobicContact CD1-CB 3.98Å; L739-N743 WeakPolarHBondContact O-CB 3.41Å; L739-I746 HydrophobicContact CD1-CD1 4.07Å; L739-I746 HydrophobicContact CD1-CG1 4.05Å; L739-I746 HydrophobicContact CG-CD1 4.29Å; L739-I746 HydrophobicContact CG-CG1 4.23Å; L739-I746 WeakPolarHBondContact O-CG1 3.31Å
740	F	90.6	Very high	84.5	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-77.1	-25.1	-174.5	-66.5	-30.1	0	0	0	114.1	Y678 F681 I685 A707 L711 L736 F737 D738 F750 H751 I754	Y678-F740 HydrophobicContact CE2-CZ 4.26Å; F681-F740 AromaticContact CE1-CE1 3.97Å; F681-F740 HydrophobicContact CE1-CE1 3.97Å; F681-F740 HydrophobicContact CE1-CZ 4.08Å; I685-F740 HydrophobicContact CD1-CD1 3.95Å; I685-F740 HydrophobicContact CD1-CE1 3.74Å; A707-F740 HydrophobicContact CB-CD1 4.46Å; A707-F740 HydrophobicContact CB-CD2 3.98Å; A707-F740 HydrophobicContact CB-CE1 4.3Å; A707-F740 HydrophobicContact CB-CE2 3.8Å; A707-F740 HydrophobicContact CB-CG 4.32Å; A707-F740 HydrophobicContact CB-CZ 3.98Å; L711-F740 HydrophobicContact CD1-CD2 4.22Å; L711-F740 HydrophobicContact CG-CD2 4.31Å; L711-F740 HydrophobicContact CG-CE2 4.23Å; L736-F740 HydrophobicContact CB-CE2 4.25Å; L736-F740 HydrophobicContact CD2-CE2 4.35Å; L736-F740 HydrophobicContact CD2-CZ 4.19Å; L736-F740 WeakPolarHBondContact O-CB 3.34Å; L736-F740 WeakPolarHBondContact O-CD2 3.17Å; L736-F740 VanDerWaalsContact O-CG 3.23Å; L736-F740 WeakPolarHBondContact O-CG 3.36Å; L736-F740 PolarHBondContact O-N 3.08Å; F737-F740 PolarHBondContact O-N 3.26Å; D738-F740 VanDerWaalsContact C-N 3.31Å; D738-F740 PolarHBondContact O-N 3.34Å; F740-F750 HydrophobicContact CD1-CE1 4.08Å; F740-H751 PolarHBondContact O-ND1 2.51Å; F740-I754 HydrophobicContact CB-CD1 3.67Å; F740-I754 HydrophobicContact CB-CG2 4.24Å; F740-I754 HydrophobicContact CD1-CD1 4.35Å; F740-I754 HydrophobicContact CD2-CD1 4.46Å; F740-I754 HydrophobicContact CG-CD1 3.93Å
741	T	87.1	Confident	85	Confident	1 Å²	1	17 Å²	17	1%	0.006	10%	0.097	C	C	.	.	H	α-helix	trans	-96.6	-46.5	-175.2	52.1	0	0	0	0	113.3	F737 D738 H751 I754 M755 F758 A789	F737-T741 HydrophobicContact CD2-CG2 3.97Å; F737-T741 HydrophobicContact CE1-CG2 4.34Å; F737-T741 HydrophobicContact CE2-CG2 3.6Å; F737-T741 HydrophobicContact CZ-CG2 3.81Å; F737-T741 WeakPolarHBondContact O-CB 3.4Å; F737-T741 WeakPolarHBondContact O-CG2 3.21Å; F737-T741 PolarHBondContact O-N 3.14Å; F737-T741 PolarHBondContact O-OG1 3.41Å; D738-T741 PolarHBondContact O-N 2.71Å; T741-H751 PolarHBondContact O-ND1 3.48Å; T741-H751 VanDerWaalsContact O-ND1 3.14Å; T741-I754 HydrophobicContact CG2-CG2 4.48Å; T741-M755 WeakPolarHBondContact O-CE 3.37Å; T741-F758 HydrophobicContact CG2-CD2 4.13Å; T741-F758 HydrophobicContact CG2-CE2 3.88Å; T741-A789 HydrophobicContact CG2-CB 4.18Å
742	M	84.3	Confident	85	Confident	13 Å²	13	15.3 Å²	15.3	6%	0.064	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-5.9	-164.1	-64	-66.4	-112.5	0	0	114.3	D738 P744 M755 V788 T792 L872 F875	D738-M742 PolarHBondContact O-N 3.16Å; M742-P744 WeakPolarHBondContact O-CD 3.47Å; M742-M755 HydrophobicContact SD-CE 3.84Å; M742-V788 HydrophobicContact CE-CB 4.47Å; M742-V788 HydrophobicContact CE-CG1 3.45Å; M742-V788 VanDerWaalsContact CE-CG1 3.45Å; M742-T792 HydrophobicContact CE-CG2 4.42Å; M742-T792 WeakPolarHBondContact CE-OG1 3.35Å; M742-T792 HydrophobicContact SD-CG2 4.1Å; M742-T792 PolarHBondContact SD-OG1 2.91Å; M742-L872 HydrophobicContact CE-CB 4.26Å; M742-L872 HydrophobicContact CE-CD1 4.14Å; M742-F875 HydrophobicContact CE-CB 4.49Å; M742-F875 HydrophobicContact SD-CB 4.24Å; M742-F875 HydrophobicContact SD-CD1 4.1Å; M742-F875 HydrophobicContact SD-CD2 3.94Å; M742-F875 HydrophobicContact SD-CE1 4.45Å; M742-F875 HydrophobicContact SD-CE2 4.29Å; M742-F875 HydrophobicContact SD-CG 3.82Å
743	N	86.2	Confident	84.8	Confident	46 Å²	46	15.9 Å²	15.9	25%	0.246	9%	0.092	C	C	.	.			trans	-77.1	121.9	-176.6	-170.2	-56.3	0	0	0	111.7	D738 L739 S745 I746 H751	D738-N743 PolarHBondContact O-N 3.01Å; L739-N743 HydrophobicContact CD1-CB 3.98Å; L739-N743 WeakPolarHBondContact O-CB 3.41Å; N743-S745 PolarHBondContact O-N 3.35Å; N743-S745 VanDerWaalsContact OD1-CB 3.22Å; N743-S745 WeakPolarHBondContact OD1-CB 3.04Å; N743-S745 PolarHBondContact OD1-N 3.02Å; N743-S745 PolarHBondContact OD1-OG 3.37Å; N743-I746 PolarHBondContact O-N 2.96Å; N743-H751 PolarHBondContact O-CE1 3.37Å; N743-H751 VanDerWaalsContact O-CE1 3.29Å; N743-H751 PolarHBondContact O-NE2 3.16Å; N743-H751 VanDerWaalsContact O-NE2 3.14Å
744	P	77.2	Confident	84.8	Confident	31 Å²	31	16 Å²	16	20%	0.201	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-6	-173.6	30.6	-37.7	0	0	0	113.9	R687 M742 I746 T878 F891	R687-P744 WeakPolarHBondContact CD-O 3.34Å; M742-P744 WeakPolarHBondContact O-CD 3.47Å; P744-I746 PolarHBondContact O-N 3.05Å; P744-T878 HydrophobicContact CB-CG2 4Å; P744-F891 HydrophobicContact CB-CE1 3.8Å; P744-F891 HydrophobicContact CB-CZ 4.42Å
745	S	79.7	Confident	84.7	Confident	47 Å²	47	16.1 Å²	16.1	33%	0.329	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-10	173.7	68.9	0	0	0	0	114.1	S686 R687 N743	S686-S745 CarbonylContact C-O 3.48Å; S686-S745 VanDerWaalsContact CA-O 3.24Å; S686-S745 WeakPolarHBondContact CA-O 3.38Å; R687-S745 PolarHBondContact N-O 3.48Å; N743-S745 PolarHBondContact O-N 3.35Å; N743-S745 VanDerWaalsContact OD1-CB 3.22Å; N743-S745 WeakPolarHBondContact OD1-CB 3.04Å; N743-S745 PolarHBondContact OD1-N 3.02Å; N743-S745 PolarHBondContact OD1-OG 3.37Å
746	I	83.8	Confident	84.3	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-100.3	150.5	-178.1	-58.1	-55.5	0	0	0	110.9	I685 R687 L739 N743 P744 F748 F750	I685-I746 HydrophobicContact CB-CG2 4.38Å; I685-I746 HydrophobicContact CD1-CD1 3.78Å; I685-I746 HydrophobicContact CD1-CG2 4.24Å; I685-I746 HydrophobicContact CG1-CD1 3.89Å; R687-I746 VanDerWaalsContact CD-O 3.32Å; R687-I746 WeakPolarHBondContact CD-O 3.48Å; R687-I746 VanDerWaalsContact CG-C 3.46Å; R687-I746 VanDerWaalsContact CG-O 3.3Å; R687-I746 WeakPolarHBondContact CG-O 3.45Å; L739-I746 HydrophobicContact CD1-CD1 4.07Å; L739-I746 HydrophobicContact CD1-CG1 4.05Å; L739-I746 HydrophobicContact CG-CD1 4.29Å; L739-I746 HydrophobicContact CG-CG1 4.23Å; L739-I746 WeakPolarHBondContact O-CG1 3.31Å; N743-I746 PolarHBondContact O-N 2.96Å; P744-I746 PolarHBondContact O-N 3.05Å; I746-F748 PolarHBondContact O-N 2.9Å; I746-F750 HydrophobicContact CG2-CB 4.36Å; I746-F750 HydrophobicContact CG2-CD1 3.39Å; I746-F750 HydrophobicContact CG2-CE1 3.96Å; I746-F750 HydrophobicContact CG2-CG 4.26Å
747	D	78.7	Confident	83.9	Confident	36 Å²	36	18.8 Å²	18.8	19%	0.193	11%	0.107	C	C	.	.			trans	-57.2	135.5	175.9	-174.9	-94.4	0	0	0	111.4	I685 I695 S749 F750 H751	I685-D747 PolarHBondContact O-N 3.44Å; I695-D747 HydrophobicContact CD1-CB 3.99Å; D747-S749 PolarHBondContact O-N 3.24Å; D747-S749 WeakPolarHBondContact OD1-CB 3.16Å; D747-S749 PolarHBondContact OD1-N 2.86Å; D747-S749 PolarHBondContact OD1-OG 2.98Å; D747-F750 HydrophobicContact CB-CB 4.35Å; D747-F750 WeakPolarHBondContact O-CB 3.04Å; D747-F750 PolarHBondContact O-N 3.43Å; D747-H751 PolarHBondContact O-N 2.93Å
748	F	76.7	Confident	83.6	Confident	4 Å²	4	18.8 Å²	18.8	2%	0.018	11%	0.107	C	C	.	.	H	α-helix	trans	-65.3	-41.9	-173.4	-60.5	-55.7	0	0	0	113	I746 F750 H751 F752 T878 C879 F891 M896	I746-F748 PolarHBondContact O-N 2.9Å; F748-F750 PolarHBondContact O-N 3.33Å; F748-F750 VanDerWaalsContact O-N 3.15Å; F748-H751 WeakPolarHBondContact O-CB 3.47Å; F748-H751 PolarHBondContact O-N 3.36Å; F748-F752 VanDerWaalsContact O-CD2 3.24Å; F748-F752 WeakPolarHBondContact O-CD2 3.46Å; F748-T878 WeakPolarHBondContact CZ-O 3.33Å; F748-C879 HydrophobicContact CD1-CB 4.31Å; F748-C879 WeakPolarHBondContact CD1-SG 3.33Å; F748-C879 HydrophobicContact CE1-CB 4.35Å; F748-C879 WeakPolarHBondContact CE1-SG 3.47Å; F748-F891 HydrophobicContact CZ-CD1 4.03Å; F748-M896 HydrophobicContact CB-CE 3.07Å; F748-M896 HydrophobicContact CD2-CE 3.79Å; F748-M896 HydrophobicContact CD2-CG 4.12Å; F748-M896 HydrophobicContact CG-CE 3.71Å
749	S	77.1	Confident	83.1	Confident	13 Å²	13	17.9 Å²	17.9	9%	0.091	10%	0.102	C	C	.	.	H	α-helix	trans	-60.9	-30	-178.5	-50.5	0	0	0	0	111.3	D747 S753	D747-S749 PolarHBondContact O-N 3.24Å; D747-S749 WeakPolarHBondContact OD1-CB 3.16Å; D747-S749 PolarHBondContact OD1-N 2.86Å; D747-S749 PolarHBondContact OD1-OG 2.98Å; S749-S753 PolarHBondContact O-N 2.99Å
750	F	83.4	Confident	82.3	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68.8	-38.3	176.2	-177.9	-101.2	0	0	0	112.9	F681 I685 L700 L703 A707 F740 I746 D747 F748 F752 S753 I754	F681-F750 HydrophobicContact CE1-CZ 4.42Å; F681-F750 HydrophobicContact CZ-CE2 4.24Å; F681-F750 AromaticContact CZ-CZ 3.83Å; F681-F750 HydrophobicContact CZ-CZ 3.83Å; I685-F750 HydrophobicContact CB-CD1 4.4Å; I685-F750 HydrophobicContact CB-CE1 4.21Å; I685-F750 HydrophobicContact CB-CZ 4.27Å; I685-F750 HydrophobicContact CD1-CD1 4.29Å; I685-F750 HydrophobicContact CD1-CE1 3.47Å; I685-F750 VanDerWaalsContact CD1-CE1 3.47Å; I685-F750 HydrophobicContact CD1-CZ 3.75Å; I685-F750 HydrophobicContact CG1-CE1 4.43Å; I685-F750 HydrophobicContact CG2-CD2 4.16Å; I685-F750 HydrophobicContact CG2-CE1 4.25Å; I685-F750 HydrophobicContact CG2-CE2 3.83Å; I685-F750 HydrophobicContact CG2-CG 4.5Å; I685-F750 HydrophobicContact CG2-CZ 3.8Å; L700-F750 HydrophobicContact CD2-CB 4.25Å; L703-F750 HydrophobicContact CB-CD2 4.13Å; L703-F750 HydrophobicContact CB-CE2 3.68Å; A707-F750 HydrophobicContact CB-CZ 3.94Å; F740-F750 HydrophobicContact CD1-CE1 4.08Å; I746-F750 HydrophobicContact CG2-CB 4.36Å; I746-F750 HydrophobicContact CG2-CD1 3.39Å; I746-F750 HydrophobicContact CG2-CE1 3.96Å; I746-F750 HydrophobicContact CG2-CG 4.26Å; D747-F750 HydrophobicContact CB-CB 4.35Å; D747-F750 WeakPolarHBondContact O-CB 3.04Å; D747-F750 PolarHBondContact O-N 3.43Å; F748-F750 PolarHBondContact O-N 3.33Å; F748-F750 VanDerWaalsContact O-N 3.15Å; F750-F752 VanDerWaalsContact C-N 3.34Å; F750-F752 PolarHBondContact O-N 3.42Å; F750-S753 PolarHBondContact O-N 3.28Å; F750-I754 HydrophobicContact CD1-CD1 3.82Å; F750-I754 HydrophobicContact CD1-CG1 4.27Å; F750-I754 HydrophobicContact CD2-CG1 4.47Å; F750-I754 HydrophobicContact CE1-CD1 3.12Å; F750-I754 HydrophobicContact CE1-CG1 3.97Å; F750-I754 HydrophobicContact CE2-CD1 3.89Å; F750-I754 HydrophobicContact CE2-CG1 4.11Å; F750-I754 HydrophobicContact CZ-CD1 3.19Å; F750-I754 HydrophobicContact CZ-CG1 3.92Å; F750-I754 WeakPolarHBondContact O-CB 3.14Å; F750-I754 PolarHBondContact O-N 3.4Å
751	H	85	Confident	81.6	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-57.2	-46.3	174.1	-66.8	-54.4	0	0	0	111.9	F740 T741 N743 D747 F748 I754 M755 F875	F740-H751 PolarHBondContact O-ND1 2.51Å; T741-H751 PolarHBondContact O-ND1 3.48Å; T741-H751 VanDerWaalsContact O-ND1 3.14Å; N743-H751 PolarHBondContact O-CE1 3.37Å; N743-H751 VanDerWaalsContact O-CE1 3.29Å; N743-H751 PolarHBondContact O-NE2 3.16Å; N743-H751 VanDerWaalsContact O-NE2 3.14Å; D747-H751 PolarHBondContact O-N 2.93Å; F748-H751 WeakPolarHBondContact O-CB 3.47Å; F748-H751 PolarHBondContact O-N 3.36Å; H751-I754 PolarHBondContact O-N 2.97Å; H751-M755 WeakPolarHBondContact O-CB 3.36Å; H751-M755 WeakPolarHBondContact O-CG 3.47Å; H751-M755 PolarHBondContact O-N 2.91Å; H751-F875 HydrophobicContact CB-CE2 4.33Å; H751-F875 HydrophobicContact CB-CZ 4.12Å; H751-F875 AromaticContact CD2-CE2 3.6Å; H751-F875 AromaticContact CG-CE2 3.97Å
752	F	80.2	Confident	80.9	Confident	18 Å²	18	23.7 Å²	23.7	8%	0.079	15%	0.145	C	C	.	.	H	α-helix	trans	-61.7	-45.9	177	-70.8	-98	0	0	0	111.7	F748 F750 I754 M755 K756 F796 V797 M896 L902 L907	F748-F752 VanDerWaalsContact O-CD2 3.24Å; F748-F752 WeakPolarHBondContact O-CD2 3.46Å; F750-F752 VanDerWaalsContact C-N 3.34Å; F750-F752 PolarHBondContact O-N 3.42Å; F752-I754 VanDerWaalsContact C-N 3.32Å; F752-I754 PolarHBondContact O-N 3.4Å; F752-M755 PolarHBondContact O-N 2.96Å; F752-K756 WeakPolarHBondContact O-CB 3.44Å; F752-K756 PolarHBondContact O-N 3.5Å; F752-F796 HydrophobicContact CE1-CB 3.74Å; F752-F796 HydrophobicContact CE1-CG 4.46Å; F752-F796 HydrophobicContact CZ-CB 4.3Å; F752-V797 HydrophobicContact CB-CG2 4.48Å; F752-V797 HydrophobicContact CD1-CG2 3.79Å; F752-V797 HydrophobicContact CG-CG2 4.47Å; F752-M896 HydrophobicContact CE2-CE 4.41Å; F752-L902 HydrophobicContact CB-CD1 4.22Å; F752-L902 HydrophobicContact CD1-CD1 4.13Å; F752-L902 HydrophobicContact CD1-CD2 4.16Å; F752-L902 HydrophobicContact CD2-CD1 3.83Å; F752-L902 HydrophobicContact CE1-CD1 4.49Å; F752-L902 HydrophobicContact CE1-CD2 4.13Å; F752-L902 HydrophobicContact CE2-CD1 4.29Å; F752-L902 HydrophobicContact CG-CD1 3.81Å; F752-L907 HydrophobicContact CE1-CD2 3.98Å; F752-L907 HydrophobicContact CE2-CD2 4.12Å; F752-L907 HydrophobicContact CZ-CD2 3.39Å
753	S	82.4	Confident	80.6	Confident	25 Å²	25	27 Å²	27	18%	0.175	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-39.3	179.2	-171.1	0	0	0	0	112	L700 S704 S749 F750 A757	L700-S753 PolarHBondContact O-OG 2.79Å; S704-S753 PolarHBondContact OG-OG 3.11Å; S749-S753 PolarHBondContact O-N 2.99Å; F750-S753 PolarHBondContact O-N 3.28Å; S753-A757 WeakPolarHBondContact O-CB 3.36Å; S753-A757 PolarHBondContact O-N 3.32Å
754	I	87	Confident	80.4	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-70.3	-46.2	178.3	-85.4	-164.6	0	0	0	111.6	A707 F740 T741 F750 H751 F752 K756 A757 F758	A707-I754 HydrophobicContact CB-CD1 3.44Å; A707-I754 VanDerWaalsContact CB-CD1 3.44Å; A707-I754 HydrophobicContact CB-CG1 4.38Å; F740-I754 HydrophobicContact CB-CD1 3.67Å; F740-I754 HydrophobicContact CB-CG2 4.24Å; F740-I754 HydrophobicContact CD1-CD1 4.35Å; F740-I754 HydrophobicContact CD2-CD1 4.46Å; F740-I754 HydrophobicContact CG-CD1 3.93Å; T741-I754 HydrophobicContact CG2-CG2 4.48Å; F750-I754 HydrophobicContact CD1-CD1 3.82Å; F750-I754 HydrophobicContact CD1-CG1 4.27Å; F750-I754 HydrophobicContact CD2-CG1 4.47Å; F750-I754 HydrophobicContact CE1-CD1 3.12Å; F750-I754 HydrophobicContact CE1-CG1 3.97Å; F750-I754 HydrophobicContact CE2-CD1 3.89Å; F750-I754 HydrophobicContact CE2-CG1 4.11Å; F750-I754 HydrophobicContact CZ-CD1 3.19Å; F750-I754 HydrophobicContact CZ-CG1 3.92Å; F750-I754 WeakPolarHBondContact O-CB 3.14Å; F750-I754 PolarHBondContact O-N 3.4Å; H751-I754 PolarHBondContact O-N 2.97Å; F752-I754 VanDerWaalsContact C-N 3.32Å; F752-I754 PolarHBondContact O-N 3.4Å; I754-K756 VanDerWaalsContact C-N 3.25Å; I754-K756 PolarHBondContact O-N 3.26Å; I754-A757 CarbonylContact O-C 3.59Å; I754-A757 WeakPolarHBondContact O-CA 3.45Å; I754-A757 WeakPolarHBondContact O-CB 3.32Å; I754-A757 PolarHBondContact O-N 3Å; I754-F758 HydrophobicContact CG2-CD2 3.46Å; I754-F758 VanDerWaalsContact CG2-CD2 3.46Å; I754-F758 HydrophobicContact CG2-CE2 3.06Å; I754-F758 HydrophobicContact CG2-CG 4.46Å; I754-F758 HydrophobicContact CG2-CZ 3.76Å; I754-F758 WeakPolarHBondContact O-CD2 3.35Å; I754-F758 PolarHBondContact O-N 3.41Å
755	M	86	Confident	80.7	Confident	3 Å²	3	24 Å²	24	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-39.9	177.1	-74.4	-176.8	-173.2	0	0	110.7	T741 M742 H751 F752 A757 F758 Y759 T792 Y793 V797	T741-M755 WeakPolarHBondContact O-CE 3.37Å; M742-M755 HydrophobicContact SD-CE 3.84Å; H751-M755 WeakPolarHBondContact O-CB 3.36Å; H751-M755 WeakPolarHBondContact O-CG 3.47Å; H751-M755 PolarHBondContact O-N 2.91Å; F752-M755 PolarHBondContact O-N 2.96Å; M755-A757 VanDerWaalsContact C-N 3.31Å; M755-A757 PolarHBondContact O-N 2.71Å; M755-F758 PolarHBondContact O-N 2.93Å; M755-Y759 HydrophobicContact CB-CD2 4.44Å; M755-Y759 WeakPolarHBondContact O-CB 3.46Å; M755-Y759 WeakPolarHBondContact O-CD2 3.4Å; M755-Y759 PolarHBondContact O-N 3.48Å; M755-T792 HydrophobicContact CE-CG2 3.69Å; M755-T792 HydrophobicContact SD-CG2 3.81Å; M755-Y793 HydrophobicContact CB-CD2 4.17Å; M755-V797 HydrophobicContact CB-CG2 4.06Å; M755-V797 HydrophobicContact SD-CG2 4.49Å
756	K	81.5	Confident	80.7	Confident	93 Å²	93	26.1 Å²	26.1	40%	0.404	16%	0.157	S	C	.	.	H	α-helix	trans	-60.6	-40	171.7	-173.2	173.9	-179	170.6	0	112.1	F752 I754 G760 V797	F752-K756 WeakPolarHBondContact O-CB 3.44Å; F752-K756 PolarHBondContact O-N 3.5Å; I754-K756 VanDerWaalsContact C-N 3.25Å; I754-K756 PolarHBondContact O-N 3.26Å; K756-G760 WeakPolarHBondContact O-CA 3.25Å; K756-G760 PolarHBondContact O-N 2.71Å; K756-V797 HydrophobicContact CB-CG1 4.09Å
757	A	83.1	Confident	80.8	Confident	29 Å²	29	28.7 Å²	28.7	24%	0.24	17%	0.169	C	C	.	.	H	α-helix	trans	-69.1	-41.3	178.3	0	0	0	0	0	112.5	L708 S753 I754 M755 A764	L708-A757 HydrophobicContact CD1-CB 3.87Å; S753-A757 WeakPolarHBondContact O-CB 3.36Å; S753-A757 PolarHBondContact O-N 3.32Å; I754-A757 CarbonylContact O-C 3.59Å; I754-A757 WeakPolarHBondContact O-CA 3.45Å; I754-A757 WeakPolarHBondContact O-CB 3.32Å; I754-A757 PolarHBondContact O-N 3Å; M755-A757 VanDerWaalsContact C-N 3.31Å; M755-A757 PolarHBondContact O-N 2.71Å; A757-A764 WeakPolarHBondContact O-CB 3.37Å
758	F	84.3	Confident	81.2	Confident	1 Å²	1	27.1 Å²	27.1	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-69.3	-47.1	177.8	-72	-41.6	0	0	0	113.1	L708 L711 F737 T741 I754 M755 A764 I765 L768	L708-F758 HydrophobicContact CD2-CD1 3.43Å; L708-F758 VanDerWaalsContact CD2-CD1 3.43Å; L708-F758 HydrophobicContact CD2-CE1 3.24Å; L708-F758 HydrophobicContact CD2-CZ 4.38Å; L708-F758 HydrophobicContact CG-CD1 4.43Å; L708-F758 HydrophobicContact CG-CE1 4.05Å; L711-F758 HydrophobicContact CD1-CE1 3.44Å; L711-F758 VanDerWaalsContact CD1-CE1 3.44Å; L711-F758 HydrophobicContact CD1-CE2 4.39Å; L711-F758 HydrophobicContact CD1-CZ 3.23Å; F737-F758 HydrophobicContact CD2-CD2 4.34Å; F737-F758 AromaticContact CD2-CE2 3.83Å; F737-F758 HydrophobicContact CD2-CE2 3.83Å; F737-F758 HydrophobicContact CD2-CZ 4.19Å; F737-F758 AromaticContact CE2-CD2 3.9Å; F737-F758 HydrophobicContact CE2-CD2 3.9Å; F737-F758 AromaticContact CE2-CE2 3.84Å; F737-F758 HydrophobicContact CE2-CE2 3.84Å; T741-F758 HydrophobicContact CG2-CD2 4.13Å; T741-F758 HydrophobicContact CG2-CE2 3.88Å; I754-F758 HydrophobicContact CG2-CD2 3.46Å; I754-F758 VanDerWaalsContact CG2-CD2 3.46Å; I754-F758 HydrophobicContact CG2-CE2 3.06Å; I754-F758 HydrophobicContact CG2-CG 4.46Å; I754-F758 HydrophobicContact CG2-CZ 3.76Å; I754-F758 WeakPolarHBondContact O-CD2 3.35Å; I754-F758 PolarHBondContact O-N 3.41Å; M755-F758 PolarHBondContact O-N 2.93Å; F758-A764 WeakPolarHBondContact O-CB 3.37Å; F758-I765 VanDerWaalsContact O-CG1 3.22Å; F758-I765 WeakPolarHBondContact O-CG1 3.48Å; F758-I765 PolarHBondContact O-N 2.63Å; F758-L768 HydrophobicContact CB-CD2 4.01Å; F758-L768 HydrophobicContact CD1-CD1 4.09Å; F758-L768 HydrophobicContact CD1-CD2 4.09Å; F758-L768 HydrophobicContact CD1-CG 4.49Å; F758-L768 HydrophobicContact CE1-CD1 4.07Å; F758-L768 HydrophobicContact CG-CD2 4Å
759	Y	81.1	Confident	81.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-104.7	2.2	-169.5	-61.4	-72.9	0	0	0	113.6	M755 I765 F786 A789 L790 Y793 F811	M755-Y759 HydrophobicContact CB-CD2 4.44Å; M755-Y759 WeakPolarHBondContact O-CB 3.46Å; M755-Y759 WeakPolarHBondContact O-CD2 3.4Å; M755-Y759 PolarHBondContact O-N 3.48Å; Y759-I765 HydrophobicContact CD1-CD1 4.08Å; Y759-I765 HydrophobicContact CD1-CG1 4.11Å; Y759-F786 HydrophobicContact CE1-CD2 4.44Å; Y759-F786 AromaticContact CE1-CE2 3.75Å; Y759-F786 HydrophobicContact CE1-CE2 3.75Å; Y759-F786 AromaticContact CE1-CZ 3.95Å; Y759-F786 HydrophobicContact CE1-CZ 3.95Å; Y759-F786 PolarHBondContact OH-O 2.87Å; Y759-F786 VanDerWaalsContact OH-O 3.13Å; Y759-A789 HydrophobicContact CE2-CB 4.32Å; Y759-A789 WeakPolarHBondContact OH-CB 3.4Å; Y759-L790 HydrophobicContact CD1-CD1 3.72Å; Y759-L790 HydrophobicContact CE1-CB 3.99Å; Y759-L790 HydrophobicContact CE1-CD1 3.81Å; Y759-L790 HydrophobicContact CE1-CG 4.46Å; Y759-L790 HydrophobicContact CG-CD1 4.38Å; Y759-L790 PolarHBondContact OH-N 3.22Å; Y759-Y793 HydrophobicContact CD2-CD2 4.3Å; Y759-Y793 AromaticContact CD2-CG 3.98Å; Y759-Y793 HydrophobicContact CD2-CG 3.98Å; Y759-Y793 HydrophobicContact CG-CD1 4.19Å; Y759-Y793 HydrophobicContact CG-CD2 4.47Å; Y759-Y793 HydrophobicContact CG-CG 4.07Å; Y759-Y793 PolarHBondContact O-OH 2.92Å; Y759-F811 WeakPolarHBondContact O-CE2 3.42Å; Y759-F811 WeakPolarHBondContact O-CZ 3.41Å
760	G	73	Confident	82	Confident	29 Å²	29	30.8 Å²	30.8	30%	0.299	18%	0.183	S	C	.	.	S	Bend	trans	-76.4	-24.2	-178.3	0	0	0	0	0	114.5	K756	K756-G760 WeakPolarHBondContact O-CA 3.25Å; K756-G760 PolarHBondContact O-N 2.71Å
761	T	75.3	Confident	82.2	Confident	72 Å²	72	31 Å²	31	44%	0.442	18%	0.184	S	C	.	.	S	Bend	trans	-137.2	148.7	-178.3	63	0	0	0	0	111.7	S763 A764 I765	T761-S763 VanDerWaalsContact C-N 3.28Å; T761-S763 PolarHBondContact O-N 2.69Å; T761-S763 PolarHBondContact OG1-OG 3.27Å; T761-A764 PolarHBondContact O-N 3.39Å; T761-A764 VanDerWaalsContact OG1-CB 3.28Å; T761-A764 WeakPolarHBondContact OG1-CB 3.4Å; T761-A764 PolarHBondContact OG1-N 2.81Å; T761-I765 PolarHBondContact O-N 3.08Å
762	S	73.2	Confident	82.4	Confident	34 Å²	34	31.2 Å²	31.2	24%	0.238	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-37.1	177.5	171.5	0	0	0	0	112.2	I765 K766	S762-I765 PolarHBondContact O-N 3.24Å; S762-K766 WeakPolarHBondContact O-CG 3.22Å; S762-K766 PolarHBondContact O-N 3Å; S762-K766 WeakPolarHBondContact OG-CE 3.45Å
763	S	78.7	Confident	82.5	Confident	82 Å²	82	34.4 Å²	34.4	57%	0.573	20%	0.203	S	C	*	.	H	α-helix	trans	-63.6	-43.1	177.8	50.1	0	0	0	0	112.7	T761 I765 K766 E767	T761-S763 VanDerWaalsContact C-N 3.28Å; T761-S763 PolarHBondContact O-N 2.69Å; T761-S763 PolarHBondContact OG1-OG 3.27Å; S763-I765 VanDerWaalsContact C-N 3.31Å; S763-I765 PolarHBondContact O-N 3.04Å; S763-K766 PolarHBondContact O-N 3.45Å; S763-E767 WeakPolarHBondContact O-CB 3.07Å; S763-E767 PolarHBondContact O-N 2.82Å
764	A	81.8	Confident	82.6	Confident	13 Å²	13	34.6 Å²	34.6	11%	0.107	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-37	177.6	0	0	0	0	0	112.1	A757 F758 T761 E767 L768	A757-A764 WeakPolarHBondContact O-CB 3.37Å; F758-A764 WeakPolarHBondContact O-CB 3.37Å; T761-A764 PolarHBondContact O-N 3.39Å; T761-A764 VanDerWaalsContact OG1-CB 3.28Å; T761-A764 WeakPolarHBondContact OG1-CB 3.4Å; T761-A764 PolarHBondContact OG1-N 2.81Å; A764-E767 PolarHBondContact O-N 3.29Å; A764-L768 WeakPolarHBondContact O-CB 3.33Å; A764-L768 PolarHBondContact O-N 2.64Å
765	I	81.7	Confident	82.5	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-68	-45.2	176.7	-63.6	174.6	0	0	0	110.9	F758 Y759 T761 S762 S763 E767 L768 V769 F786 F816 I820	F758-I765 VanDerWaalsContact O-CG1 3.22Å; F758-I765 WeakPolarHBondContact O-CG1 3.48Å; F758-I765 PolarHBondContact O-N 2.63Å; Y759-I765 HydrophobicContact CD1-CD1 4.08Å; Y759-I765 HydrophobicContact CD1-CG1 4.11Å; T761-I765 PolarHBondContact O-N 3.08Å; S762-I765 PolarHBondContact O-N 3.24Å; S763-I765 VanDerWaalsContact C-N 3.31Å; S763-I765 PolarHBondContact O-N 3.04Å; I765-E767 VanDerWaalsContact C-N 3.27Å; I765-E767 PolarHBondContact O-N 2.92Å; I765-L768 PolarHBondContact O-N 2.94Å; I765-V769 HydrophobicContact CG2-CG2 4.37Å; I765-V769 WeakPolarHBondContact O-CB 3.28Å; I765-V769 VanDerWaalsContact O-CG2 3.31Å; I765-V769 WeakPolarHBondContact O-CG2 3.22Å; I765-V769 PolarHBondContact O-N 3.11Å; I765-F786 HydrophobicContact CG2-CZ 4.37Å; I765-F816 HydrophobicContact CD1-CD1 4.44Å; I765-F816 HydrophobicContact CD1-CD2 4.08Å; I765-F816 HydrophobicContact CD1-CE1 3.82Å; I765-F816 HydrophobicContact CD1-CE2 3.4Å; I765-F816 HydrophobicContact CD1-CZ 3.16Å; I765-F816 HydrophobicContact CG2-CD2 4.04Å; I765-F816 HydrophobicContact CG2-CE2 4.09Å; I765-I820 HydrophobicContact CG2-CG2 3.91Å
766	K	80.6	Confident	82.2	Confident	93 Å²	93	40 Å²	40	40%	0.404	23%	0.23	S	C	.	.	H	α-helix	trans	-55.5	-47.6	175.6	-72.2	-179.6	-149.5	-140.6	0	110.9	S762 S763 V769 T770 E819	S762-K766 WeakPolarHBondContact O-CG 3.22Å; S762-K766 PolarHBondContact O-N 3Å; S762-K766 WeakPolarHBondContact OG-CE 3.45Å; S763-K766 PolarHBondContact O-N 3.45Å; K766-V769 PolarHBondContact O-N 3.18Å; K766-T770 WeakPolarHBondContact O-CG2 3.42Å; K766-T770 PolarHBondContact O-N 2.82Å; K766-E819 WeakPolarHBondContact CD-OE2 3.24Å; K766-E819 VanDerWaalsContact CE-CD 3.49Å; K766-E819 WeakPolarHBondContact CE-OE1 2.99Å; K766-E819 WeakPolarHBondContact CE-OE2 3.13Å; K766-E819 WeakPolarHBondContact CG-OE2 3.07Å; K766-E819 IonicContact NZ-OE1 3.52Å; K766-E819 PolarHBondContact NZ-OE1 2.71Å; K766-E819 IonicContact NZ-OE2 2.71Å
767	E	85.5	Confident	82.3	Confident	54 Å²	54	38.8 Å²	38.8	25%	0.252	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-48.8	177.7	174.6	165.2	-142.5	0	0	112.1	R712 S763 A764 I765 V769 T770 I771	R712-E767 WeakPolarHBondContact CD-OE1 3.47Å; R712-E767 IonicContact CZ-OE1 3.47Å; R712-E767 IonicContact CZ-OE2 2.75Å; R712-E767 VanDerWaalsContact NE-CD 3.33Å; R712-E767 IonicContact NE-OE1 3.37Å; R712-E767 PolarHBondContact NE-OE1 3.11Å; R712-E767 IonicContact NE-OE2 3.53Å; R712-E767 IonicContact NH2-OE1 2.78Å; R712-E767 PolarHBondContact NH2-OE1 3.2Å; R712-E767 IonicContact NH2-OE2 3.96Å; R712-E767 PolarHBondContact NH2-OE2 2.98Å; S763-E767 WeakPolarHBondContact O-CB 3.07Å; S763-E767 PolarHBondContact O-N 2.82Å; A764-E767 PolarHBondContact O-N 3.29Å; I765-E767 VanDerWaalsContact C-N 3.27Å; I765-E767 PolarHBondContact O-N 2.92Å; E767-V769 VanDerWaalsContact C-N 3.28Å; E767-V769 PolarHBondContact O-N 3.09Å; E767-T770 WeakPolarHBondContact CA-OG1 3.34Å; E767-T770 PolarHBondContact O-N 3.12Å; E767-T770 PolarHBondContact O-OG1 3.36Å; E767-I771 HydrophobicContact CG-CD1 3.79Å; E767-I771 HydrophobicContact CG-CG1 4.47Å; E767-I771 WeakPolarHBondContact O-CG1 3.21Å; E767-I771 PolarHBondContact O-N 3.19Å
768	L	88.2	Confident	82.3	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-56.3	-44.9	177.8	176.2	62.8	0	0	0	111.4	F737 F758 A764 I765 T770 I771 L772 F786	F737-L768 HydrophobicContact CD2-CD1 3.74Å; F737-L768 HydrophobicContact CD2-CD2 4.36Å; F737-L768 HydrophobicContact CE2-CD1 3.94Å; F737-L768 HydrophobicContact CE2-CD2 3.69Å; F737-L768 HydrophobicContact CE2-CG 4.39Å; F737-L768 HydrophobicContact CZ-CD2 4.36Å; F758-L768 HydrophobicContact CB-CD2 4.01Å; F758-L768 HydrophobicContact CD1-CD1 4.09Å; F758-L768 HydrophobicContact CD1-CD2 4.09Å; F758-L768 HydrophobicContact CD1-CG 4.49Å; F758-L768 HydrophobicContact CE1-CD1 4.07Å; F758-L768 HydrophobicContact CG-CD2 4Å; A764-L768 WeakPolarHBondContact O-CB 3.33Å; A764-L768 PolarHBondContact O-N 2.64Å; I765-L768 PolarHBondContact O-N 2.94Å; L768-T770 PolarHBondContact O-N 2.88Å; L768-I771 PolarHBondContact O-N 3.3Å; L768-L772 HydrophobicContact CD1-CD1 3.98Å; L768-L772 HydrophobicContact CD1-CG 4.03Å; L768-L772 HydrophobicContact CG-CD1 3.97Å; L768-L772 HydrophobicContact CG-CG 4.38Å; L768-L772 WeakPolarHBondContact O-CB 3.45Å; L768-L772 WeakPolarHBondContact O-CG 3.45Å; L768-L772 PolarHBondContact O-N 3.35Å; L768-F786 HydrophobicContact CD2-CD2 4.22Å; L768-F786 HydrophobicContact CD2-CE2 4.02Å
769	V	86	Confident	82.2	Confident	14 Å²	14	50 Å²	50	9%	0.085	28%	0.281	C	S	.	.	H	α-helix	trans	-61.2	-44.3	176.3	168.8	0	0	0	0	111	I765 K766 E767 I771 L772 N773 F786 I820 Y823	I765-V769 HydrophobicContact CG2-CG2 4.37Å; I765-V769 WeakPolarHBondContact O-CB 3.28Å; I765-V769 VanDerWaalsContact O-CG2 3.31Å; I765-V769 WeakPolarHBondContact O-CG2 3.22Å; I765-V769 PolarHBondContact O-N 3.11Å; K766-V769 PolarHBondContact O-N 3.18Å; E767-V769 VanDerWaalsContact C-N 3.28Å; E767-V769 PolarHBondContact O-N 3.09Å; V769-I771 VanDerWaalsContact C-N 3.29Å; V769-I771 PolarHBondContact O-N 3.27Å; V769-L772 PolarHBondContact O-N 3.46Å; V769-N773 PolarHBondContact O-N 3.36Å; V769-N773 VanDerWaalsContact O-N 3.11Å; V769-N773 PolarHBondContact O-ND2 3.29Å; V769-F786 HydrophobicContact CG2-CE2 4.18Å; V769-F786 HydrophobicContact CG2-CZ 4.35Å; V769-I820 HydrophobicContact CG2-CG2 4.39Å; V769-Y823 HydrophobicContact CG1-CD1 4.16Å; V769-Y823 HydrophobicContact CG1-CD2 3.39Å; V769-Y823 HydrophobicContact CG1-CE1 3.93Å; V769-Y823 HydrophobicContact CG1-CE2 3.12Å; V769-Y823 HydrophobicContact CG1-CG 3.94Å; V769-Y823 VanDerWaalsContact CG1-CZ 3.46Å; V769-Y823 HydrophobicContact CG2-CD2 4.35Å
770	T	84.4	Confident	82.3	Confident	79 Å²	79	52.4 Å²	52.4	49%	0.485	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-36.4	176.6	66.8	0	0	0	0	112.8	K766 E767 L768 N773	K766-T770 WeakPolarHBondContact O-CG2 3.42Å; K766-T770 PolarHBondContact O-N 2.82Å; E767-T770 WeakPolarHBondContact CA-OG1 3.34Å; E767-T770 PolarHBondContact O-N 3.12Å; E767-T770 PolarHBondContact O-OG1 3.36Å; L768-T770 PolarHBondContact O-N 2.88Å; T770-N773 WeakPolarHBondContact O-CB 3.23Å
771	I	87.6	Confident	82.9	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-68.9	-48.8	176.8	-71.8	166.1	0	0	0	110.5	L711 R712 N715 P733 E767 L768 V769 N773 S774	L711-I771 HydrophobicContact CB-CD1 4.4Å; L711-I771 HydrophobicContact CB-CG2 4.29Å; L711-I771 HydrophobicContact CD2-CG2 4.49Å; R712-I771 HydrophobicContact CG-CD1 3.85Å; N715-I771 HydrophobicContact CB-CB 4.3Å; N715-I771 HydrophobicContact CB-CG1 4.02Å; N715-I771 HydrophobicContact CB-CG2 4.09Å; P733-I771 HydrophobicContact CB-CG2 3.89Å; E767-I771 HydrophobicContact CG-CD1 3.79Å; E767-I771 HydrophobicContact CG-CG1 4.47Å; E767-I771 WeakPolarHBondContact O-CG1 3.21Å; E767-I771 PolarHBondContact O-N 3.19Å; L768-I771 PolarHBondContact O-N 3.3Å; V769-I771 VanDerWaalsContact C-N 3.29Å; V769-I771 PolarHBondContact O-N 3.27Å; I771-N773 PolarHBondContact O-N 3.36Å; I771-S774 WeakPolarHBondContact O-CB 3.38Å; I771-S774 PolarHBondContact O-N 3.37Å; I771-S774 PolarHBondContact O-OG 2.86Å
772	L	87.9	Confident	83.4	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-26.1	-177.1	-71.5	178.4	0	0	0	113	A734 F737 L768 V769 S774 S775 V782 F786	A734-L772 HydrophobicContact CB-CD2 4.49Å; F737-L772 HydrophobicContact CB-CD2 3.9Å; F737-L772 HydrophobicContact CD1-CD2 4.43Å; F737-L772 HydrophobicContact CG-CD2 4.1Å; L768-L772 HydrophobicContact CD1-CD1 3.98Å; L768-L772 HydrophobicContact CD1-CG 4.03Å; L768-L772 HydrophobicContact CG-CD1 3.97Å; L768-L772 HydrophobicContact CG-CG 4.38Å; L768-L772 WeakPolarHBondContact O-CB 3.45Å; L768-L772 WeakPolarHBondContact O-CG 3.45Å; L768-L772 PolarHBondContact O-N 3.35Å; V769-L772 PolarHBondContact O-N 3.46Å; L772-S774 PolarHBondContact O-N 3.37Å; L772-S775 WeakPolarHBondContact O-CB 3.45Å; L772-S775 PolarHBondContact O-N 3.49Å; L772-S775 VanDerWaalsContact O-N 3.15Å; L772-V782 HydrophobicContact CB-CG1 3.79Å; L772-V782 HydrophobicContact CD1-CG1 4.36Å; L772-V782 HydrophobicContact CD2-CG1 4.47Å; L772-V782 HydrophobicContact CG-CG1 4.43Å; L772-F786 HydrophobicContact CD1-CB 4.41Å; L772-F786 HydrophobicContact CD1-CD2 4.05Å
773	N	83.5	Confident	84	Confident	85 Å²	85	47.9 Å²	47.9	46%	0.455	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.9	171.6	-85	-47.5	0	0	0	115.3	V769 T770 I771 S775 Y823	V769-N773 PolarHBondContact O-N 3.36Å; V769-N773 VanDerWaalsContact O-N 3.11Å; V769-N773 PolarHBondContact O-ND2 3.29Å; T770-N773 WeakPolarHBondContact O-CB 3.23Å; I771-N773 PolarHBondContact O-N 3.36Å; N773-S775 VanDerWaalsContact C-N 3.25Å; N773-S775 PolarHBondContact O-N 3.27Å; N773-Y823 PolarHBondContact ND2-OH 3.09Å; N773-Y823 WeakPolarHBondContact OD1-CE1 3.34Å; N773-Y823 PolarHBondContact OD1-OH 2.95Å
774	S	83.4	Confident	84.5	Confident	28 Å²	28	44.2 Å²	44.2	20%	0.196	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-5.9	179.7	70.9	0	0	0	0	113.4	N715 P733 I771 L772	N715-S774 WeakPolarHBondContact OD1-CB 3.5Å; N715-S774 PolarHBondContact OD1-OG 3.42Å; P733-S774 WeakPolarHBondContact CG-OG 3.43Å; I771-S774 WeakPolarHBondContact O-CB 3.38Å; I771-S774 PolarHBondContact O-N 3.37Å; I771-S774 PolarHBondContact O-OG 2.86Å; L772-S774 PolarHBondContact O-N 3.37Å
775	S	85	Confident	84.8	Confident	18 Å²	18	44.2 Å²	44.2	13%	0.126	24%	0.235	C	C	.	.			trans	-62.8	148	179.7	177.8	0	0	0	0	112.5	D732 A734 L772 N773 K777	D732-S775 VanDerWaalsContact CG-OG 3.29Å; D732-S775 WeakPolarHBondContact OD1-CB 3.44Å; D732-S775 PolarHBondContact OD1-OG 2.9Å; D732-S775 PolarHBondContact OD2-OG 2.84Å; A734-S775 WeakPolarHBondContact CB-OG 3.47Å; L772-S775 WeakPolarHBondContact O-CB 3.45Å; L772-S775 PolarHBondContact O-N 3.49Å; L772-S775 VanDerWaalsContact O-N 3.15Å; N773-S775 VanDerWaalsContact C-N 3.25Å; N773-S775 PolarHBondContact O-N 3.27Å; S775-K777 VanDerWaalsContact C-N 3.34Å; S775-K777 PolarHBondContact OG-N 2.93Å; S775-K777 VanDerWaalsContact OG-N 3.08Å
776	K	81.3	Confident	85.2	Confident	100 Å²	100	44.3 Å²	44.3	44%	0.435	24%	0.235	S	C	.	.	S	Bend	trans	-81.3	-12.6	171.3	-72.7	170.4	-166	171.7	0	113.4	F718 R721 D732	F718-K776 HydrophobicContact CD1-CD 4.47Å; F718-K776 HydrophobicContact CD1-CG 4.31Å; F718-K776 HydrophobicContact CE1-CD 3.65Å; F718-K776 HydrophobicContact CE1-CG 3.77Å; F718-K776 HydrophobicContact CZ-CD 4.45Å; R721-K776 VanDerWaalsContact NE-CE 3.29Å; D732-K776 PolarHBondContact OD2-N 3.48Å
777	K	83.4	Confident	85.5	Confident	69 Å²	69	39.9 Å²	39.9	30%	0.3	22%	0.216	S	C	.	.	S	Bend	trans	-67.6	156.9	-179.7	-68.8	-162.7	179.8	179.7	0	110.4	A734 D735 S775 T779 T781 V782	A734-K777 HydrophobicContact CB-CD 3.96Å; A734-K777 HydrophobicContact CB-CG 4.36Å; D735-K777 WeakPolarHBondContact OD1-CE 3.3Å; D735-K777 IonicContact OD1-NZ 2.85Å; D735-K777 PolarHBondContact OD1-NZ 3.16Å; S775-K777 VanDerWaalsContact C-N 3.34Å; S775-K777 PolarHBondContact OG-N 2.93Å; S775-K777 VanDerWaalsContact OG-N 3.08Å; K777-T779 PolarHBondContact O-N 3.4Å; K777-T781 HydrophobicContact CB-CG2 4.44Å; K777-T781 HydrophobicContact CD-CG2 3.85Å; K777-V782 HydrophobicContact CB-CG2 3.81Å
778	E	83.2	Confident	85.7	Confident	140 Å²	140	37.6 Å²	37.6	65%	0.654	21%	0.206	S	C	*	.			trans	-56.6	139.3	173.5	-61.6	-172.9	174.9	0	0	110	S780 T781 V782	E778-S780 VanDerWaalsContact CB-OG 3.31Å; E778-S780 WeakPolarHBondContact CB-OG 3.41Å; E778-S780 PolarHBondContact O-N 2.95Å; E778-S780 VanDerWaalsContact O-N 3.09Å; E778-S780 PolarHBondContact OE2-OG 2.89Å; E778-T781 WeakPolarHBondContact O-CB 3.1Å; E778-T781 PolarHBondContact O-N 3.13Å; E778-V782 PolarHBondContact O-N 3.38Å; E778-V782 VanDerWaalsContact O-N 3.1Å
779	T	81.2	Confident	85.8	Confident	126 Å²	126	37.4 Å²	37.4	77%	0.773	21%	0.205	S	C	*	.	H	α-helix	trans	-55.8	-31.4	-179.9	53.7	0	0	0	0	111.9	K777 A783	K777-T779 PolarHBondContact O-N 3.4Å; T779-A783 WeakPolarHBondContact O-CB 3.4Å; T779-A783 PolarHBondContact O-N 2.85Å
780	S	82.7	Confident	85.8	Confident	50 Å²	50	36.8 Å²	36.8	35%	0.35	20%	0.201	S	C	.	.	H	α-helix	trans	-60.2	-50.9	172.3	43.8	0	0	0	0	112.1	E778 A783 W784	E778-S780 VanDerWaalsContact CB-OG 3.31Å; E778-S780 WeakPolarHBondContact CB-OG 3.41Å; E778-S780 PolarHBondContact O-N 2.95Å; E778-S780 VanDerWaalsContact O-N 3.09Å; E778-S780 PolarHBondContact OE2-OG 2.89Å; S780-A783 WeakPolarHBondContact O-CB 3.45Å; S780-A783 PolarHBondContact O-N 3.39Å; S780-W784 PolarHBondContact O-N 2.85Å
781	T	85.7	Confident	85.9	Confident	26 Å²	26	33.1 Å²	33.1	16%	0.16	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-47.3	179.5	-61	0	0	0	0	111.1	K777 E778 A783 W784 L785 Y868	K777-T781 HydrophobicContact CB-CG2 4.44Å; K777-T781 HydrophobicContact CD-CG2 3.85Å; E778-T781 WeakPolarHBondContact O-CB 3.1Å; E778-T781 PolarHBondContact O-N 3.13Å; T781-A783 VanDerWaalsContact C-N 3.31Å; T781-A783 PolarHBondContact O-N 3.06Å; T781-W784 PolarHBondContact O-N 3.45Å; T781-L785 HydrophobicContact CG2-CD1 4.11Å; T781-L785 HydrophobicContact CG2-CG 4.45Å; T781-L785 VanDerWaalsContact O-CG 3.32Å; T781-L785 WeakPolarHBondContact O-CG 3.33Å; T781-L785 PolarHBondContact O-N 3Å; T781-Y868 HydrophobicContact CG2-CE1 4.15Å; T781-Y868 WeakPolarHBondContact CG2-OH 3.41Å; T781-Y868 PolarHBondContact OG1-OH 3Å
782	V	87	Confident	85.9	Confident	9 Å²	9	32.9 Å²	32.9	6%	0.055	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-42.8	178.1	179.9	0	0	0	0	110.9	A734 L772 K777 E778 W784 L785 F786	A734-V782 HydrophobicContact CB-CG2 4.14Å; L772-V782 HydrophobicContact CB-CG1 3.79Å; L772-V782 HydrophobicContact CD1-CG1 4.36Å; L772-V782 HydrophobicContact CD2-CG1 4.47Å; L772-V782 HydrophobicContact CG-CG1 4.43Å; K777-V782 HydrophobicContact CB-CG2 3.81Å; E778-V782 PolarHBondContact O-N 3.38Å; E778-V782 VanDerWaalsContact O-N 3.1Å; V782-W784 PolarHBondContact O-N 3.37Å; V782-L785 PolarHBondContact O-N 3.02Å; V782-F786 WeakPolarHBondContact O-CB 3.4Å; V782-F786 PolarHBondContact O-N 3.5Å
783	A	85.6	Confident	85.8	Confident	5 Å²	5	33.3 Å²	33.3	4%	0.041	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-43.6	176.6	0	0	0	0	0	112.4	T779 S780 T781 F787 Y823 P825	T779-A783 WeakPolarHBondContact O-CB 3.4Å; T779-A783 PolarHBondContact O-N 2.85Å; S780-A783 WeakPolarHBondContact O-CB 3.45Å; S780-A783 PolarHBondContact O-N 3.39Å; T781-A783 VanDerWaalsContact C-N 3.31Å; T781-A783 PolarHBondContact O-N 3.06Å; A783-F787 VanDerWaalsContact O-CB 3.23Å; A783-F787 WeakPolarHBondContact O-CB 3.47Å; A783-F787 PolarHBondContact O-N 2.87Å; A783-Y823 WeakPolarHBondContact CA-O 3.47Å; A783-Y823 WeakPolarHBondContact CB-O 3.18Å; A783-P825 HydrophobicContact CB-CG 4.44Å
784	W	88.3	Confident	85.7	Confident	5 Å²	5	29.5 Å²	29.5	2%	0.019	16%	0.158	C	C	.	.	H	α-helix	trans	-65.6	-46.6	175.3	-82.5	110.3	0	0	0	112.3	S780 T781 V782 F786 F787 V788 P825 I828 F861 V864 Y868	S780-W784 PolarHBondContact O-N 2.85Å; T781-W784 PolarHBondContact O-N 3.45Å; V782-W784 PolarHBondContact O-N 3.37Å; W784-F786 VanDerWaalsContact C-N 3.32Å; W784-F786 PolarHBondContact O-N 3.35Å; W784-F787 AromaticContact CE3-CD1 4Å; W784-F787 HydrophobicContact CE3-CD1 4Å; W784-F787 AromaticContact CZ3-CD1 3.97Å; W784-F787 HydrophobicContact CZ3-CD1 3.97Å; W784-F787 HydrophobicContact CZ3-CE1 4.15Å; W784-F787 PolarHBondContact O-N 3.24Å; W784-F787 VanDerWaalsContact O-N 3.16Å; W784-V788 VanDerWaalsContact O-CG2 3.3Å; W784-V788 WeakPolarHBondContact O-CG2 3.43Å; W784-V788 PolarHBondContact O-N 3.22Å; W784-P825 HydrophobicContact CD2-CB 3.99Å; W784-P825 HydrophobicContact CD2-CG 3.48Å; W784-P825 VanDerWaalsContact CD2-CG 3.48Å; W784-P825 HydrophobicContact CE3-CG 3.81Å; W784-P825 HydrophobicContact CG-CB 4.42Å; W784-P825 HydrophobicContact CG-CG 3.83Å; W784-P825 HydrophobicContact CH2-CB 4.32Å; W784-P825 HydrophobicContact CH2-CG 4.34Å; W784-P825 HydrophobicContact CZ2-CB 3.73Å; W784-P825 HydrophobicContact CZ2-CG 4.05Å; W784-P825 HydrophobicContact CZ3-CG 4.22Å; W784-I828 HydrophobicContact CZ3-CD1 4.46Å; W784-F861 HydrophobicContact CH2-CE2 4.44Å; W784-F861 HydrophobicContact CZ2-CE2 4.38Å; W784-V864 HydrophobicContact CD2-CG1 4.39Å; W784-V864 HydrophobicContact CZ2-CG1 3.94Å; W784-V864 VanDerWaalsContact NE1-CG1 3.32Å; W784-Y868 HydrophobicContact CB-CD1 3.49Å; W784-Y868 VanDerWaalsContact CB-CD1 3.49Å; W784-Y868 HydrophobicContact CB-CD2 3.57Å; W784-Y868 HydrophobicContact CB-CE1 3.72Å; W784-Y868 HydrophobicContact CB-CE2 3.87Å; W784-Y868 HydrophobicContact CB-CG 3.44Å; W784-Y868 VanDerWaalsContact CB-CG 3.44Å; W784-Y868 AromaticContact CD1-CD2 3.84Å; W784-Y868 AromaticContact CD1-CE2 3.81Å; W784-Y868 AromaticContact CD2-CD2 3.87Å; W784-Y868 HydrophobicContact CD2-CD2 3.87Å; W784-Y868 HydrophobicContact CD2-CG 4.2Å; W784-Y868 HydrophobicContact CE3-CD2 4.4Å; W784-Y868 HydrophobicContact CE3-CG 4.39Å; W784-Y868 HydrophobicContact CG-CD1 4.33Å; W784-Y868 AromaticContact CG-CD2 3.48Å; W784-Y868 HydrophobicContact CG-CD2 3.48Å; W784-Y868 VanDerWaalsContact CG-CD2 3.48Å; W784-Y868 AromaticContact CG-CE2 3.84Å; W784-Y868 HydrophobicContact CG-CE2 3.84Å; W784-Y868 AromaticContact CG-CG 3.82Å; W784-Y868 HydrophobicContact CG-CG 3.82Å
785	L	89.2	Confident	85.7	Confident	12 Å²	12	28.4 Å²	28.4	6%	0.063	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-47.3	177.1	-69.2	173.6	0	0	0	111.5	A734 F737 T781 V782 F787 V788 A789 Y868	A734-L785 HydrophobicContact CB-CD1 4.31Å; F737-L785 HydrophobicContact CD1-CB 4.48Å; F737-L785 HydrophobicContact CE1-CB 4.42Å; T781-L785 HydrophobicContact CG2-CD1 4.11Å; T781-L785 HydrophobicContact CG2-CG 4.45Å; T781-L785 VanDerWaalsContact O-CG 3.32Å; T781-L785 WeakPolarHBondContact O-CG 3.33Å; T781-L785 PolarHBondContact O-N 3Å; V782-L785 PolarHBondContact O-N 3.02Å; L785-F787 PolarHBondContact O-N 3.18Å; L785-V788 PolarHBondContact O-N 3.22Å; L785-A789 WeakPolarHBondContact O-CB 3.2Å; L785-A789 PolarHBondContact O-N 3.47Å; L785-Y868 HydrophobicContact CD2-CD1 4.28Å; L785-Y868 HydrophobicContact CD2-CE1 4.24Å; L785-Y868 HydrophobicContact CG-CE1 4.3Å
786	F	88.8	Confident	85.4	Confident	3 Å²	3	27.7 Å²	27.7	1%	0.013	15%	0.145	C	C	.	.	H	α-helix	trans	-59.6	-45.4	176	176.6	-94.9	0	0	0	111.9	Y759 I765 L768 V769 L772 V782 W784 L790 I820	Y759-F786 HydrophobicContact CE1-CD2 4.44Å; Y759-F786 AromaticContact CE1-CE2 3.75Å; Y759-F786 HydrophobicContact CE1-CE2 3.75Å; Y759-F786 AromaticContact CE1-CZ 3.95Å; Y759-F786 HydrophobicContact CE1-CZ 3.95Å; Y759-F786 PolarHBondContact OH-O 2.87Å; Y759-F786 VanDerWaalsContact OH-O 3.13Å; I765-F786 HydrophobicContact CG2-CZ 4.37Å; L768-F786 HydrophobicContact CD2-CD2 4.22Å; L768-F786 HydrophobicContact CD2-CE2 4.02Å; V769-F786 HydrophobicContact CG2-CE2 4.18Å; V769-F786 HydrophobicContact CG2-CZ 4.35Å; L772-F786 HydrophobicContact CD1-CB 4.41Å; L772-F786 HydrophobicContact CD1-CD2 4.05Å; V782-F786 WeakPolarHBondContact O-CB 3.4Å; V782-F786 PolarHBondContact O-N 3.5Å; W784-F786 VanDerWaalsContact C-N 3.32Å; W784-F786 PolarHBondContact O-N 3.35Å; F786-L790 HydrophobicContact CE1-CD2 4.34Å; F786-L790 WeakPolarHBondContact O-CB 3.36Å; F786-L790 PolarHBondContact O-N 3.45Å; F786-I820 HydrophobicContact CE1-CB 4.25Å; F786-I820 HydrophobicContact CE1-CG2 4.01Å; F786-I820 HydrophobicContact CZ-CG2 3.79Å
787	F	87.5	Confident	85	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.7	-44.2	-179.3	172.9	-106.8	0	0	0	112.6	A783 W784 L785 L790 L791 L824 P825 I828 I833 I841 I845 I869	A783-F787 VanDerWaalsContact O-CB 3.23Å; A783-F787 WeakPolarHBondContact O-CB 3.47Å; A783-F787 PolarHBondContact O-N 2.87Å; W784-F787 AromaticContact CE3-CD1 4Å; W784-F787 HydrophobicContact CE3-CD1 4Å; W784-F787 AromaticContact CZ3-CD1 3.97Å; W784-F787 HydrophobicContact CZ3-CD1 3.97Å; W784-F787 HydrophobicContact CZ3-CE1 4.15Å; W784-F787 PolarHBondContact O-N 3.24Å; W784-F787 VanDerWaalsContact O-N 3.16Å; L785-F787 PolarHBondContact O-N 3.18Å; F787-L790 WeakPolarHBondContact O-CB 3.35Å; F787-L790 PolarHBondContact O-N 3.19Å; F787-L791 HydrophobicContact CD1-CD1 4.02Å; F787-L791 HydrophobicContact CD2-CG 4.48Å; F787-L791 HydrophobicContact CE1-CD1 3.3Å; F787-L791 HydrophobicContact CE1-CG 4.01Å; F787-L791 HydrophobicContact CE2-CD1 4.13Å; F787-L791 HydrophobicContact CE2-CD2 4.24Å; F787-L791 HydrophobicContact CE2-CG 3.96Å; F787-L791 HydrophobicContact CZ-CD1 3.36Å; F787-L791 HydrophobicContact CZ-CD2 4.05Å; F787-L791 HydrophobicContact CZ-CG 3.7Å; F787-L791 WeakPolarHBondContact O-CG 3.24Å; F787-L791 PolarHBondContact O-N 3.41Å; F787-L824 HydrophobicContact CD2-CD2 4.08Å; F787-P825 HydrophobicContact CB-CG 4.28Å; F787-I828 HydrophobicContact CD1-CD1 3.61Å; F787-I828 HydrophobicContact CD2-CD1 3.81Å; F787-I828 HydrophobicContact CE1-CD1 3.3Å; F787-I828 HydrophobicContact CE2-CD1 3.52Å; F787-I828 HydrophobicContact CE2-CG2 4.45Å; F787-I828 HydrophobicContact CG-CD1 3.84Å; F787-I828 HydrophobicContact CZ-CD1 3.25Å; F787-I833 HydrophobicContact CE2-CD1 4.44Å; F787-I841 HydrophobicContact CE2-CG2 4.2Å; F787-I841 HydrophobicContact CZ-CG2 3.65Å; F787-I845 HydrophobicContact CE1-CD1 4.19Å; F787-I845 HydrophobicContact CZ-CD1 4.12Å; F787-I869 HydrophobicContact CE1-CD1 4.42Å
788	V	89.4	Confident	84.5	Confident	6 Å²	6	24.8 Å²	24.8	4%	0.036	13%	0.13	C	C	.	.	H	α-helix	trans	-66.4	-42	179	-174.8	0	0	0	0	110.5	M742 W784 L785 L790 L791 T792 I869 L872	M742-V788 HydrophobicContact CE-CB 4.47Å; M742-V788 HydrophobicContact CE-CG1 3.45Å; M742-V788 VanDerWaalsContact CE-CG1 3.45Å; W784-V788 VanDerWaalsContact O-CG2 3.3Å; W784-V788 WeakPolarHBondContact O-CG2 3.43Å; W784-V788 PolarHBondContact O-N 3.22Å; L785-V788 PolarHBondContact O-N 3.22Å; V788-L790 VanDerWaalsContact C-N 3.34Å; V788-L790 PolarHBondContact O-N 3.18Å; V788-L791 WeakPolarHBondContact O-CB 3.34Å; V788-L791 PolarHBondContact O-N 3.19Å; V788-T792 PolarHBondContact O-N 3.15Å; V788-T792 PolarHBondContact O-OG1 3.39Å; V788-I869 HydrophobicContact CG2-CD1 3.9Å; V788-L872 HydrophobicContact CG1-CB 3.77Å
789	A	89.6	Confident	83.8	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.2	-38.4	174.7	0	0	0	0	0	112.7	F737 T741 Y759 L785 T792 Y793	F737-A789 HydrophobicContact CE1-CB 3.87Å; F737-A789 HydrophobicContact CZ-CB 3.53Å; T741-A789 HydrophobicContact CG2-CB 4.18Å; Y759-A789 HydrophobicContact CE2-CB 4.32Å; Y759-A789 WeakPolarHBondContact OH-CB 3.4Å; L785-A789 WeakPolarHBondContact O-CB 3.2Å; L785-A789 PolarHBondContact O-N 3.47Å; A789-T792 PolarHBondContact O-N 3.4Å; A789-Y793 PolarHBondContact O-N 3.18Å
790	L	86.8	Confident	82.8	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-62.8	-43.8	173.1	176.2	63.9	0	0	0	111.5	Y759 F786 F787 V788 T792 Y793 C794 F813 I820 L836	Y759-L790 HydrophobicContact CD1-CD1 3.72Å; Y759-L790 HydrophobicContact CE1-CB 3.99Å; Y759-L790 HydrophobicContact CE1-CD1 3.81Å; Y759-L790 HydrophobicContact CE1-CG 4.46Å; Y759-L790 HydrophobicContact CG-CD1 4.38Å; Y759-L790 PolarHBondContact OH-N 3.22Å; F786-L790 HydrophobicContact CE1-CD2 4.34Å; F786-L790 WeakPolarHBondContact O-CB 3.36Å; F786-L790 PolarHBondContact O-N 3.45Å; F787-L790 WeakPolarHBondContact O-CB 3.35Å; F787-L790 PolarHBondContact O-N 3.19Å; V788-L790 VanDerWaalsContact C-N 3.34Å; V788-L790 PolarHBondContact O-N 3.18Å; L790-T792 VanDerWaalsContact C-N 3.35Å; L790-T792 PolarHBondContact O-N 2.85Å; L790-Y793 HydrophobicContact CD1-CD1 4.49Å; L790-Y793 WeakPolarHBondContact O-CB 3.42Å; L790-Y793 PolarHBondContact O-N 3.21Å; L790-C794 PolarHBondContact O-N 3.31Å; L790-C794 PolarHBondContact O-SG 2.75Å; L790-C794 VanDerWaalsContact O-SG 3.34Å; L790-F813 HydrophobicContact CD1-CZ 4.28Å; L790-I820 HydrophobicContact CD2-CD1 4.46Å; L790-L836 HydrophobicContact CD2-CD2 4.13Å; L790-L836 HydrophobicContact CG-CD2 4.29Å
791	L	86.9	Confident	81.7	Confident	1 Å²	1	14.4 Å²	14.4	1%	0.005	7%	0.073	C	C	.	.	H	α-helix	trans	-59.1	-46.5	174.1	-78.9	179.2	0	0	0	111.2	F787 V788 Y793 C794 L795 I841 F842 I869	F787-L791 HydrophobicContact CD1-CD1 4.02Å; F787-L791 HydrophobicContact CD2-CG 4.48Å; F787-L791 HydrophobicContact CE1-CD1 3.3Å; F787-L791 HydrophobicContact CE1-CG 4.01Å; F787-L791 HydrophobicContact CE2-CD1 4.13Å; F787-L791 HydrophobicContact CE2-CD2 4.24Å; F787-L791 HydrophobicContact CE2-CG 3.96Å; F787-L791 HydrophobicContact CZ-CD1 3.36Å; F787-L791 HydrophobicContact CZ-CD2 4.05Å; F787-L791 HydrophobicContact CZ-CG 3.7Å; F787-L791 WeakPolarHBondContact O-CG 3.24Å; F787-L791 PolarHBondContact O-N 3.41Å; V788-L791 WeakPolarHBondContact O-CB 3.34Å; V788-L791 PolarHBondContact O-N 3.19Å; L791-Y793 VanDerWaalsContact C-N 3.31Å; L791-Y793 PolarHBondContact O-N 3.31Å; L791-C794 PolarHBondContact O-N 2.8Å; L791-C794 VanDerWaalsContact O-N 3.15Å; L791-L795 HydrophobicContact CB-CD1 4.48Å; L791-L795 WeakPolarHBondContact O-CB 3.11Å; L791-L795 WeakPolarHBondContact O-CD1 3.28Å; L791-L795 WeakPolarHBondContact O-CG 3.48Å; L791-L795 PolarHBondContact O-N 3.43Å; L791-I841 HydrophobicContact CD2-CB 4.46Å; L791-I841 HydrophobicContact CD2-CD1 3.84Å; L791-I841 HydrophobicContact CD2-CG2 4.08Å; L791-F842 HydrophobicContact CD1-CE1 4.22Å; L791-F842 HydrophobicContact CD1-CZ 4.45Å; L791-I869 HydrophobicContact CD1-CD1 3.93Å
792	T	87.6	Confident	80	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-58.5	-43.9	176.8	-48.4	0	0	0	0	111.7	M742 M755 V788 A789 L790 C794 L795 F796 L872 F875	M742-T792 HydrophobicContact CE-CG2 4.42Å; M742-T792 WeakPolarHBondContact CE-OG1 3.35Å; M742-T792 HydrophobicContact SD-CG2 4.1Å; M742-T792 PolarHBondContact SD-OG1 2.91Å; M755-T792 HydrophobicContact CE-CG2 3.69Å; M755-T792 HydrophobicContact SD-CG2 3.81Å; V788-T792 PolarHBondContact O-N 3.15Å; V788-T792 PolarHBondContact O-OG1 3.39Å; A789-T792 PolarHBondContact O-N 3.4Å; L790-T792 VanDerWaalsContact C-N 3.35Å; L790-T792 PolarHBondContact O-N 2.85Å; T792-C794 VanDerWaalsContact C-N 3.35Å; T792-C794 PolarHBondContact O-N 3.34Å; T792-L795 PolarHBondContact O-N 2.9Å; T792-F796 HydrophobicContact CG2-CD2 3.79Å; T792-F796 HydrophobicContact CG2-CE2 4.41Å; T792-F796 WeakPolarHBondContact O-CB 3.32Å; T792-F796 PolarHBondContact O-N 3.38Å; T792-L872 HydrophobicContact CG2-CD1 4.31Å; T792-L872 WeakPolarHBondContact OG1-CD1 3.42Å; T792-F875 HydrophobicContact CG2-CD1 3.87Å; T792-F875 HydrophobicContact CG2-CE1 3.55Å; T792-F875 HydrophobicContact CG2-CZ 4.38Å
793	Y	85.6	Confident	77.8	Confident	15 Å²	15	25.1 Å²	25.1	6%	0.059	13%	0.127	C	C	.	.	I	π-helix	trans	-58	-46.5	174.7	169.6	-100.5	0	0	0	111.8	M755 Y759 A789 L790 L791 L795 V797 R798 F811	M755-Y793 HydrophobicContact CB-CD2 4.17Å; Y759-Y793 HydrophobicContact CD2-CD2 4.3Å; Y759-Y793 AromaticContact CD2-CG 3.98Å; Y759-Y793 HydrophobicContact CD2-CG 3.98Å; Y759-Y793 HydrophobicContact CG-CD1 4.19Å; Y759-Y793 HydrophobicContact CG-CD2 4.47Å; Y759-Y793 HydrophobicContact CG-CG 4.07Å; Y759-Y793 PolarHBondContact O-OH 2.92Å; A789-Y793 PolarHBondContact O-N 3.18Å; L790-Y793 HydrophobicContact CD1-CD1 4.49Å; L790-Y793 WeakPolarHBondContact O-CB 3.42Å; L790-Y793 PolarHBondContact O-N 3.21Å; L791-Y793 VanDerWaalsContact C-N 3.31Å; L791-Y793 PolarHBondContact O-N 3.31Å; Y793-L795 VanDerWaalsContact C-N 3.33Å; Y793-L795 PolarHBondContact O-N 3.25Å; Y793-V797 HydrophobicContact CD2-CB 3.49Å; Y793-V797 VanDerWaalsContact CD2-CB 3.49Å; Y793-V797 HydrophobicContact CD2-CG1 3.7Å; Y793-V797 HydrophobicContact CD2-CG2 3.96Å; Y793-V797 HydrophobicContact CE2-CB 3.78Å; Y793-V797 HydrophobicContact CE2-CG1 3.52Å; Y793-V797 HydrophobicContact CG-CB 4.35Å; Y793-V797 WeakPolarHBondContact O-CB 3.15Å; Y793-V797 PolarHBondContact O-N 3.35Å; Y793-R798 PolarHBondContact O-N 3.21Å; Y793-F811 HydrophobicContact CE1-CE1 4.29Å; Y793-F811 HydrophobicContact CE1-CZ 4.05Å
794	C	82.6	Confident	75.6	Confident	4 Å²	4	27.6 Å²	27.6	3%	0.027	14%	0.144	C	C	.	.	I	π-helix	trans	-64.7	-37.2	178.3	-67.8	0	0	0	0	112.9	L790 L791 T792 P838	L790-C794 PolarHBondContact O-N 3.31Å; L790-C794 PolarHBondContact O-SG 2.75Å; L790-C794 VanDerWaalsContact O-SG 3.34Å; L791-C794 PolarHBondContact O-N 2.8Å; L791-C794 VanDerWaalsContact O-N 3.15Å; T792-C794 VanDerWaalsContact C-N 3.35Å; T792-C794 PolarHBondContact O-N 3.34Å; C794-P838 HydrophobicContact CB-CG 4.12Å
795	L	83.3	Confident	73.3	Confident	6 Å²	6	33.4 Å²	33.4	3%	0.031	18%	0.181	C	C	.	.	I	π-helix	trans	-75.5	-37.1	-177.1	-74.5	164.8	0	0	0	113.3	L791 T792 Y793 T799 P838 F842 L872 V914 M917	L791-L795 HydrophobicContact CB-CD1 4.48Å; L791-L795 WeakPolarHBondContact O-CB 3.11Å; L791-L795 WeakPolarHBondContact O-CD1 3.28Å; L791-L795 WeakPolarHBondContact O-CG 3.48Å; L791-L795 PolarHBondContact O-N 3.43Å; T792-L795 PolarHBondContact O-N 2.9Å; Y793-L795 VanDerWaalsContact C-N 3.33Å; Y793-L795 PolarHBondContact O-N 3.25Å; L795-T799 WeakPolarHBondContact O-CG2 3.25Å; L795-T799 PolarHBondContact O-OG1 3.19Å; L795-P838 HydrophobicContact CD2-CB 3.4Å; L795-P838 VanDerWaalsContact CD2-CB 3.4Å; L795-P838 HydrophobicContact CD2-CG 3.67Å; L795-P838 HydrophobicContact CG-CB 3.97Å; L795-P838 HydrophobicContact CG-CG 4Å; L795-F842 HydrophobicContact CD1-CE2 4.47Å; L795-F842 HydrophobicContact CD1-CZ 4.31Å; L795-F842 HydrophobicContact CD2-CE2 4.49Å; L795-L872 HydrophobicContact CD1-CD1 4.42Å; L795-L872 HydrophobicContact CD1-CD2 3.95Å; L795-V914 HydrophobicContact CB-CG2 3.89Å; L795-V914 HydrophobicContact CD1-CG1 3.74Å; L795-V914 HydrophobicContact CD2-CB 4.44Å; L795-V914 HydrophobicContact CD2-CG1 3.99Å; L795-V914 HydrophobicContact CD2-CG2 3.81Å; L795-V914 HydrophobicContact CG-CG1 4.32Å; L795-V914 HydrophobicContact CG-CG2 4.29Å; L795-M917 HydrophobicContact CD2-CE 3.48Å; L795-M917 VanDerWaalsContact CD2-CE 3.48Å
796	F	78.6	Confident	70.8	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.009	22%	0.219	C	C	.	.	I	π-helix	trans	-116.2	-45.4	-169.6	-75.3	-72.5	0	0	0	114.3	F752 T792 T799 V800 I876 C880 V914	F752-F796 HydrophobicContact CE1-CB 3.74Å; F752-F796 HydrophobicContact CE1-CG 4.46Å; F752-F796 HydrophobicContact CZ-CB 4.3Å; T792-F796 HydrophobicContact CG2-CD2 3.79Å; T792-F796 HydrophobicContact CG2-CE2 4.41Å; T792-F796 WeakPolarHBondContact O-CB 3.32Å; T792-F796 PolarHBondContact O-N 3.38Å; F796-T799 PolarHBondContact O-OG1 3.26Å; F796-V800 WeakPolarHBondContact O-CB 3.32Å; F796-V800 WeakPolarHBondContact O-CG2 3.3Å; F796-V800 PolarHBondContact O-N 3.5Å; F796-I876 HydrophobicContact CE2-CD1 4.47Å; F796-I876 HydrophobicContact CE2-CG1 3.74Å; F796-I876 HydrophobicContact CZ-CG1 3.78Å; F796-I876 HydrophobicContact CZ-CG2 4.31Å; F796-C880 VanDerWaalsContact CE1-SG 3.52Å; F796-V914 HydrophobicContact CE1-CG2 4.19Å; F796-V914 HydrophobicContact CE2-CG1 4.5Å; F796-V914 HydrophobicContact CE2-CG2 4.05Å; F796-V914 HydrophobicContact CZ-CB 4.23Å; F796-V914 HydrophobicContact CZ-CG2 3.77Å
797	V	73.1	Confident	68.6	Low	5 Å²	5	44.7 Å²	44.7	3%	0.03	24%	0.24	C	C	.	.	I	π-helix	trans	-84.3	-43.4	-172.1	-178.1	0	0	0	0	110.6	F752 M755 K756 Y793 N801	F752-V797 HydrophobicContact CB-CG2 4.48Å; F752-V797 HydrophobicContact CD1-CG2 3.79Å; F752-V797 HydrophobicContact CG-CG2 4.47Å; M755-V797 HydrophobicContact CB-CG2 4.06Å; M755-V797 HydrophobicContact SD-CG2 4.49Å; K756-V797 HydrophobicContact CB-CG1 4.09Å; Y793-V797 HydrophobicContact CD2-CB 3.49Å; Y793-V797 VanDerWaalsContact CD2-CB 3.49Å; Y793-V797 HydrophobicContact CD2-CG1 3.7Å; Y793-V797 HydrophobicContact CD2-CG2 3.96Å; Y793-V797 HydrophobicContact CE2-CB 3.78Å; Y793-V797 HydrophobicContact CE2-CG1 3.52Å; Y793-V797 HydrophobicContact CG-CB 4.35Å; Y793-V797 WeakPolarHBondContact O-CB 3.15Å; Y793-V797 PolarHBondContact O-N 3.35Å; V797-N801 WeakPolarHBondContact CG1-ND2 3.4Å; V797-N801 WeakPolarHBondContact O-CB 3.31Å; V797-N801 VanDerWaalsContact O-CG 3.31Å; V797-N801 PolarHBondContact O-N 3.32Å; V797-N801 VanDerWaalsContact O-N 3.15Å; V797-N801 PolarHBondContact O-ND2 3.45Å
798	R	71.6	Confident	66.2	Low	103 Å²	103	53.8 Å²	53.8	39%	0.389	28%	0.282	S	S	.	.	H	α-helix	trans	-68.3	-43.2	-179.3	-174.7	-179.6	177.4	-172.1	-1.5	111.8	Y793 S802	Y793-R798 PolarHBondContact O-N 3.21Å; R798-S802 WeakPolarHBondContact O-CB 3.41Å; R798-S802 PolarHBondContact O-N 3.14Å
799	T	68	Low	64	Low	43 Å²	43	59.5 Å²	59.5	26%	0.264	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-53.2	178.8	45.4	0	0	0	0	111	L795 F796 N801 S802 F803	L795-T799 WeakPolarHBondContact O-CG2 3.25Å; L795-T799 PolarHBondContact O-OG1 3.19Å; F796-T799 PolarHBondContact O-OG1 3.26Å; T799-N801 PolarHBondContact O-N 3.29Å; T799-S802 PolarHBondContact O-N 3.15Å; T799-S802 PolarHBondContact O-OG 3.43Å; T799-F803 WeakPolarHBondContact O-CD2 3.18Å
800	V	61.3	Low	61.9	Low	23 Å²	23	67.1 Å²	67.1	14%	0.139	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-42.8	179.3	174.8	0	0	0	0	112	F796 S802 F803 L902	F796-V800 WeakPolarHBondContact O-CB 3.32Å; F796-V800 WeakPolarHBondContact O-CG2 3.3Å; F796-V800 PolarHBondContact O-N 3.5Å; V800-S802 PolarHBondContact O-N 3.24Å; V800-F803 PolarHBondContact O-N 2.96Å; V800-L902 HydrophobicContact CG1-CD2 4.12Å
801	N	58.6	Low	60	Low	32 Å²	32	69.8 Å²	69.8	17%	0.171	37%	0.365	C	S	.	.	H	α-helix	trans	-70.9	-29.1	179.3	-71.4	-46.2	0	0	0	113.2	V797 T799 F803 S804	V797-N801 WeakPolarHBondContact CG1-ND2 3.4Å; V797-N801 WeakPolarHBondContact O-CB 3.31Å; V797-N801 VanDerWaalsContact O-CG 3.31Å; V797-N801 PolarHBondContact O-N 3.32Å; V797-N801 VanDerWaalsContact O-N 3.15Å; V797-N801 PolarHBondContact O-ND2 3.45Å; T799-N801 PolarHBondContact O-N 3.29Å; N801-F803 PolarHBondContact O-N 3.45Å; N801-S804 WeakPolarHBondContact O-CB 3.17Å; N801-S804 PolarHBondContact O-N 3.14Å; N801-S804 PolarHBondContact O-OG 3.03Å
802	S	51.6	Low	58.3	Low	85 Å²	85	74.1 Å²	74.1	59%	0.594	39%	0.391	S	S	*	.	H	α-helix	trans	-63.8	-23.4	179.5	70.8	0	0	0	0	113.7	R798 T799 V800 S804	R798-S802 WeakPolarHBondContact O-CB 3.41Å; R798-S802 PolarHBondContact O-N 3.14Å; T799-S802 PolarHBondContact O-N 3.15Å; T799-S802 PolarHBondContact O-OG 3.43Å; V800-S802 PolarHBondContact O-N 3.24Å; S802-S804 VanDerWaalsContact C-N 3.3Å
803	F	39.5	Very low	56.7	Low	175 Å²	175	74.9 Å²	74.9	77%	0.768	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-14.9	173.4	-68.6	-75.2	0	0	0	113.3	T799 V800 N801 T805	T799-F803 WeakPolarHBondContact O-CD2 3.18Å; V800-F803 PolarHBondContact O-N 2.96Å; N801-F803 PolarHBondContact O-N 3.45Å; F803-T805 PolarHBondContact O-N 2.9Å
804	S	40.5	Very low	55.4	Low	57 Å²	57	78.8 Å²	78.8	40%	0.399	42%	0.422	S	S	.	.			trans	-82.8	97.8	171.2	69.9	0	0	0	0	109	N801 S802 E806	N801-S804 WeakPolarHBondContact O-CB 3.17Å; N801-S804 PolarHBondContact O-N 3.14Å; N801-S804 PolarHBondContact O-OG 3.03Å; S802-S804 VanDerWaalsContact C-N 3.3Å; S804-E806 PolarHBondContact O-N 2.99Å
805	T	39	Very low	54.3	Low	128 Å²	128	81.7 Å²	81.7	79%	0.785	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	6.2	-173.8	44	0	0	0	0	115.9	F803	F803-T805 PolarHBondContact O-N 2.9Å
806	E	37.8	Very low	53.5	Low	187 Å²	187	81.5 Å²	81.5	87%	0.874	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	0.6	-167.4	-68.8	-168.9	163.4	0	0	115.9	S804	S804-E806 PolarHBondContact O-N 2.99Å
807	S	41.4	Very low	52.9	Low	64 Å²	64	82.6 Å²	82.6	45%	0.448	45%	0.447	S	S	.	.			trans	-125.4	82.4	174.8	55.8	0	0	0	0	112.6	D809	S807-D809 PolarHBondContact O-N 2.9Å
808	H	37.8	Very low	52.6	Low	191 Å²	191	86.6 Å²	86.6	88%	0.884	48%	0.475	S	S	*	.			trans	-73.2	58.4	156.6	-76.7	-62.5	0	0	0	109.8
809	D	43.8	Very low	52.3	Low	127 Å²	127	84.9 Å²	84.9	68%	0.679	47%	0.471	S	S	*	.			trans	-96.7	105.5	-178.5	-74.3	-23.6	0	0	0	110.4	S807 F811	S807-D809 PolarHBondContact O-N 2.9Å; D809-F811 PolarHBondContact O-N 2.82Å
810	D	43.9	Very low	52.5	Low	159 Å²	159	82.9 Å²	82.9	85%	0.85	46%	0.459	S	S	*	.			trans	43	9.3	147	-74.7	-15	0	0	0	121.9	V812	D810-V812 PolarHBondContact O-N 3.42Å
811	F	47.2	Very low	52.9	Low	58 Å²	58	89.7 Å²	89.7	25%	0.254	48%	0.482	S	S	.	.			trans	-77.7	63.9	178.9	-156.4	-121.2	0	0	0	112	Y759 Y793 D809 F813 F816	Y759-F811 WeakPolarHBondContact O-CE2 3.42Å; Y759-F811 WeakPolarHBondContact O-CZ 3.41Å; Y793-F811 HydrophobicContact CE1-CE1 4.29Å; Y793-F811 HydrophobicContact CE1-CZ 4.05Å; D809-F811 PolarHBondContact O-N 2.82Å; F811-F813 AromaticContact CD1-CD2 3.76Å; F811-F813 HydrophobicContact CD1-CD2 3.76Å; F811-F813 HydrophobicContact CD1-CE2 4.34Å; F811-F813 AromaticContact CE1-CD2 3.02Å; F811-F813 HydrophobicContact CE1-CD2 3.02Å; F811-F813 AromaticContact CE1-CE2 3.22Å; F811-F813 HydrophobicContact CE1-CE2 3.22Å; F811-F813 HydrophobicContact CE1-CG 4.23Å; F811-F813 HydrophobicContact CE2-CD2 4.32Å; F811-F813 HydrophobicContact CE2-CE2 4.29Å; F811-F813 AromaticContact CZ-CD2 3.35Å; F811-F813 HydrophobicContact CZ-CD2 3.35Å; F811-F813 AromaticContact CZ-CE2 3.15Å; F811-F813 HydrophobicContact CZ-CE2 3.15Å; F811-F813 HydrophobicContact CZ-CG 4.46Å; F811-F813 HydrophobicContact CZ-CZ 4.19Å; F811-F813 PolarHBondContact O-N 3.46Å; F811-F816 HydrophobicContact CE2-CE1 4.14Å; F811-F816 HydrophobicContact CE2-CZ 4.42Å; F811-F816 HydrophobicContact CZ-CE1 4.28Å; F811-F816 HydrophobicContact CZ-CZ 4.26Å
812	V	50.8	Low	53.3	Low	91 Å²	91	92.1 Å²	92.1	55%	0.552	51%	0.507	S	S	*	.			trans	-78.5	74.9	171.1	-171	0	0	0	0	107.8	D810 P814 S815	D810-V812 PolarHBondContact O-N 3.42Å; V812-P814 HydrophobicContact CG1-CG 4.38Å; V812-P814 WeakPolarHBondContact O-CD 3.49Å; V812-P814 VanDerWaalsContact O-N 3.12Å; V812-S815 WeakPolarHBondContact O-CB 3.27Å; V812-S815 PolarHBondContact O-N 2.9Å; V812-S815 VanDerWaalsContact O-N 3.09Å; V812-S815 PolarHBondContact O-OG 3.08Å
813	F	55.6	Low	54.3	Low	17 Å²	17	90.5 Å²	90.5	8%	0.075	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-44.1	-38.1	176.6	-139.5	-68	0	0	0	115.2	L790 F811 S815 F816 I817 L836	L790-F813 HydrophobicContact CD1-CZ 4.28Å; F811-F813 AromaticContact CD1-CD2 3.76Å; F811-F813 HydrophobicContact CD1-CD2 3.76Å; F811-F813 HydrophobicContact CD1-CE2 4.34Å; F811-F813 AromaticContact CE1-CD2 3.02Å; F811-F813 HydrophobicContact CE1-CD2 3.02Å; F811-F813 AromaticContact CE1-CE2 3.22Å; F811-F813 HydrophobicContact CE1-CE2 3.22Å; F811-F813 HydrophobicContact CE1-CG 4.23Å; F811-F813 HydrophobicContact CE2-CD2 4.32Å; F811-F813 HydrophobicContact CE2-CE2 4.29Å; F811-F813 AromaticContact CZ-CD2 3.35Å; F811-F813 HydrophobicContact CZ-CD2 3.35Å; F811-F813 AromaticContact CZ-CE2 3.15Å; F811-F813 HydrophobicContact CZ-CE2 3.15Å; F811-F813 HydrophobicContact CZ-CG 4.46Å; F811-F813 HydrophobicContact CZ-CZ 4.19Å; F811-F813 PolarHBondContact O-N 3.46Å; F813-S815 PolarHBondContact O-N 2.72Å; F813-F816 HydrophobicContact CB-CE1 4.42Å; F813-F816 HydrophobicContact CD1-CD1 4.29Å; F813-F816 AromaticContact CD1-CE1 3.63Å; F813-F816 HydrophobicContact CD1-CE1 3.63Å; F813-F816 HydrophobicContact CD1-CE2 4.03Å; F813-F816 AromaticContact CD1-CZ 3.55Å; F813-F816 HydrophobicContact CD1-CZ 3.55Å; F813-F816 HydrophobicContact CD2-CE1 4.01Å; F813-F816 AromaticContact CD2-CZ 3.96Å; F813-F816 HydrophobicContact CD2-CZ 3.96Å; F813-F816 HydrophobicContact CE1-CD1 4.41Å; F813-F816 HydrophobicContact CE1-CD2 4.11Å; F813-F816 AromaticContact CE1-CE1 3.6Å; F813-F816 HydrophobicContact CE1-CE1 3.6Å; F813-F816 AromaticContact CE1-CE2 3.23Å; F813-F816 HydrophobicContact CE1-CE2 3.23Å; F813-F816 AromaticContact CE1-CZ 2.98Å; F813-F816 HydrophobicContact CE1-CZ 2.98Å; F813-F816 AromaticContact CE2-CE1 3.99Å; F813-F816 HydrophobicContact CE2-CE1 3.99Å; F813-F816 HydrophobicContact CE2-CE2 4.4Å; F813-F816 AromaticContact CE2-CZ 3.47Å; F813-F816 HydrophobicContact CE2-CZ 3.47Å; F813-F816 VanDerWaalsContact CE2-CZ 3.47Å; F813-F816 AromaticContact CG-CE1 3.78Å; F813-F816 HydrophobicContact CG-CE1 3.78Å; F813-F816 AromaticContact CG-CZ 3.96Å; F813-F816 HydrophobicContact CG-CZ 3.96Å; F813-F816 AromaticContact CZ-CE1 3.75Å; F813-F816 HydrophobicContact CZ-CE1 3.75Å; F813-F816 AromaticContact CZ-CE2 3.42Å; F813-F816 HydrophobicContact CZ-CE2 3.42Å; F813-F816 VanDerWaalsContact CZ-CE2 3.42Å; F813-F816 AromaticContact CZ-CZ 2.9Å; F813-F816 HydrophobicContact CZ-CZ 2.9Å; F813-F816 WeakPolarHBondContact O-CD1 3.44Å; F813-F816 PolarHBondContact O-N 3.04Å; F813-I817 HydrophobicContact CD1-CD1 4.29Å; F813-I817 HydrophobicContact CD1-CG1 3.87Å; F813-I817 HydrophobicContact CE1-CG1 4.33Å; F813-L836 HydrophobicContact CD1-CD1 3.55Å; F813-L836 HydrophobicContact CD2-CD1 3.73Å; F813-L836 HydrophobicContact CE1-CD1 2.96Å; F813-L836 HydrophobicContact CE1-CG 4.35Å; F813-L836 HydrophobicContact CE2-CD1 3.18Å; F813-L836 HydrophobicContact CG-CD1 3.94Å; F813-L836 HydrophobicContact CZ-CD1 2.79Å; F813-L836 HydrophobicContact CZ-CG 4.25Å
814	P	56.7	Low	56.1	Low	98 Å²	98	82.9 Å²	82.9	64%	0.636	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-52.8	-26.6	179.6	-29.4	35.4	0	0	0	114.4	V812 F816	V812-P814 HydrophobicContact CG1-CG 4.38Å; V812-P814 WeakPolarHBondContact O-CD 3.49Å; V812-P814 VanDerWaalsContact O-N 3.12Å; P814-F816 PolarHBondContact O-N 2.67Å
815	S	60.8	Low	57.8	Low	65 Å²	65	80.3 Å²	80.3	46%	0.455	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-63.5	-33.3	-176.8	60.4	0	0	0	0	114.5	V812 F813	V812-S815 WeakPolarHBondContact O-CB 3.27Å; V812-S815 PolarHBondContact O-N 2.9Å; V812-S815 VanDerWaalsContact O-N 3.09Å; V812-S815 PolarHBondContact O-OG 3.08Å; F813-S815 PolarHBondContact O-N 2.72Å
816	F	66.2	Low	59.4	Low	2 Å²	2	84 Å²	84	1%	0.009	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-1.1	-171.4	73.4	-93.8	0	0	0	115.4	I765 F811 F813 P814 S818 E819 I820	I765-F816 HydrophobicContact CD1-CD1 4.44Å; I765-F816 HydrophobicContact CD1-CD2 4.08Å; I765-F816 HydrophobicContact CD1-CE1 3.82Å; I765-F816 HydrophobicContact CD1-CE2 3.4Å; I765-F816 HydrophobicContact CD1-CZ 3.16Å; I765-F816 HydrophobicContact CG2-CD2 4.04Å; I765-F816 HydrophobicContact CG2-CE2 4.09Å; F811-F816 HydrophobicContact CE2-CE1 4.14Å; F811-F816 HydrophobicContact CE2-CZ 4.42Å; F811-F816 HydrophobicContact CZ-CE1 4.28Å; F811-F816 HydrophobicContact CZ-CZ 4.26Å; F813-F816 HydrophobicContact CB-CE1 4.42Å; F813-F816 HydrophobicContact CD1-CD1 4.29Å; F813-F816 AromaticContact CD1-CE1 3.63Å; F813-F816 HydrophobicContact CD1-CE1 3.63Å; F813-F816 HydrophobicContact CD1-CE2 4.03Å; F813-F816 AromaticContact CD1-CZ 3.55Å; F813-F816 HydrophobicContact CD1-CZ 3.55Å; F813-F816 HydrophobicContact CD2-CE1 4.01Å; F813-F816 AromaticContact CD2-CZ 3.96Å; F813-F816 HydrophobicContact CD2-CZ 3.96Å; F813-F816 HydrophobicContact CE1-CD1 4.41Å; F813-F816 HydrophobicContact CE1-CD2 4.11Å; F813-F816 AromaticContact CE1-CE1 3.6Å; F813-F816 HydrophobicContact CE1-CE1 3.6Å; F813-F816 AromaticContact CE1-CE2 3.23Å; F813-F816 HydrophobicContact CE1-CE2 3.23Å; F813-F816 AromaticContact CE1-CZ 2.98Å; F813-F816 HydrophobicContact CE1-CZ 2.98Å; F813-F816 AromaticContact CE2-CE1 3.99Å; F813-F816 HydrophobicContact CE2-CE1 3.99Å; F813-F816 HydrophobicContact CE2-CE2 4.4Å; F813-F816 AromaticContact CE2-CZ 3.47Å; F813-F816 HydrophobicContact CE2-CZ 3.47Å; F813-F816 VanDerWaalsContact CE2-CZ 3.47Å; F813-F816 AromaticContact CG-CE1 3.78Å; F813-F816 HydrophobicContact CG-CE1 3.78Å; F813-F816 AromaticContact CG-CZ 3.96Å; F813-F816 HydrophobicContact CG-CZ 3.96Å; F813-F816 AromaticContact CZ-CE1 3.75Å; F813-F816 HydrophobicContact CZ-CE1 3.75Å; F813-F816 AromaticContact CZ-CE2 3.42Å; F813-F816 HydrophobicContact CZ-CE2 3.42Å; F813-F816 VanDerWaalsContact CZ-CE2 3.42Å; F813-F816 AromaticContact CZ-CZ 2.9Å; F813-F816 HydrophobicContact CZ-CZ 2.9Å; F813-F816 WeakPolarHBondContact O-CD1 3.44Å; F813-F816 PolarHBondContact O-N 3.04Å; P814-F816 PolarHBondContact O-N 2.67Å; F816-S818 PolarHBondContact O-N 3.26Å; F816-E819 WeakPolarHBondContact CB-OE2 3.17Å; F816-E819 WeakPolarHBondContact O-CA 3.44Å; F816-E819 WeakPolarHBondContact O-CB 3.38Å; F816-E819 PolarHBondContact O-N 3.03Å; F816-I820 HydrophobicContact CD2-CD1 4.34Å; F816-I820 HydrophobicContact CD2-CG1 4.39Å; F816-I820 HydrophobicContact CD2-CG2 3.9Å; F816-I820 HydrophobicContact CE2-CD1 4.18Å; F816-I820 HydrophobicContact CE2-CG2 4.25Å; F816-I820 PolarHBondContact O-N 3.03Å; F816-I820 VanDerWaalsContact O-N 3.12Å
817	I	66.4	Low	61.1	Low	24 Å²	24	78.1 Å²	78.1	12%	0.123	42%	0.415	C	S	.	.	H	α-helix	trans	-54.1	-38.1	174.7	-66.4	177.9	0	0	0	111.2	F813 E819 R821 I830	F813-I817 HydrophobicContact CD1-CD1 4.29Å; F813-I817 HydrophobicContact CD1-CG1 3.87Å; F813-I817 HydrophobicContact CE1-CG1 4.33Å; I817-E819 PolarHBondContact O-N 2.59Å; I817-R821 PolarHBondContact O-N 3.03Å; I817-I830 HydrophobicContact CG2-CG2 3.51Å
818	S	65.6	Low	62.6	Low	90 Å²	90	75.6 Å²	75.6	63%	0.629	40%	0.396	S	S	*	.	H	α-helix	trans	-62.3	-31.9	176.5	64.3	0	0	0	0	112.7	F816 R821	F816-S818 PolarHBondContact O-N 3.26Å; S818-R821 WeakPolarHBondContact O-CB 3.45Å
819	E	64.9	Low	64	Low	67 Å²	67	70 Å²	70	31%	0.313	38%	0.375	S	S	.	.	H	α-helix	trans	-81.6	-39.2	-175	-55.6	176.5	164.5	0	0	111.4	K766 F816 I817 R821	K766-E819 WeakPolarHBondContact CD-OE2 3.24Å; K766-E819 VanDerWaalsContact CE-CD 3.49Å; K766-E819 WeakPolarHBondContact CE-OE1 2.99Å; K766-E819 WeakPolarHBondContact CE-OE2 3.13Å; K766-E819 WeakPolarHBondContact CG-OE2 3.07Å; K766-E819 IonicContact NZ-OE1 3.52Å; K766-E819 PolarHBondContact NZ-OE1 2.71Å; K766-E819 IonicContact NZ-OE2 2.71Å; F816-E819 WeakPolarHBondContact CB-OE2 3.17Å; F816-E819 WeakPolarHBondContact O-CA 3.44Å; F816-E819 WeakPolarHBondContact O-CB 3.38Å; F816-E819 PolarHBondContact O-N 3.03Å; I817-E819 PolarHBondContact O-N 2.59Å; E819-R821 VanDerWaalsContact C-N 3.29Å; E819-R821 PolarHBondContact O-N 3.4Å
820	I	73.1	Confident	64.9	Low	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-79.3	-10	177.3	61.1	167.6	0	0	0	113.2	I765 V769 F786 L790 F816 A822 Y823 L824	I765-I820 HydrophobicContact CG2-CG2 3.91Å; V769-I820 HydrophobicContact CG2-CG2 4.39Å; F786-I820 HydrophobicContact CE1-CB 4.25Å; F786-I820 HydrophobicContact CE1-CG2 4.01Å; F786-I820 HydrophobicContact CZ-CG2 3.79Å; L790-I820 HydrophobicContact CD2-CD1 4.46Å; F816-I820 HydrophobicContact CD2-CD1 4.34Å; F816-I820 HydrophobicContact CD2-CG1 4.39Å; F816-I820 HydrophobicContact CD2-CG2 3.9Å; F816-I820 HydrophobicContact CE2-CD1 4.18Å; F816-I820 HydrophobicContact CE2-CG2 4.25Å; F816-I820 PolarHBondContact O-N 3.03Å; F816-I820 VanDerWaalsContact O-N 3.12Å; I820-A822 PolarHBondContact O-N 3.16Å; I820-A822 VanDerWaalsContact O-N 3.11Å; I820-Y823 WeakPolarHBondContact O-CA 3.5Å; I820-Y823 PolarHBondContact O-N 3.39Å; I820-L824 PolarHBondContact O-N 3.24Å
821	R	70	Confident	65.9	Low	167 Å²	167	63.3 Å²	63.3	63%	0.63	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-48.8	-42.9	-177.7	179.6	-174.2	-169.1	155.7	4.8	112.9	I817 S818 E819 Y823 I830	I817-R821 PolarHBondContact O-N 3.03Å; S818-R821 WeakPolarHBondContact O-CB 3.45Å; E819-R821 VanDerWaalsContact C-N 3.29Å; E819-R821 PolarHBondContact O-N 3.4Å; R821-Y823 PolarHBondContact O-N 2.75Å; R821-I830 HydrophobicContact CB-CD1 4.07Å; R821-I830 HydrophobicContact CB-CG1 4.33Å; R821-I830 HydrophobicContact CG-CD1 3.41Å; R821-I830 VanDerWaalsContact CG-CD1 3.41Å; R821-I830 HydrophobicContact CG-CG1 3.84Å
822	A	66.6	Low	66.7	Low	83 Å²	83	61.2 Å²	61.2	69%	0.686	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-74.4	-14.8	-177.5	0	0	0	0	0	113.5	I820	I820-A822 PolarHBondContact O-N 3.16Å; I820-A822 VanDerWaalsContact O-N 3.11Å
823	Y	72.4	Confident	67.5	Low	51 Å²	51	57 Å²	57	20%	0.2	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-106	4.2	-175.1	-64.4	-82.3	0	0	0	113.5	V769 N773 A783 I820 R821	V769-Y823 HydrophobicContact CG1-CD1 4.16Å; V769-Y823 HydrophobicContact CG1-CD2 3.39Å; V769-Y823 HydrophobicContact CG1-CE1 3.93Å; V769-Y823 HydrophobicContact CG1-CE2 3.12Å; V769-Y823 HydrophobicContact CG1-CG 3.94Å; V769-Y823 VanDerWaalsContact CG1-CZ 3.46Å; V769-Y823 HydrophobicContact CG2-CD2 4.35Å; N773-Y823 PolarHBondContact ND2-OH 3.09Å; N773-Y823 WeakPolarHBondContact OD1-CE1 3.34Å; N773-Y823 PolarHBondContact OD1-OH 2.95Å; A783-Y823 WeakPolarHBondContact CA-O 3.47Å; A783-Y823 WeakPolarHBondContact CB-O 3.18Å; I820-Y823 WeakPolarHBondContact O-CA 3.5Å; I820-Y823 PolarHBondContact O-N 3.39Å; R821-Y823 PolarHBondContact O-N 2.75Å
824	L	77.3	Confident	67.8	Low	14 Å²	14	59.3 Å²	59.3	7%	0.073	33%	0.331	C	S	.	.	S	Bend	trans	-86	144	172.8	-65.1	164.6	0	0	0	109.1	F787 I820 K826 I833	F787-L824 HydrophobicContact CD2-CD2 4.08Å; I820-L824 PolarHBondContact O-N 3.24Å; L824-K826 PolarHBondContact O-N 2.89Å; L824-I833 HydrophobicContact CD1-CD1 3.32Å; L824-I833 HydrophobicContact CD1-CG1 4.41Å; L824-I833 HydrophobicContact CD2-CD1 3.28Å; L824-I833 HydrophobicContact CG-CD1 3.86Å
825	P	76.6	Confident	68.3	Low	3 Å²	3	60.5 Å²	60.5	2%	0.019	33%	0.332	C	S	.	.			trans	-49.8	137.7	168.2	-24.9	33.1	0	0	0	109.8	A783 W784 F787 Q827 I828	A783-P825 HydrophobicContact CB-CG 4.44Å; W784-P825 HydrophobicContact CD2-CB 3.99Å; W784-P825 HydrophobicContact CD2-CG 3.48Å; W784-P825 VanDerWaalsContact CD2-CG 3.48Å; W784-P825 HydrophobicContact CE3-CG 3.81Å; W784-P825 HydrophobicContact CG-CB 4.42Å; W784-P825 HydrophobicContact CG-CG 3.83Å; W784-P825 HydrophobicContact CH2-CB 4.32Å; W784-P825 HydrophobicContact CH2-CG 4.34Å; W784-P825 HydrophobicContact CZ2-CB 3.73Å; W784-P825 HydrophobicContact CZ2-CG 4.05Å; W784-P825 HydrophobicContact CZ3-CG 4.22Å; F787-P825 HydrophobicContact CB-CG 4.28Å; P825-Q827 PolarHBondContact O-N 3.34Å; P825-I828 HydrophobicContact CB-CD1 4.29Å; P825-I828 HydrophobicContact CB-CG1 4.22Å; P825-I828 HydrophobicContact CG-CD1 3.98Å; P825-I828 HydrophobicContact CG-CG1 4.44Å; P825-I828 PolarHBondContact O-N 3.49Å
826	K	73	Confident	68.8	Low	205 Å²	205	57.6 Å²	57.6	89%	0.891	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-23.8	-176.3	-68.6	-177.7	-179.9	177.3	0	113.5	L824 I828	L824-K826 PolarHBondContact O-N 2.89Å; K826-I828 VanDerWaalsContact C-N 3.31Å
827	Q	72.5	Confident	69.3	Low	64 Å²	64	60.4 Å²	60.4	30%	0.299	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-14.4	179.4	-56	85.2	-4	0	0	113.3	P825 Y848 F861	P825-Q827 PolarHBondContact O-N 3.34Å; Q827-Y848 HydrophobicContact CB-CD1 4.28Å; Q827-Y848 HydrophobicContact CB-CE1 3.84Å; Q827-Y848 HydrophobicContact CG-CE1 3.75Å; Q827-F861 HydrophobicContact CB-CE2 3.9Å; Q827-F861 HydrophobicContact CG-CD2 4Å; Q827-F861 HydrophobicContact CG-CE2 3.8Å
828	I	72.6	Confident	70	Confident	12 Å²	12	60 Å²	60	6%	0.062	33%	0.326	C	S	.	.	S	Bend	trans	-106.5	110.3	-177.1	-52.4	-175.2	0	0	0	109	W784 F787 P825 K826 T832 I833 I845	W784-I828 HydrophobicContact CZ3-CD1 4.46Å; F787-I828 HydrophobicContact CD1-CD1 3.61Å; F787-I828 HydrophobicContact CD2-CD1 3.81Å; F787-I828 HydrophobicContact CE1-CD1 3.3Å; F787-I828 HydrophobicContact CE2-CD1 3.52Å; F787-I828 HydrophobicContact CE2-CG2 4.45Å; F787-I828 HydrophobicContact CG-CD1 3.84Å; F787-I828 HydrophobicContact CZ-CD1 3.25Å; P825-I828 HydrophobicContact CB-CD1 4.29Å; P825-I828 HydrophobicContact CB-CG1 4.22Å; P825-I828 HydrophobicContact CG-CD1 3.98Å; P825-I828 HydrophobicContact CG-CG1 4.44Å; P825-I828 PolarHBondContact O-N 3.49Å; K826-I828 VanDerWaalsContact C-N 3.31Å; I828-T832 HydrophobicContact CG2-CG2 4.2Å; I828-I833 HydrophobicContact CG2-CD1 3.68Å; I828-I833 HydrophobicContact CG2-CG1 3.86Å; I828-I845 HydrophobicContact CD1-CD1 4.47Å
829	T	68.1	Low	70.9	Confident	72 Å²	72	58.6 Å²	58.6	44%	0.442	31%	0.309	S	S	.	.			trans	-80.6	153.8	179.8	66.6	0	0	0	0	111.7	S831 T832	T829-S831 PolarHBondContact O-N 2.98Å; T829-S831 PolarHBondContact OG1-OG 3.29Å; T829-T832 WeakPolarHBondContact O-CA 3.45Å; T829-T832 WeakPolarHBondContact O-CB 3.32Å; T829-T832 PolarHBondContact O-N 3.5Å; T829-T832 PolarHBondContact O-OG1 3.3Å; T829-T832 PolarHBondContact OG1-OG1 2.94Å
830	I	63	Low	71.8	Confident	52 Å²	52	58.1 Å²	58.1	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-60.2	-36.6	178.1	-65.5	161.7	0	0	0	112.1	I817 R821 T832 I833 S834	I817-I830 HydrophobicContact CG2-CG2 3.51Å; R821-I830 HydrophobicContact CB-CD1 4.07Å; R821-I830 HydrophobicContact CB-CG1 4.33Å; R821-I830 HydrophobicContact CG-CD1 3.41Å; R821-I830 VanDerWaalsContact CG-CD1 3.41Å; R821-I830 HydrophobicContact CG-CG1 3.84Å; I830-T832 PolarHBondContact O-N 3.45Å; I830-T832 VanDerWaalsContact O-N 3.16Å; I830-I833 PolarHBondContact O-N 2.88Å; I830-S834 PolarHBondContact O-N 3.4Å
831	S	65.2	Low	72.3	Confident	94 Å²	94	58.1 Å²	58.1	66%	0.657	31%	0.311	S	S	*	.	H	α-helix	trans	-57.3	-27.3	175.1	37	0	0	0	0	112.3	T829 I833	T829-S831 PolarHBondContact O-N 2.98Å; T829-S831 PolarHBondContact OG1-OG 3.29Å; S831-I833 VanDerWaalsContact C-N 3.31Å
832	T	63.1	Low	73.1	Confident	15 Å²	15	50.2 Å²	50.2	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-69.8	-27.8	174.7	-48.4	0	0	0	0	112.4	I828 T829 I830 I841 N844	I828-T832 HydrophobicContact CG2-CG2 4.2Å; T829-T832 WeakPolarHBondContact O-CA 3.45Å; T829-T832 WeakPolarHBondContact O-CB 3.32Å; T829-T832 PolarHBondContact O-N 3.5Å; T829-T832 PolarHBondContact O-OG1 3.3Å; T829-T832 PolarHBondContact OG1-OG1 2.94Å; I830-T832 PolarHBondContact O-N 3.45Å; I830-T832 VanDerWaalsContact O-N 3.16Å; T832-I841 HydrophobicContact CG2-CG1 4.34Å; T832-N844 HydrophobicContact CG2-CB 3.54Å
833	I	66.8	Low	74	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-104.6	-8.1	-170.4	-54.7	-166.9	0	0	0	112.5	F787 L824 I828 I830 S831 N835 L836	F787-I833 HydrophobicContact CE2-CD1 4.44Å; L824-I833 HydrophobicContact CD1-CD1 3.32Å; L824-I833 HydrophobicContact CD1-CG1 4.41Å; L824-I833 HydrophobicContact CD2-CD1 3.28Å; L824-I833 HydrophobicContact CG-CD1 3.86Å; I828-I833 HydrophobicContact CG2-CD1 3.68Å; I828-I833 HydrophobicContact CG2-CG1 3.86Å; I830-I833 PolarHBondContact O-N 2.88Å; S831-I833 VanDerWaalsContact C-N 3.31Å; I833-N835 PolarHBondContact O-N 2.96Å; I833-L836 HydrophobicContact CG2-CD1 4.04Å; I833-L836 HydrophobicContact CG2-CD2 3.81Å; I833-L836 HydrophobicContact CG2-CG 3.59Å; I833-L836 PolarHBondContact O-N 3.46Å
834	S	63.6	Low	74.5	Confident	67 Å²	67	50.1 Å²	50.1	47%	0.469	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-32.1	-171.6	66.8	0	0	0	0	114.6	I830	I830-S834 PolarHBondContact O-N 3.4Å
835	N	65.4	Low	74.9	Confident	122 Å²	122	49.9 Å²	49.9	65%	0.652	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-10.3	178.9	-64.5	-3.7	0	0	0	114	I833 D837	I833-N835 PolarHBondContact O-N 2.96Å; N835-D837 PolarHBondContact O-N 2.94Å
836	L	71.3	Confident	75.3	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	28%	0.277	C	S	.	.			trans	43.1	38.5	-172.6	-91.2	158.9	0	0	0	114.4	L790 F813 I833 P838 I841	L790-L836 HydrophobicContact CD2-CD2 4.13Å; L790-L836 HydrophobicContact CG-CD2 4.29Å; F813-L836 HydrophobicContact CD1-CD1 3.55Å; F813-L836 HydrophobicContact CD2-CD1 3.73Å; F813-L836 HydrophobicContact CE1-CD1 2.96Å; F813-L836 HydrophobicContact CE1-CG 4.35Å; F813-L836 HydrophobicContact CE2-CD1 3.18Å; F813-L836 HydrophobicContact CG-CD1 3.94Å; F813-L836 HydrophobicContact CZ-CD1 2.79Å; F813-L836 HydrophobicContact CZ-CG 4.25Å; I833-L836 HydrophobicContact CG2-CD1 4.04Å; I833-L836 HydrophobicContact CG2-CD2 3.81Å; I833-L836 HydrophobicContact CG2-CG 3.59Å; I833-L836 PolarHBondContact O-N 3.46Å; L836-P838 VanDerWaalsContact O-CD 3.31Å; L836-P838 WeakPolarHBondContact O-CD 3.12Å; L836-I841 HydrophobicContact CD2-CD1 3.9Å
837	D	77.8	Confident	75.9	Confident	60 Å²	60	42.7 Å²	42.7	32%	0.321	25%	0.25	S	C	.	.			trans	-79.3	114.8	167.7	170.2	30.6	0	0	0	107.9	N835 E839 T840 I841	N835-D837 PolarHBondContact O-N 2.94Å; D837-E839 PolarHBondContact O-N 3.34Å; D837-E839 PolarHBondContact OD1-N 2.93Å; D837-T840 PolarHBondContact O-N 3.27Å; D837-T840 WeakPolarHBondContact OD2-CB 3.49Å; D837-T840 PolarHBondContact OD2-N 3.31Å; D837-T840 VanDerWaalsContact OD2-N 3.07Å; D837-T840 PolarHBondContact OD2-OG1 2.89Å; D837-I841 WeakPolarHBondContact O-CG1 3.44Å; D837-I841 PolarHBondContact O-N 3.33Å
838	P	81.9	Confident	76.6	Confident	17 Å²	17	43.4 Å²	43.4	11%	0.11	25%	0.25	C	S	.	.	H	α-helix	trans	-57.9	-34.8	-179.2	-22.9	34.6	0	0	0	112.6	C794 L795 L836 I841 F842	C794-P838 HydrophobicContact CB-CG 4.12Å; L795-P838 HydrophobicContact CD2-CB 3.4Å; L795-P838 VanDerWaalsContact CD2-CB 3.4Å; L795-P838 HydrophobicContact CD2-CG 3.67Å; L795-P838 HydrophobicContact CG-CB 3.97Å; L795-P838 HydrophobicContact CG-CG 4Å; L836-P838 VanDerWaalsContact O-CD 3.31Å; L836-P838 WeakPolarHBondContact O-CD 3.12Å; P838-I841 PolarHBondContact O-N 3Å; P838-F842 HydrophobicContact CB-CE2 4.22Å; P838-F842 WeakPolarHBondContact O-CD2 2.9Å; P838-F842 WeakPolarHBondContact O-CG 3.4Å; P838-F842 PolarHBondContact O-N 3.47Å
839	E	83.6	Confident	77.2	Confident	59 Å²	59	43.7 Å²	43.7	28%	0.276	25%	0.251	S	S	.	.	H	α-helix	trans	-64	-51.3	178.3	-167.9	178.8	175.7	0	0	110.3	D837 I841 F842 I843 M917 R920 H921	D837-E839 PolarHBondContact O-N 3.34Å; D837-E839 PolarHBondContact OD1-N 2.93Å; E839-I841 PolarHBondContact O-N 2.85Å; E839-F842 PolarHBondContact O-N 3.41Å; E839-I843 HydrophobicContact CG-CD1 4.03Å; E839-I843 VanDerWaalsContact O-CG1 3.3Å; E839-I843 WeakPolarHBondContact O-CG1 3.47Å; E839-I843 PolarHBondContact O-N 2.78Å; E839-M917 HydrophobicContact CB-SD 4.22Å; E839-R920 IonicContact OE1-CZ 3.8Å; E839-R920 IonicContact OE1-NH1 3.8Å; E839-R920 PolarHBondContact OE1-NH1 3.23Å; E839-R920 IonicContact OE1-NH2 2.84Å; E839-R920 PolarHBondContact OE1-NH2 2.89Å; E839-H921 WeakPolarHBondContact CG-NE2 3.48Å; E839-H921 IonicContact OE1-NE2 2.65Å; E839-H921 PolarHBondContact OE1-NE2 2.94Å
840	T	83.1	Confident	78	Confident	57 Å²	57	44.5 Å²	44.5	35%	0.35	25%	0.253	S	S	.	.	H	α-helix	trans	-55.4	-38.8	174.5	-63	0	0	0	0	112.4	D837 N844	D837-T840 PolarHBondContact O-N 3.27Å; D837-T840 WeakPolarHBondContact OD2-CB 3.49Å; D837-T840 PolarHBondContact OD2-N 3.31Å; D837-T840 VanDerWaalsContact OD2-N 3.07Å; D837-T840 PolarHBondContact OD2-OG1 2.89Å; T840-N844 WeakPolarHBondContact CG2-ND2 3.24Å; T840-N844 WeakPolarHBondContact O-CB 3.37Å; T840-N844 VanDerWaalsContact O-CG 3.27Å; T840-N844 PolarHBondContact O-N 3.45Å; T840-N844 PolarHBondContact O-ND2 3.03Å
841	I	84.6	Confident	79.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-47.1	178.3	-68.3	166.4	0	0	0	111.1	F787 L791 T832 L836 D837 P838 E839 I843 N844 I845	F787-I841 HydrophobicContact CE2-CG2 4.2Å; F787-I841 HydrophobicContact CZ-CG2 3.65Å; L791-I841 HydrophobicContact CD2-CB 4.46Å; L791-I841 HydrophobicContact CD2-CD1 3.84Å; L791-I841 HydrophobicContact CD2-CG2 4.08Å; T832-I841 HydrophobicContact CG2-CG1 4.34Å; L836-I841 HydrophobicContact CD2-CD1 3.9Å; D837-I841 WeakPolarHBondContact O-CG1 3.44Å; D837-I841 PolarHBondContact O-N 3.33Å; P838-I841 PolarHBondContact O-N 3Å; E839-I841 PolarHBondContact O-N 2.85Å; I841-I843 VanDerWaalsContact C-N 3.34Å; I841-I843 PolarHBondContact O-N 3.46Å; I841-N844 PolarHBondContact O-N 2.86Å; I841-I845 HydrophobicContact CG2-CD1 3.8Å; I841-I845 HydrophobicContact CG2-CG1 4.47Å; I841-I845 WeakPolarHBondContact O-CG1 3.31Å; I841-I845 PolarHBondContact O-N 3.27Å
842	F	87.5	Confident	80.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-39.3	177.8	-67.7	-50.6	0	0	0	112.3	L791 L795 P838 E839 N844 I845 A846 L872 L918 H921	L791-F842 HydrophobicContact CD1-CE1 4.22Å; L791-F842 HydrophobicContact CD1-CZ 4.45Å; L795-F842 HydrophobicContact CD1-CE2 4.47Å; L795-F842 HydrophobicContact CD1-CZ 4.31Å; L795-F842 HydrophobicContact CD2-CE2 4.49Å; P838-F842 HydrophobicContact CB-CE2 4.22Å; P838-F842 WeakPolarHBondContact O-CD2 2.9Å; P838-F842 WeakPolarHBondContact O-CG 3.4Å; P838-F842 PolarHBondContact O-N 3.47Å; E839-F842 PolarHBondContact O-N 3.41Å; F842-N844 VanDerWaalsContact C-N 3.35Å; F842-N844 PolarHBondContact O-N 3.49Å; F842-I845 PolarHBondContact O-N 3.35Å; F842-A846 WeakPolarHBondContact O-CB 3.28Å; F842-A846 PolarHBondContact O-N 2.89Å; F842-L872 HydrophobicContact CZ-CD2 4.21Å; F842-L918 HydrophobicContact CD1-CD2 4.17Å; F842-L918 HydrophobicContact CE1-CD2 3.51Å; F842-L918 HydrophobicContact CE2-CD2 4.07Å; F842-L918 HydrophobicContact CE2-CG 4.43Å; F842-L918 HydrophobicContact CZ-CD2 3.46Å; F842-L918 VanDerWaalsContact CZ-CD2 3.46Å; F842-L918 HydrophobicContact CZ-CG 4.18Å; F842-H921 HydrophobicContact CB-CB 3.78Å
843	I	85.3	Confident	81.2	Confident	72 Å²	72	50.9 Å²	50.9	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-58.2	-47.9	174.3	-70	165.7	0	0	0	110.8	E839 I841 I845 A846 A847 H921	E839-I843 HydrophobicContact CG-CD1 4.03Å; E839-I843 VanDerWaalsContact O-CG1 3.3Å; E839-I843 WeakPolarHBondContact O-CG1 3.47Å; E839-I843 PolarHBondContact O-N 2.78Å; I841-I843 VanDerWaalsContact C-N 3.34Å; I841-I843 PolarHBondContact O-N 3.46Å; I843-I845 PolarHBondContact O-N 3.46Å; I843-A846 PolarHBondContact O-N 3.24Å; I843-A847 WeakPolarHBondContact O-CB 3.48Å; I843-A847 PolarHBondContact O-N 3.18Å; I843-H921 WeakPolarHBondContact CG1-CE1 3.47Å; I843-H921 WeakPolarHBondContact CG1-ND1 3.45Å
844	N	83.4	Confident	82.2	Confident	61 Å²	61	54.2 Å²	54.2	33%	0.326	30%	0.304	S	S	.	.	H	α-helix	trans	-68.1	-35.4	-178.4	-74.4	-40.2	0	0	0	112.6	T832 T840 I841 F842 A847 Y848	T832-N844 HydrophobicContact CG2-CB 3.54Å; T840-N844 WeakPolarHBondContact CG2-ND2 3.24Å; T840-N844 WeakPolarHBondContact O-CB 3.37Å; T840-N844 VanDerWaalsContact O-CG 3.27Å; T840-N844 PolarHBondContact O-N 3.45Å; T840-N844 PolarHBondContact O-ND2 3.03Å; I841-N844 PolarHBondContact O-N 2.86Å; F842-N844 VanDerWaalsContact C-N 3.35Å; F842-N844 PolarHBondContact O-N 3.49Å; N844-A847 PolarHBondContact O-N 3.08Å; N844-Y848 WeakPolarHBondContact O-CB 3.45Å; N844-Y848 PolarHBondContact O-N 3.39Å
845	I	85.4	Confident	83.3	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-66.3	-42.4	174.5	-68.7	166.9	0	0	0	110.9	F787 I828 I841 F842 I843 Y848 F849 F861 F865 L925	F787-I845 HydrophobicContact CE1-CD1 4.19Å; F787-I845 HydrophobicContact CZ-CD1 4.12Å; I828-I845 HydrophobicContact CD1-CD1 4.47Å; I841-I845 HydrophobicContact CG2-CD1 3.8Å; I841-I845 HydrophobicContact CG2-CG1 4.47Å; I841-I845 WeakPolarHBondContact O-CG1 3.31Å; I841-I845 PolarHBondContact O-N 3.27Å; F842-I845 PolarHBondContact O-N 3.35Å; I843-I845 PolarHBondContact O-N 3.46Å; I845-Y848 PolarHBondContact O-N 2.94Å; I845-F849 PolarHBondContact O-N 3.41Å; I845-F849 VanDerWaalsContact O-N 3.09Å; I845-F861 HydrophobicContact CG2-CE1 4.04Å; I845-F861 HydrophobicContact CG2-CZ 3.82Å; I845-F865 HydrophobicContact CD1-CE2 4.46Å; I845-F865 HydrophobicContact CG2-CD2 3.68Å; I845-F865 HydrophobicContact CG2-CE2 3.43Å; I845-F865 VanDerWaalsContact CG2-CE2 3.43Å; I845-F865 HydrophobicContact CG2-CZ 4.5Å; I845-L925 HydrophobicContact CG2-CD1 4.1Å
846	A	85.2	Confident	84.3	Confident	20 Å²	20	60.2 Å²	60.2	17%	0.165	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-45.9	175.2	0	0	0	0	0	111.3	F842 I843 Y848 F849 D850 H921	F842-A846 WeakPolarHBondContact O-CB 3.28Å; F842-A846 PolarHBondContact O-N 2.89Å; I843-A846 PolarHBondContact O-N 3.24Å; A846-Y848 VanDerWaalsContact C-N 3.33Å; A846-Y848 PolarHBondContact O-N 3.45Å; A846-F849 WeakPolarHBondContact O-CB 3.37Å; A846-F849 PolarHBondContact O-N 3.38Å; A846-F849 VanDerWaalsContact O-N 3.15Å; A846-D850 PolarHBondContact O-N 3.32Å; A846-D850 VanDerWaalsContact O-N 3.12Å; A846-H921 VanDerWaalsContact CB-O 3.3Å; A846-H921 WeakPolarHBondContact CB-O 3.47Å
847	A	85.1	Confident	85	Confident	38 Å²	38	61.3 Å²	61.3	31%	0.314	33%	0.328	S	S	.	.	H	α-helix	trans	-59.3	-43.2	176	0	0	0	0	0	112.1	I843 N844 F849 D850 E851	I843-A847 WeakPolarHBondContact O-CB 3.48Å; I843-A847 PolarHBondContact O-N 3.18Å; N844-A847 PolarHBondContact O-N 3.08Å; A847-F849 VanDerWaalsContact C-N 3.32Å; A847-F849 PolarHBondContact O-N 2.89Å; A847-D850 PolarHBondContact O-N 2.84Å; A847-D850 VanDerWaalsContact O-N 3.14Å; A847-E851 WeakPolarHBondContact O-CG 3.48Å; A847-E851 PolarHBondContact O-N 3.3Å
848	Y	86	Confident	85.4	Confident	78 Å²	78	62.5 Å²	62.5	31%	0.306	33%	0.329	S	S	.	.	H	α-helix	trans	-59.8	-41.7	175.9	177.5	-98.3	0	0	0	112.2	Q827 N844 I845 A846 D850 E851 L852 F861	Q827-Y848 HydrophobicContact CB-CD1 4.28Å; Q827-Y848 HydrophobicContact CB-CE1 3.84Å; Q827-Y848 HydrophobicContact CG-CE1 3.75Å; N844-Y848 WeakPolarHBondContact O-CB 3.45Å; N844-Y848 PolarHBondContact O-N 3.39Å; I845-Y848 PolarHBondContact O-N 2.94Å; A846-Y848 VanDerWaalsContact C-N 3.33Å; A846-Y848 PolarHBondContact O-N 3.45Å; Y848-D850 VanDerWaalsContact C-N 3.3Å; Y848-D850 PolarHBondContact O-N 3.29Å; Y848-E851 PolarHBondContact O-N 2.87Å; Y848-L852 HydrophobicContact CE1-CD1 4.07Å; Y848-L852 HydrophobicContact CE1-CD2 4.08Å; Y848-L852 HydrophobicContact CE1-CG 4.22Å; Y848-L852 WeakPolarHBondContact O-CG 3.36Å; Y848-L852 PolarHBondContact O-N 3.43Å; Y848-F861 HydrophobicContact CD1-CD1 4.46Å; Y848-F861 HydrophobicContact CD1-CD2 4.23Å; Y848-F861 HydrophobicContact CD1-CE1 4.12Å; Y848-F861 AromaticContact CD1-CE2 3.9Å; Y848-F861 HydrophobicContact CD1-CE2 3.9Å; Y848-F861 HydrophobicContact CD1-CG 4.49Å; Y848-F861 AromaticContact CD1-CZ 3.83Å; Y848-F861 HydrophobicContact CD1-CZ 3.83Å; Y848-F861 AromaticContact CE1-CD2 3.84Å; Y848-F861 HydrophobicContact CE1-CD2 3.84Å; Y848-F861 AromaticContact CE1-CE2 3.85Å; Y848-F861 HydrophobicContact CE1-CE2 3.85Å; Y848-F861 HydrophobicContact CE1-CG 4.24Å; Y848-F861 HydrophobicContact CE1-CZ 4.25Å
849	F	86.5	Confident	85.6	Confident	18 Å²	18	65.4 Å²	65.4	8%	0.079	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-39.8	175.7	172.3	-103.9	0	0	0	112.3	I845 A846 A847 E851 L852 R858 F861 K862 L925	I845-F849 PolarHBondContact O-N 3.41Å; I845-F849 VanDerWaalsContact O-N 3.09Å; A846-F849 WeakPolarHBondContact O-CB 3.37Å; A846-F849 PolarHBondContact O-N 3.38Å; A846-F849 VanDerWaalsContact O-N 3.15Å; A847-F849 VanDerWaalsContact C-N 3.32Å; A847-F849 PolarHBondContact O-N 2.89Å; F849-E851 VanDerWaalsContact C-N 3.34Å; F849-L852 PolarHBondContact O-N 2.77Å; F849-R858 HydrophobicContact CD2-CB 4.23Å; F849-R858 HydrophobicContact CD2-CG 4.23Å; F849-R858 HydrophobicContact CE2-CB 3.6Å; F849-R858 HydrophobicContact CE2-CG 3.94Å; F849-R858 WeakPolarHBondContact CE2-O 3.21Å; F849-R858 HydrophobicContact CZ-CB 4.16Å; F849-R858 HydrophobicContact CZ-CG 4.37Å; F849-F861 HydrophobicContact CB-CD1 4.12Å; F849-F861 HydrophobicContact CB-CE1 4.1Å; F849-F861 AromaticContact CD2-CD1 3.95Å; F849-F861 HydrophobicContact CD2-CD1 3.95Å; F849-K862 HydrophobicContact CE2-CB 4.17Å; F849-L925 HydrophobicContact CB-CD1 4.45Å; F849-L925 HydrophobicContact CB-CD2 4.01Å; F849-L925 HydrophobicContact CD1-CD2 4.09Å; F849-L925 HydrophobicContact CD1-CG 4.48Å; F849-L925 HydrophobicContact CD2-CD2 3.47Å; F849-L925 VanDerWaalsContact CD2-CD2 3.47Å; F849-L925 HydrophobicContact CE1-CD2 4.41Å; F849-L925 HydrophobicContact CE2-CD2 3.81Å; F849-L925 HydrophobicContact CG-CD2 3.59Å; F849-L925 HydrophobicContact CG-CG 4.31Å; F849-L925 HydrophobicContact CZ-CD2 4.27Å
850	D	84.2	Confident	85.7	Confident	90 Å²	90	65.9 Å²	65.9	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-67.6	-34.4	177.6	-70.7	-27.8	0	0	0	112.3	A846 A847 Y848 L852 R858	A846-D850 PolarHBondContact O-N 3.32Å; A846-D850 VanDerWaalsContact O-N 3.12Å; A847-D850 PolarHBondContact O-N 2.84Å; A847-D850 VanDerWaalsContact O-N 3.14Å; Y848-D850 VanDerWaalsContact C-N 3.3Å; Y848-D850 PolarHBondContact O-N 3.29Å; D850-L852 VanDerWaalsContact C-N 3.31Å; D850-L852 PolarHBondContact O-N 3.16Å; D850-R858 PolarHBondContact O-NH2 3.26Å
851	E	86.1	Confident	85.8	Confident	153 Å²	153	63.6 Å²	63.6	72%	0.715	34%	0.337	S	S	*	.	H	α-helix	trans	-69.3	-22.8	177	-73.3	178.6	-179.3	0	0	113.9	A847 Y848 F849 S853	A847-E851 WeakPolarHBondContact O-CG 3.48Å; A847-E851 PolarHBondContact O-N 3.3Å; Y848-E851 PolarHBondContact O-N 2.87Å; F849-E851 VanDerWaalsContact C-N 3.34Å; E851-S853 PolarHBondContact O-N 3.41Å; E851-S853 VanDerWaalsContact O-N 3.17Å
852	L	86.4	Confident	86	Confident	26 Å²	26	65.2 Å²	65.2	14%	0.136	34%	0.344	C	S	.	.			trans	-63.8	118.7	178.1	-67.5	173.8	0	0	0	110.5	Y848 F849 D850 A857 R858 F861	Y848-L852 HydrophobicContact CE1-CD1 4.07Å; Y848-L852 HydrophobicContact CE1-CD2 4.08Å; Y848-L852 HydrophobicContact CE1-CG 4.22Å; Y848-L852 WeakPolarHBondContact O-CG 3.36Å; Y848-L852 PolarHBondContact O-N 3.43Å; F849-L852 PolarHBondContact O-N 2.77Å; D850-L852 VanDerWaalsContact C-N 3.31Å; D850-L852 PolarHBondContact O-N 3.16Å; L852-A857 HydrophobicContact CB-CB 4.41Å; L852-A857 HydrophobicContact CD2-CB 4.31Å; L852-R858 HydrophobicContact CB-CG 3.67Å; L852-R858 HydrophobicContact CD1-CG 4.43Å; L852-R858 PolarHBondContact O-NE 2.81Å; L852-R858 PolarHBondContact O-NH2 3.36Å; L852-F861 HydrophobicContact CD1-CB 3.64Å; L852-F861 HydrophobicContact CD1-CD1 4.32Å; L852-F861 HydrophobicContact CD1-CG 4.04Å
853	S	86.7	Confident	85.9	Confident	116 Å²	116	69 Å²	69	81%	0.811	37%	0.37	S	S	*	.			trans	-78.8	-26.4	-170.6	59.8	0	0	0	0	114.9	E851	E851-S853 PolarHBondContact O-N 3.41Å; E851-S853 VanDerWaalsContact O-N 3.17Å
854	T	87.8	Confident	85.8	Confident	71 Å²	71	67.8 Å²	67.8	44%	0.436	37%	0.366	S	S	.	.	S	Bend	trans	-105.2	141.5	-176.9	67.8	0	0	0	0	111.5	Q856 A857 R858	T854-Q856 PolarHBondContact O-N 3.27Å; T854-A857 PolarHBondContact O-N 3.24Å; T854-A857 WeakPolarHBondContact OG1-CB 3.25Å; T854-A857 PolarHBondContact OG1-N 2.9Å; T854-A857 VanDerWaalsContact OG1-N 3.15Å; T854-R858 PolarHBondContact O-N 2.81Å
855	F	85.7	Confident	86	Confident	154 Å²	154	64.9 Å²	64.9	68%	0.675	35%	0.35	S	S	*	.	H	α-helix	trans	-55.5	-41.3	174.1	179	-94.9	0	0	0	111.8	R858 M859	F855-R858 PolarHBondContact O-N 3.36Å; F855-M859 HydrophobicContact CD1-CG 4.05Å; F855-M859 HydrophobicContact CD2-CE 4.02Å; F855-M859 HydrophobicContact CD2-CG 4.45Å; F855-M859 HydrophobicContact CE1-CG 3.6Å; F855-M859 HydrophobicContact CE2-CE 3.35Å; F855-M859 HydrophobicContact CE2-CG 4.07Å; F855-M859 HydrophobicContact CE2-SD 4.43Å; F855-M859 HydrophobicContact CG-CG 4.45Å; F855-M859 HydrophobicContact CZ-CE 3.66Å; F855-M859 HydrophobicContact CZ-CG 3.62Å; F855-M859 HydrophobicContact CZ-SD 4.18Å; F855-M859 WeakPolarHBondContact O-CG 3.21Å; F855-M859 PolarHBondContact O-N 3.21Å
856	Q	86.7	Confident	86.1	Confident	160 Å²	160	66.2 Å²	66.2	75%	0.748	36%	0.359	S	S	*	.	H	α-helix	trans	-63.5	-43.5	178.5	-171.5	175.5	5.1	0	0	112.1	T854 M859 S860	T854-Q856 PolarHBondContact O-N 3.27Å; Q856-M859 PolarHBondContact O-N 3.01Å; Q856-S860 WeakPolarHBondContact O-CB 3.07Å; Q856-S860 PolarHBondContact O-N 3.08Å; Q856-S860 PolarHBondContact O-OG 2.91Å
857	A	85.2	Confident	86	Confident	28 Å²	28	70.2 Å²	70.2	23%	0.231	37%	0.374	C	S	.	.	H	α-helix	trans	-62.7	-45.2	175.5	0	0	0	0	0	111.3	L852 T854 M859 S860 F861	L852-A857 HydrophobicContact CB-CB 4.41Å; L852-A857 HydrophobicContact CD2-CB 4.31Å; T854-A857 PolarHBondContact O-N 3.24Å; T854-A857 WeakPolarHBondContact OG1-CB 3.25Å; T854-A857 PolarHBondContact OG1-N 2.9Å; T854-A857 VanDerWaalsContact OG1-N 3.15Å; A857-M859 PolarHBondContact O-N 3.1Å; A857-S860 WeakPolarHBondContact CA-OG 3.46Å; A857-S860 PolarHBondContact O-N 3.13Å; A857-S860 PolarHBondContact O-OG 3.31Å; A857-F861 WeakPolarHBondContact O-CB 3.43Å; A857-F861 PolarHBondContact O-N 2.94Å
858	R	86.2	Confident	86.1	Confident	86 Å²	86	69.1 Å²	69.1	33%	0.325	36%	0.362	S	S	.	.	H	α-helix	trans	-56.4	-49.2	175.1	-75.7	-174.8	-173.9	-168.1	-2.7	111.9	F849 D850 L852 T854 F855 F861 K862	F849-R858 HydrophobicContact CD2-CB 4.23Å; F849-R858 HydrophobicContact CD2-CG 4.23Å; F849-R858 HydrophobicContact CE2-CB 3.6Å; F849-R858 HydrophobicContact CE2-CG 3.94Å; F849-R858 WeakPolarHBondContact CE2-O 3.21Å; F849-R858 HydrophobicContact CZ-CB 4.16Å; F849-R858 HydrophobicContact CZ-CG 4.37Å; D850-R858 PolarHBondContact O-NH2 3.26Å; L852-R858 HydrophobicContact CB-CG 3.67Å; L852-R858 HydrophobicContact CD1-CG 4.43Å; L852-R858 PolarHBondContact O-NE 2.81Å; L852-R858 PolarHBondContact O-NH2 3.36Å; T854-R858 PolarHBondContact O-N 2.81Å; F855-R858 PolarHBondContact O-N 3.36Å; R858-F861 PolarHBondContact O-N 3.2Å; R858-K862 VanDerWaalsContact O-CB 3.24Å; R858-K862 WeakPolarHBondContact O-CB 3.38Å; R858-K862 PolarHBondContact O-N 3.21Å
859	M	87.7	Confident	86.2	Confident	77 Å²	77	65.4 Å²	65.4	38%	0.379	35%	0.347	S	S	.	.	H	α-helix	trans	-67.3	-37.9	-179.5	-68.1	-55.7	148.7	0	0	112.5	F855 Q856 A857 K862 S863	F855-M859 HydrophobicContact CD1-CG 4.05Å; F855-M859 HydrophobicContact CD2-CE 4.02Å; F855-M859 HydrophobicContact CD2-CG 4.45Å; F855-M859 HydrophobicContact CE1-CG 3.6Å; F855-M859 HydrophobicContact CE2-CE 3.35Å; F855-M859 HydrophobicContact CE2-CG 4.07Å; F855-M859 HydrophobicContact CE2-SD 4.43Å; F855-M859 HydrophobicContact CG-CG 4.45Å; F855-M859 HydrophobicContact CZ-CE 3.66Å; F855-M859 HydrophobicContact CZ-CG 3.62Å; F855-M859 HydrophobicContact CZ-SD 4.18Å; F855-M859 WeakPolarHBondContact O-CG 3.21Å; F855-M859 PolarHBondContact O-N 3.21Å; Q856-M859 PolarHBondContact O-N 3.01Å; A857-M859 PolarHBondContact O-N 3.1Å; M859-K862 PolarHBondContact O-N 3.41Å; M859-K862 HydrophobicContact SD-CD 4.43Å; M859-S863 WeakPolarHBondContact O-CB 3.49Å; M859-S863 PolarHBondContact O-N 3.05Å
860	S	84.3	Confident	86.1	Confident	69 Å²	69	64.8 Å²	64.8	48%	0.483	35%	0.346	S	S	.	.	H	α-helix	trans	-63.5	-44.5	174.6	70.6	0	0	0	0	112.1	Q856 A857 S863 V864	Q856-S860 WeakPolarHBondContact O-CB 3.07Å; Q856-S860 PolarHBondContact O-N 3.08Å; Q856-S860 PolarHBondContact O-OG 2.91Å; A857-S860 WeakPolarHBondContact CA-OG 3.46Å; A857-S860 PolarHBondContact O-N 3.13Å; A857-S860 PolarHBondContact O-OG 3.31Å; S860-S863 PolarHBondContact O-N 3.35Å; S860-V864 WeakPolarHBondContact O-CG2 3.41Å; S860-V864 PolarHBondContact O-N 3.29Å
861	F	86.5	Confident	86.2	Confident	10 Å²	10	63.9 Å²	63.9	4%	0.044	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-44.5	177	179.5	-104.6	0	0	0	111.4	W784 Q827 I845 Y848 F849 L852 A857 R858 S863 V864 F865 L925	W784-F861 HydrophobicContact CH2-CE2 4.44Å; W784-F861 HydrophobicContact CZ2-CE2 4.38Å; Q827-F861 HydrophobicContact CB-CE2 3.9Å; Q827-F861 HydrophobicContact CG-CD2 4Å; Q827-F861 HydrophobicContact CG-CE2 3.8Å; I845-F861 HydrophobicContact CG2-CE1 4.04Å; I845-F861 HydrophobicContact CG2-CZ 3.82Å; Y848-F861 HydrophobicContact CD1-CD1 4.46Å; Y848-F861 HydrophobicContact CD1-CD2 4.23Å; Y848-F861 HydrophobicContact CD1-CE1 4.12Å; Y848-F861 AromaticContact CD1-CE2 3.9Å; Y848-F861 HydrophobicContact CD1-CE2 3.9Å; Y848-F861 HydrophobicContact CD1-CG 4.49Å; Y848-F861 AromaticContact CD1-CZ 3.83Å; Y848-F861 HydrophobicContact CD1-CZ 3.83Å; Y848-F861 AromaticContact CE1-CD2 3.84Å; Y848-F861 HydrophobicContact CE1-CD2 3.84Å; Y848-F861 AromaticContact CE1-CE2 3.85Å; Y848-F861 HydrophobicContact CE1-CE2 3.85Å; Y848-F861 HydrophobicContact CE1-CG 4.24Å; Y848-F861 HydrophobicContact CE1-CZ 4.25Å; F849-F861 HydrophobicContact CB-CD1 4.12Å; F849-F861 HydrophobicContact CB-CE1 4.1Å; F849-F861 AromaticContact CD2-CD1 3.95Å; F849-F861 HydrophobicContact CD2-CD1 3.95Å; L852-F861 HydrophobicContact CD1-CB 3.64Å; L852-F861 HydrophobicContact CD1-CD1 4.32Å; L852-F861 HydrophobicContact CD1-CG 4.04Å; A857-F861 WeakPolarHBondContact O-CB 3.43Å; A857-F861 PolarHBondContact O-N 2.94Å; R858-F861 PolarHBondContact O-N 3.2Å; F861-S863 VanDerWaalsContact C-N 3.31Å; F861-S863 PolarHBondContact O-N 3.41Å; F861-V864 PolarHBondContact O-N 3.29Å; F861-F865 HydrophobicContact CE1-CB 4.45Å; F861-F865 HydrophobicContact CE1-CD2 4.48Å; F861-F865 HydrophobicContact CZ-CD2 4.43Å; F861-F865 VanDerWaalsContact O-CB 3.31Å; F861-F865 WeakPolarHBondContact O-CB 3.42Å; F861-F865 PolarHBondContact O-N 2.96Å; F861-L925 HydrophobicContact CD1-CD2 4.19Å; F861-L925 HydrophobicContact CE1-CD1 4.45Å; F861-L925 HydrophobicContact CE1-CD2 4.25Å
862	K	87.7	Confident	86.3	Confident	35 Å²	35	56.6 Å²	56.6	15%	0.152	30%	0.302	C	S	.	.	H	α-helix	trans	-58.9	-42.7	176.4	-179.9	169.6	172.6	162.2	0	111.7	F849 R858 M859 V864 F865 V866 M924 L925 Y927	F849-K862 HydrophobicContact CE2-CB 4.17Å; R858-K862 VanDerWaalsContact O-CB 3.24Å; R858-K862 WeakPolarHBondContact O-CB 3.38Å; R858-K862 PolarHBondContact O-N 3.21Å; M859-K862 PolarHBondContact O-N 3.41Å; M859-K862 HydrophobicContact SD-CD 4.43Å; K862-V864 PolarHBondContact O-N 3.29Å; K862-F865 PolarHBondContact O-N 2.75Å; K862-V866 HydrophobicContact CG-CG2 4.28Å; K862-V866 WeakPolarHBondContact O-CB 3.37Å; K862-V866 VanDerWaalsContact O-CG2 3.25Å; K862-V866 WeakPolarHBondContact O-CG2 3.43Å; K862-V866 PolarHBondContact O-N 2.99Å; K862-M924 WeakPolarHBondContact CE-O 3.34Å; K862-M924 PolarHBondContact NZ-O 3.08Å; K862-L925 HydrophobicContact CB-CD2 4.16Å; K862-L925 WeakPolarHBondContact CE-O 3.48Å; K862-L925 HydrophobicContact CG-CD2 4.29Å; K862-Y927 WeakPolarHBondContact CE-O 3.1Å; K862-Y927 PolarHBondContact NZ-O 3.08Å
863	S	84.9	Confident	86.4	Confident	80 Å²	80	55.3 Å²	55.3	56%	0.559	30%	0.296	S	S	*	.	H	α-helix	trans	-58.3	-49.5	176.3	-172.1	0	0	0	0	111.6	M859 S860 F861 V866 E867	M859-S863 WeakPolarHBondContact O-CB 3.49Å; M859-S863 PolarHBondContact O-N 3.05Å; S860-S863 PolarHBondContact O-N 3.35Å; F861-S863 VanDerWaalsContact C-N 3.31Å; F861-S863 PolarHBondContact O-N 3.41Å; S863-V866 PolarHBondContact O-N 2.79Å; S863-E867 WeakPolarHBondContact O-CB 3.38Å; S863-E867 PolarHBondContact O-N 3.29Å
864	V	85	Confident	86.3	Confident	45 Å²	45	54.3 Å²	54.3	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-45	177.9	173.4	0	0	0	0	110.6	W784 S860 F861 K862 V866 E867 Y868	W784-V864 HydrophobicContact CD2-CG1 4.39Å; W784-V864 HydrophobicContact CZ2-CG1 3.94Å; W784-V864 VanDerWaalsContact NE1-CG1 3.32Å; S860-V864 WeakPolarHBondContact O-CG2 3.41Å; S860-V864 PolarHBondContact O-N 3.29Å; F861-V864 PolarHBondContact O-N 3.29Å; K862-V864 PolarHBondContact O-N 3.29Å; V864-V866 PolarHBondContact O-N 2.75Å; V864-E867 WeakPolarHBondContact O-CB 3.38Å; V864-E867 PolarHBondContact O-N 3.07Å; V864-Y868 HydrophobicContact CG1-CD2 3.91Å; V864-Y868 HydrophobicContact CG1-CE2 3.97Å; V864-Y868 WeakPolarHBondContact O-CD2 3.06Å; V864-Y868 PolarHBondContact O-N 3.29Å
865	F	87.2	Confident	86.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-47.4	178.5	179.9	-85.4	0	0	0	111.6	I845 F861 K862 E867 Y868 I869 C922 L925 L926	I845-F865 HydrophobicContact CD1-CE2 4.46Å; I845-F865 HydrophobicContact CG2-CD2 3.68Å; I845-F865 HydrophobicContact CG2-CE2 3.43Å; I845-F865 VanDerWaalsContact CG2-CE2 3.43Å; I845-F865 HydrophobicContact CG2-CZ 4.5Å; F861-F865 HydrophobicContact CE1-CB 4.45Å; F861-F865 HydrophobicContact CE1-CD2 4.48Å; F861-F865 HydrophobicContact CZ-CD2 4.43Å; F861-F865 VanDerWaalsContact O-CB 3.31Å; F861-F865 WeakPolarHBondContact O-CB 3.42Å; F861-F865 PolarHBondContact O-N 2.96Å; K862-F865 PolarHBondContact O-N 2.75Å; F865-E867 VanDerWaalsContact C-N 3.34Å; F865-E867 PolarHBondContact O-N 2.69Å; F865-Y868 PolarHBondContact O-N 2.93Å; F865-I869 HydrophobicContact CD1-CB 4.15Å; F865-I869 HydrophobicContact CD1-CG1 4.46Å; F865-I869 HydrophobicContact CD2-CB 4.4Å; F865-I869 HydrophobicContact CD2-CG1 3.83Å; F865-I869 HydrophobicContact CE1-CB 3.82Å; F865-I869 HydrophobicContact CE1-CG1 4.24Å; F865-I869 HydrophobicContact CE1-CG2 3.81Å; F865-I869 HydrophobicContact CE2-CB 4.08Å; F865-I869 HydrophobicContact CE2-CG1 3.57Å; F865-I869 HydrophobicContact CE2-CG2 4.26Å; F865-I869 HydrophobicContact CG-CB 4.44Å; F865-I869 HydrophobicContact CG-CG1 4.28Å; F865-I869 HydrophobicContact CZ-CB 3.78Å; F865-I869 HydrophobicContact CZ-CG1 3.8Å; F865-I869 HydrophobicContact CZ-CG2 3.61Å; F865-I869 WeakPolarHBondContact O-CA 3.31Å; F865-I869 VanDerWaalsContact O-CB 3.28Å; F865-I869 WeakPolarHBondContact O-CB 3.1Å; F865-I869 PolarHBondContact O-N 3.16Å; F865-C922 HydrophobicContact CE1-CB 4.11Å; F865-C922 HydrophobicContact CZ-CB 3.81Å; F865-L925 HydrophobicContact CD1-CB 3.57Å; F865-L925 HydrophobicContact CD1-CD1 4.09Å; F865-L925 HydrophobicContact CD1-CG 4.29Å; F865-L925 HydrophobicContact CD2-CD1 4.06Å; F865-L925 HydrophobicContact CE1-CB 3.55Å; F865-L925 HydrophobicContact CE1-CD1 3.98Å; F865-L925 HydrophobicContact CE1-CG 4.37Å; F865-L925 HydrophobicContact CE2-CD1 3.93Å; F865-L925 HydrophobicContact CG-CB 4.31Å; F865-L925 HydrophobicContact CG-CD1 4.13Å; F865-L925 HydrophobicContact CZ-CB 4.28Å; F865-L925 HydrophobicContact CZ-CD1 3.89Å; F865-L926 HydrophobicContact CD1-CD2 4.5Å; F865-L926 HydrophobicContact CE1-CD2 3.81Å; F865-L926 HydrophobicContact CE1-CG 4.15Å
866	V	86.5	Confident	86.3	Confident	36 Å²	36	43.9 Å²	43.9	22%	0.218	23%	0.226	C	C	.	.	H	α-helix	trans	-64.3	-39.7	178.1	172.6	0	0	0	0	111.1	K862 S863 V864 Y868 G870 L925	K862-V866 HydrophobicContact CG-CG2 4.28Å; K862-V866 WeakPolarHBondContact O-CB 3.37Å; K862-V866 VanDerWaalsContact O-CG2 3.25Å; K862-V866 WeakPolarHBondContact O-CG2 3.43Å; K862-V866 PolarHBondContact O-N 2.99Å; S863-V866 PolarHBondContact O-N 2.79Å; V864-V866 PolarHBondContact O-N 2.75Å; V866-Y868 VanDerWaalsContact C-N 3.29Å; V866-Y868 PolarHBondContact O-N 3.18Å; V866-G870 WeakPolarHBondContact O-CA 3.12Å; V866-G870 PolarHBondContact O-N 3.17Å; V866-L925 WeakPolarHBondContact CG2-O 3.44Å
867	E	83.7	Confident	86.2	Confident	105 Å²	105	36.4 Å²	36.4	49%	0.491	19%	0.192	S	C	.	.	H	α-helix	trans	-58.2	-38.5	177.5	-174.1	-171.5	154.5	0	0	112.7	S863 V864 F865 R871	S863-E867 WeakPolarHBondContact O-CB 3.38Å; S863-E867 PolarHBondContact O-N 3.29Å; V864-E867 WeakPolarHBondContact O-CB 3.38Å; V864-E867 PolarHBondContact O-N 3.07Å; F865-E867 VanDerWaalsContact C-N 3.34Å; F865-E867 PolarHBondContact O-N 2.69Å; E867-R871 WeakPolarHBondContact O-CD 3.05Å; E867-R871 WeakPolarHBondContact O-CG 2.93Å
868	Y	87.3	Confident	86	Confident	14 Å²	14	35.8 Å²	35.8	6%	0.055	19%	0.185	C	C	.	.	H	α-helix	trans	-100.8	-48.4	-175.6	-65.6	-74.7	0	0	0	113.4	T781 W784 L785 V864 F865 V866 G870 R871	T781-Y868 HydrophobicContact CG2-CE1 4.15Å; T781-Y868 WeakPolarHBondContact CG2-OH 3.41Å; T781-Y868 PolarHBondContact OG1-OH 3Å; W784-Y868 HydrophobicContact CB-CD1 3.49Å; W784-Y868 VanDerWaalsContact CB-CD1 3.49Å; W784-Y868 HydrophobicContact CB-CD2 3.57Å; W784-Y868 HydrophobicContact CB-CE1 3.72Å; W784-Y868 HydrophobicContact CB-CE2 3.87Å; W784-Y868 HydrophobicContact CB-CG 3.44Å; W784-Y868 VanDerWaalsContact CB-CG 3.44Å; W784-Y868 AromaticContact CD1-CD2 3.84Å; W784-Y868 AromaticContact CD1-CE2 3.81Å; W784-Y868 AromaticContact CD2-CD2 3.87Å; W784-Y868 HydrophobicContact CD2-CD2 3.87Å; W784-Y868 HydrophobicContact CD2-CG 4.2Å; W784-Y868 HydrophobicContact CE3-CD2 4.4Å; W784-Y868 HydrophobicContact CE3-CG 4.39Å; W784-Y868 HydrophobicContact CG-CD1 4.33Å; W784-Y868 AromaticContact CG-CD2 3.48Å; W784-Y868 HydrophobicContact CG-CD2 3.48Å; W784-Y868 VanDerWaalsContact CG-CD2 3.48Å; W784-Y868 AromaticContact CG-CE2 3.84Å; W784-Y868 HydrophobicContact CG-CE2 3.84Å; W784-Y868 AromaticContact CG-CG 3.82Å; W784-Y868 HydrophobicContact CG-CG 3.82Å; L785-Y868 HydrophobicContact CD2-CD1 4.28Å; L785-Y868 HydrophobicContact CD2-CE1 4.24Å; L785-Y868 HydrophobicContact CG-CE1 4.3Å; V864-Y868 HydrophobicContact CG1-CD2 3.91Å; V864-Y868 HydrophobicContact CG1-CE2 3.97Å; V864-Y868 WeakPolarHBondContact O-CD2 3.06Å; V864-Y868 PolarHBondContact O-N 3.29Å; F865-Y868 PolarHBondContact O-N 2.93Å; V866-Y868 VanDerWaalsContact C-N 3.29Å; V866-Y868 PolarHBondContact O-N 3.18Å; Y868-G870 VanDerWaalsContact C-N 3.34Å; Y868-R871 WeakPolarHBondContact O-CB 3.42Å; Y868-R871 PolarHBondContact O-N 2.9Å
869	I	88	Confident	85.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-75.5	-26	178.3	-59.5	-68.6	0	0	0	111.3	F787 V788 L791 F865 R871 L872 S873 L918 L926	F787-I869 HydrophobicContact CE1-CD1 4.42Å; V788-I869 HydrophobicContact CG2-CD1 3.9Å; L791-I869 HydrophobicContact CD1-CD1 3.93Å; F865-I869 HydrophobicContact CD1-CB 4.15Å; F865-I869 HydrophobicContact CD1-CG1 4.46Å; F865-I869 HydrophobicContact CD2-CB 4.4Å; F865-I869 HydrophobicContact CD2-CG1 3.83Å; F865-I869 HydrophobicContact CE1-CB 3.82Å; F865-I869 HydrophobicContact CE1-CG1 4.24Å; F865-I869 HydrophobicContact CE1-CG2 3.81Å; F865-I869 HydrophobicContact CE2-CB 4.08Å; F865-I869 HydrophobicContact CE2-CG1 3.57Å; F865-I869 HydrophobicContact CE2-CG2 4.26Å; F865-I869 HydrophobicContact CG-CB 4.44Å; F865-I869 HydrophobicContact CG-CG1 4.28Å; F865-I869 HydrophobicContact CZ-CB 3.78Å; F865-I869 HydrophobicContact CZ-CG1 3.8Å; F865-I869 HydrophobicContact CZ-CG2 3.61Å; F865-I869 WeakPolarHBondContact O-CA 3.31Å; F865-I869 VanDerWaalsContact O-CB 3.28Å; F865-I869 WeakPolarHBondContact O-CB 3.1Å; F865-I869 PolarHBondContact O-N 3.16Å; I869-R871 PolarHBondContact O-N 2.96Å; I869-L872 WeakPolarHBondContact O-CB 3.38Å; I869-L872 PolarHBondContact O-N 3.15Å; I869-L872 VanDerWaalsContact O-N 3.08Å; I869-S873 PolarHBondContact O-N 2.93Å; I869-S873 PolarHBondContact O-OG 2.92Å; I869-L918 HydrophobicContact CG2-CD2 3.94Å; I869-L926 HydrophobicContact CG2-CD2 4.27Å
870	G	85.2	Confident	85.4	Confident	6 Å²	6	28 Å²	28	6%	0.062	15%	0.152	C	C	.	.	H	α-helix	trans	-59.5	-30.2	168.8	0	0	0	0	0	112.6	V866 Y868 S873 E874 S938	V866-G870 WeakPolarHBondContact O-CA 3.12Å; V866-G870 PolarHBondContact O-N 3.17Å; Y868-G870 VanDerWaalsContact C-N 3.34Å; G870-S873 WeakPolarHBondContact O-CB 3.2Å; G870-S873 PolarHBondContact O-N 3.17Å; G870-E874 PolarHBondContact O-N 2.75Å; G870-S938 WeakPolarHBondContact CA-OG 3.32Å
871	R	85.3	Confident	85.3	Confident	70 Å²	70	24.8 Å²	24.8	26%	0.264	13%	0.129	S	C	.	.	H	α-helix	trans	-71.2	-34.9	173.9	-54.4	-179.4	79.7	-162.6	0.9	112.4	D738 E867 Y868 I869 S873 E874 F875	D738-R871 VanDerWaalsContact CG-NH1 3.27Å; D738-R871 VanDerWaalsContact CG-NH2 3.28Å; D738-R871 IonicContact OD1-CZ 3.32Å; D738-R871 IonicContact OD1-NH1 2.64Å; D738-R871 PolarHBondContact OD1-NH1 3.15Å; D738-R871 IonicContact OD1-NH2 2.78Å; D738-R871 PolarHBondContact OD1-NH2 2.94Å; D738-R871 VanDerWaalsContact OD1-NH2 3.08Å; D738-R871 IonicContact OD2-CZ 3.3Å; D738-R871 IonicContact OD2-NH1 3.03Å; D738-R871 PolarHBondContact OD2-NH1 3.46Å; D738-R871 IonicContact OD2-NH2 2.9Å; D738-R871 PolarHBondContact OD2-NH2 2.85Å; E867-R871 WeakPolarHBondContact O-CD 3.05Å; E867-R871 WeakPolarHBondContact O-CG 2.93Å; Y868-R871 WeakPolarHBondContact O-CB 3.42Å; Y868-R871 PolarHBondContact O-N 2.9Å; I869-R871 PolarHBondContact O-N 2.96Å; R871-S873 VanDerWaalsContact C-N 3.31Å; R871-E874 PolarHBondContact O-N 3.47Å; R871-F875 VanDerWaalsContact O-CB 3.25Å; R871-F875 WeakPolarHBondContact O-CB 3.19Å; R871-F875 PolarHBondContact O-N 2.92Å
872	L	88.7	Confident	84.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62	-43.1	169.3	173	63.8	0	0	0	110.2	M742 V788 T792 L795 F842 I869 F875 I876 L918	M742-L872 HydrophobicContact CE-CB 4.26Å; M742-L872 HydrophobicContact CE-CD1 4.14Å; V788-L872 HydrophobicContact CG1-CB 3.77Å; T792-L872 HydrophobicContact CG2-CD1 4.31Å; T792-L872 WeakPolarHBondContact OG1-CD1 3.42Å; L795-L872 HydrophobicContact CD1-CD1 4.42Å; L795-L872 HydrophobicContact CD1-CD2 3.95Å; F842-L872 HydrophobicContact CZ-CD2 4.21Å; I869-L872 WeakPolarHBondContact O-CB 3.38Å; I869-L872 PolarHBondContact O-N 3.15Å; I869-L872 VanDerWaalsContact O-N 3.08Å; L872-F875 PolarHBondContact O-N 3.3Å; L872-I876 HydrophobicContact CD1-CD1 3.83Å; L872-I876 HydrophobicContact CD1-CG1 4.04Å; L872-I876 HydrophobicContact CG-CD1 3.71Å; L872-I876 HydrophobicContact CG-CG1 4.39Å; L872-I876 WeakPolarHBondContact O-CB 3.41Å; L872-I876 VanDerWaalsContact O-CD1 3.28Å; L872-I876 WeakPolarHBondContact O-CD1 3.36Å; L872-I876 WeakPolarHBondContact O-CG1 3.48Å; L872-I876 PolarHBondContact O-N 3.27Å; L872-L918 HydrophobicContact CD2-CD1 4.36Å; L872-L918 HydrophobicContact CD2-CD2 4.41Å; L872-L918 HydrophobicContact CG-CD1 4.43Å
873	S	87.5	Confident	84.2	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.4	-45.3	175.9	-58	0	0	0	0	112	I869 G870 R871 I876 C877	I869-S873 PolarHBondContact O-N 2.93Å; I869-S873 PolarHBondContact O-OG 2.92Å; G870-S873 WeakPolarHBondContact O-CB 3.2Å; G870-S873 PolarHBondContact O-N 3.17Å; R871-S873 VanDerWaalsContact C-N 3.31Å; S873-I876 PolarHBondContact O-N 2.82Å; S873-C877 WeakPolarHBondContact O-CB 3.24Å; S873-C877 PolarHBondContact O-N 3.14Å; S873-C877 PolarHBondContact O-SG 3.26Å
874	E	84.5	Confident	83.4	Confident	95 Å²	95	19.9 Å²	19.9	44%	0.444	10%	0.1	S	C	.	.	H	α-helix	trans	-60.1	-47.6	174.4	-172.9	-178.9	179.9	0	0	111.5	G870 R871 I876 C877 T878	G870-E874 PolarHBondContact O-N 2.75Å; R871-E874 PolarHBondContact O-N 3.47Å; E874-I876 PolarHBondContact O-N 3.43Å; E874-C877 WeakPolarHBondContact O-CB 3.47Å; E874-C877 PolarHBondContact O-N 3.15Å; E874-T878 WeakPolarHBondContact O-CG2 3.05Å; E874-T878 PolarHBondContact O-N 3.43Å; E874-T878 PolarHBondContact O-OG1 3.38Å
875	F	86.2	Confident	82.6	Confident	5 Å²	5	20.4 Å²	20.4	2%	0.022	10%	0.103	C	C	.	.	H	α-helix	trans	-56.8	-47.9	176.9	-177.8	-98.4	0	0	0	111.5	M742 H751 T792 R871 L872 C877 T878 C879	M742-F875 HydrophobicContact CE-CB 4.49Å; M742-F875 HydrophobicContact SD-CB 4.24Å; M742-F875 HydrophobicContact SD-CD1 4.1Å; M742-F875 HydrophobicContact SD-CD2 3.94Å; M742-F875 HydrophobicContact SD-CE1 4.45Å; M742-F875 HydrophobicContact SD-CE2 4.29Å; M742-F875 HydrophobicContact SD-CG 3.82Å; H751-F875 HydrophobicContact CB-CE2 4.33Å; H751-F875 HydrophobicContact CB-CZ 4.12Å; H751-F875 AromaticContact CD2-CE2 3.6Å; H751-F875 AromaticContact CG-CE2 3.97Å; T792-F875 HydrophobicContact CG2-CD1 3.87Å; T792-F875 HydrophobicContact CG2-CE1 3.55Å; T792-F875 HydrophobicContact CG2-CZ 4.38Å; R871-F875 VanDerWaalsContact O-CB 3.25Å; R871-F875 WeakPolarHBondContact O-CB 3.19Å; R871-F875 PolarHBondContact O-N 2.92Å; L872-F875 PolarHBondContact O-N 3.3Å; F875-C877 PolarHBondContact O-N 3.4Å; F875-T878 WeakPolarHBondContact CA-OG1 3.47Å; F875-T878 PolarHBondContact O-N 3Å; F875-T878 VanDerWaalsContact O-N 3.16Å; F875-T878 PolarHBondContact O-OG1 3.37Å; F875-C879 VanDerWaalsContact CE2-SG 3.6Å; F875-C879 WeakPolarHBondContact CZ-SG 3.42Å; F875-C879 WeakPolarHBondContact O-CB 3.44Å; F875-C879 PolarHBondContact O-N 3.32Å; F875-C879 PolarHBondContact O-SG 3.49Å
876	I	87.3	Confident	81.9	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.1	-44.3	177.2	-63.3	158.8	0	0	0	111.1	F796 L872 S873 E874 T878 C879 C880 V914 L918 F946	F796-I876 HydrophobicContact CE2-CD1 4.47Å; F796-I876 HydrophobicContact CE2-CG1 3.74Å; F796-I876 HydrophobicContact CZ-CG1 3.78Å; F796-I876 HydrophobicContact CZ-CG2 4.31Å; L872-I876 HydrophobicContact CD1-CD1 3.83Å; L872-I876 HydrophobicContact CD1-CG1 4.04Å; L872-I876 HydrophobicContact CG-CD1 3.71Å; L872-I876 HydrophobicContact CG-CG1 4.39Å; L872-I876 WeakPolarHBondContact O-CB 3.41Å; L872-I876 VanDerWaalsContact O-CD1 3.28Å; L872-I876 WeakPolarHBondContact O-CD1 3.36Å; L872-I876 WeakPolarHBondContact O-CG1 3.48Å; L872-I876 PolarHBondContact O-N 3.27Å; S873-I876 PolarHBondContact O-N 2.82Å; E874-I876 PolarHBondContact O-N 3.43Å; I876-T878 VanDerWaalsContact C-N 3.31Å; I876-T878 PolarHBondContact O-N 3.12Å; I876-C879 PolarHBondContact O-N 2.97Å; I876-C880 HydrophobicContact CG2-CB 4.42Å; I876-C880 WeakPolarHBondContact O-CB 3.35Å; I876-C880 PolarHBondContact O-N 3.36Å; I876-V914 HydrophobicContact CD1-CB 4.2Å; I876-V914 HydrophobicContact CD1-CG1 3.36Å; I876-V914 HydrophobicContact CG1-CG1 4.27Å; I876-L918 HydrophobicContact CD1-CD1 3.49Å; I876-L918 VanDerWaalsContact CD1-CD1 3.49Å; I876-F946 HydrophobicContact CG2-CE2 3.79Å; I876-F946 HydrophobicContact CG2-CZ 3.54Å
877	C	85.6	Confident	81	Confident	4 Å²	4	22.8 Å²	22.8	3%	0.027	11%	0.112	C	C	.	.	H	α-helix	trans	-60.4	-41.4	175.3	-71.3	0	0	0	0	111.7	S873 E874 F875 S881 H945	S873-C877 WeakPolarHBondContact O-CB 3.24Å; S873-C877 PolarHBondContact O-N 3.14Å; S873-C877 PolarHBondContact O-SG 3.26Å; E874-C877 WeakPolarHBondContact O-CB 3.47Å; E874-C877 PolarHBondContact O-N 3.15Å; F875-C877 PolarHBondContact O-N 3.4Å; C877-S881 WeakPolarHBondContact O-CB 3.31Å; C877-S881 PolarHBondContact O-N 3.09Å; C877-H945 HydrophobicContact CB-CB 4.16Å
878	T	80.6	Confident	80.2	Confident	14 Å²	14	24 Å²	24	9%	0.086	12%	0.117	C	C	.	.	H	α-helix	trans	-71.4	-38.2	179.6	59.4	0	0	0	0	113.1	P744 F748 E874 F875 I876 F891 G892	P744-T878 HydrophobicContact CB-CG2 4Å; F748-T878 WeakPolarHBondContact CZ-O 3.33Å; E874-T878 WeakPolarHBondContact O-CG2 3.05Å; E874-T878 PolarHBondContact O-N 3.43Å; E874-T878 PolarHBondContact O-OG1 3.38Å; F875-T878 WeakPolarHBondContact CA-OG1 3.47Å; F875-T878 PolarHBondContact O-N 3Å; F875-T878 VanDerWaalsContact O-N 3.16Å; F875-T878 PolarHBondContact O-OG1 3.37Å; I876-T878 VanDerWaalsContact C-N 3.31Å; I876-T878 PolarHBondContact O-N 3.12Å; T878-F891 HydrophobicContact CG2-CD1 3.81Å; T878-F891 HydrophobicContact CG2-CE1 4.2Å; T878-F891 HydrophobicContact CG2-CG 4.12Å; T878-G892 WeakPolarHBondContact O-CA 3.41Å; T878-G892 PolarHBondContact O-N 3.41Å
879	C	77.6	Confident	79.2	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.007	14%	0.136	C	C	.	.	H	α-helix	trans	-84.5	-43.4	-175.2	-67.3	0	0	0	0	112.9	F748 F875 I876	F748-C879 HydrophobicContact CD1-CB 4.31Å; F748-C879 WeakPolarHBondContact CD1-SG 3.33Å; F748-C879 HydrophobicContact CE1-CB 4.35Å; F748-C879 WeakPolarHBondContact CE1-SG 3.47Å; F875-C879 VanDerWaalsContact CE2-SG 3.6Å; F875-C879 WeakPolarHBondContact CZ-SG 3.42Å; F875-C879 WeakPolarHBondContact O-CB 3.44Å; F875-C879 PolarHBondContact O-N 3.32Å; F875-C879 PolarHBondContact O-SG 3.49Å; I876-C879 PolarHBondContact O-N 2.97Å
880	C	83.6	Confident	78	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-114	-2.6	-163.8	-59.4	0	0	0	0	113.9	F796 I876 L893 F946	F796-C880 VanDerWaalsContact CE1-SG 3.52Å; I876-C880 HydrophobicContact CG2-CB 4.42Å; I876-C880 WeakPolarHBondContact O-CB 3.35Å; I876-C880 PolarHBondContact O-N 3.36Å; C880-L893 WeakPolarHBondContact O-CD1 3.42Å; C880-F946 HydrophobicContact CB-CE1 4.32Å; C880-F946 HydrophobicContact CB-CZ 4.07Å
881	S	82.4	Confident	77.3	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.155	C	C	.	.			trans	-74.3	147.3	179.6	-172.9	0	0	0	0	112.3	C877 S883 G892 L893 H945	C877-S881 WeakPolarHBondContact O-CB 3.31Å; C877-S881 PolarHBondContact O-N 3.09Å; S881-S883 WeakPolarHBondContact OG-CB 3.41Å; S881-S883 PolarHBondContact OG-N 3.17Å; S881-S883 PolarHBondContact OG-OG 2.97Å; S881-G892 CarbonylContact O-C 3.47Å; S881-G892 WeakPolarHBondContact O-CA 3.47Å; S881-L893 PolarHBondContact O-N 2.98Å; S881-H945 WeakPolarHBondContact OG-CB 3.45Å; S881-H945 PolarHBondContact OG-CD2 3.46Å; S881-H945 VanDerWaalsContact OG-CD2 3.26Å; S881-H945 PolarHBondContact OG-O 3.13Å; S881-H945 VanDerWaalsContact OG-O 3.13Å
882	V	76.6	Confident	76.6	Confident	12 Å²	12	26.2 Å²	26.2	7%	0.073	14%	0.143	C	C	.	.			trans	-102.9	0.8	168.1	-66.7	0	0	0	0	112.5	L893 Q951 F970 V974 M978	V882-L893 HydrophobicContact CG1-CB 4.4Å; V882-L893 HydrophobicContact CG1-CD1 3.62Å; V882-Q951 PolarHBondContact O-NE2 3.27Å; V882-F970 HydrophobicContact CB-CD1 4.02Å; V882-F970 HydrophobicContact CB-CE1 3.74Å; V882-F970 HydrophobicContact CG2-CD1 3.86Å; V882-F970 HydrophobicContact CG2-CE1 3.41Å; V882-F970 VanDerWaalsContact CG2-CE1 3.41Å; V882-F970 HydrophobicContact CG2-CZ 4.06Å; V882-V974 HydrophobicContact CB-CG1 4.35Å; V882-V974 HydrophobicContact CG1-CG1 4.05Å; V882-V974 HydrophobicContact CG1-CG2 3.78Å; V882-V974 HydrophobicContact CG2-CG1 3.69Å; V882-M978 HydrophobicContact CG2-CE 4.13Å
883	S	74.4	Confident	75.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.			trans	-65	149.1	-172.3	69.3	0	0	0	0	112.1	S881 V885 A886 Q887 H945 Q951	S881-S883 WeakPolarHBondContact OG-CB 3.41Å; S881-S883 PolarHBondContact OG-N 3.17Å; S881-S883 PolarHBondContact OG-OG 2.97Å; S883-V885 PolarHBondContact O-N 2.88Å; S883-A886 WeakPolarHBondContact O-CB 3.36Å; S883-A886 PolarHBondContact O-N 3.21Å; S883-A886 VanDerWaalsContact O-N 3.08Å; S883-A886 WeakPolarHBondContact OG-CB 3.12Å; S883-A886 PolarHBondContact OG-N 3.48Å; S883-A886 VanDerWaalsContact OG-N 3.08Å; S883-Q887 WeakPolarHBondContact O-CG 3.2Å; S883-Q887 PolarHBondContact O-N 2.96Å; S883-H945 PolarHBondContact OG-CD2 2.97Å; S883-H945 VanDerWaalsContact OG-CD2 3.31Å; S883-Q951 VanDerWaalsContact C-NE2 3.3Å
884	S	69.2	Low	74.7	Confident	11 Å²	11	30 Å²	30	8%	0.077	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-28.7	177.7	52.4	0	0	0	0	110	Q887 E888	S884-Q887 PolarHBondContact O-N 2.71Å; S884-E888 VanDerWaalsContact O-CB 3.24Å; S884-E888 WeakPolarHBondContact O-CB 3.42Å; S884-E888 WeakPolarHBondContact O-CG 3.45Å; S884-E888 PolarHBondContact O-N 3.47Å
885	V	67.8	Low	73.5	Confident	56 Å²	56	28.2 Å²	28.2	34%	0.339	16%	0.16	S	C	.	.	H	α-helix	trans	-57.8	-49.5	170.3	-179.5	0	0	0	0	110.5	S883 S889 R950	S883-V885 PolarHBondContact O-N 2.88Å; V885-S889 WeakPolarHBondContact O-CB 3.46Å; V885-S889 PolarHBondContact O-N 2.96Å; V885-S889 PolarHBondContact O-OG 2.86Å; V885-R950 HydrophobicContact CG2-CB 4.38Å
886	A	71.2	Confident	72.3	Confident	1 Å²	1	29 Å²	29	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-47.3	173.8	0	0	0	0	0	110.4	S883 E888 S889 G890 F891	S883-A886 WeakPolarHBondContact O-CB 3.36Å; S883-A886 PolarHBondContact O-N 3.21Å; S883-A886 VanDerWaalsContact O-N 3.08Å; S883-A886 WeakPolarHBondContact OG-CB 3.12Å; S883-A886 PolarHBondContact OG-N 3.48Å; S883-A886 VanDerWaalsContact OG-N 3.08Å; A886-E888 PolarHBondContact O-N 2.73Å; A886-S889 WeakPolarHBondContact CA-OG 3.19Å; A886-S889 CarbonylContact O-C 3.48Å; A886-S889 PolarHBondContact O-N 3.24Å; A886-S889 PolarHBondContact O-OG 3.23Å; A886-G890 PolarHBondContact O-N 2.99Å; A886-F891 CarbonylContact C-O 3.07Å; A886-F891 HydrophobicContact CB-CB 4.21Å; A886-F891 CarbonylContact O-C 3.51Å; A886-F891 WeakPolarHBondContact O-CA 3.47Å; A886-F891 PolarHBondContact O-N 3.49Å
887	Q	69.2	Low	70.6	Confident	84 Å²	84	31 Å²	31	39%	0.393	18%	0.176	S	C	.	.	H	α-helix	trans	-60.1	-45.4	-179.4	-65.6	-179.6	-12.4	0	0	113.4	S883 S884 S889 G890 F891 S894 H895	S883-Q887 WeakPolarHBondContact O-CG 3.2Å; S883-Q887 PolarHBondContact O-N 2.96Å; S884-Q887 PolarHBondContact O-N 2.71Å; Q887-S889 VanDerWaalsContact C-N 3.32Å; Q887-G890 WeakPolarHBondContact O-CA 3.28Å; Q887-G890 PolarHBondContact O-N 2.91Å; Q887-F891 PolarHBondContact N-O 2.78Å; Q887-S894 WeakPolarHBondContact CG-OG 3.4Å; Q887-H895 PolarHBondContact O-NE2 3.25Å
888	E	65.5	Low	69	Low	130 Å²	130	39.2 Å²	39.2	61%	0.607	21%	0.214	S	C	*	.	H	α-helix	trans	-63	-38.1	177.8	-76.6	174.1	-178	0	0	111.2	S884 A886 G890 R950	S884-E888 VanDerWaalsContact O-CB 3.24Å; S884-E888 WeakPolarHBondContact O-CB 3.42Å; S884-E888 WeakPolarHBondContact O-CG 3.45Å; S884-E888 PolarHBondContact O-N 3.47Å; A886-E888 PolarHBondContact O-N 2.73Å; E888-G890 PolarHBondContact O-N 3.28Å; E888-R950 IonicContact OE1-CZ 2.77Å; E888-R950 IonicContact OE1-NH1 2.74Å; E888-R950 PolarHBondContact OE1-NH1 2.98Å; E888-R950 IonicContact OE1-NH2 2.9Å; E888-R950 IonicContact OE2-NH1 3.5Å; E888-R950 PolarHBondContact OE2-NH1 3.31Å
889	S	66.2	Low	67.6	Low	64 Å²	64	39.5 Å²	39.5	45%	0.448	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	1.8	174.7	51.8	0	0	0	0	113.3	V885 A886 Q887 F891	V885-S889 WeakPolarHBondContact O-CB 3.46Å; V885-S889 PolarHBondContact O-N 2.96Å; V885-S889 PolarHBondContact O-OG 2.86Å; A886-S889 WeakPolarHBondContact CA-OG 3.19Å; A886-S889 CarbonylContact O-C 3.48Å; A886-S889 PolarHBondContact O-N 3.24Å; A886-S889 PolarHBondContact O-OG 3.23Å; Q887-S889 VanDerWaalsContact C-N 3.32Å; S889-F891 WeakPolarHBondContact O-CD2 3.44Å; S889-F891 WeakPolarHBondContact O-CE2 3.28Å; S889-F891 VanDerWaalsContact OG-CD2 3.31Å; S889-F891 WeakPolarHBondContact OG-CD2 3.25Å
890	G	64.3	Low	66.4	Low	24 Å²	24	44.9 Å²	44.9	25%	0.247	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	19.8	178.6	0	0	0	0	0	113.9	R687 A886 Q887 E888	R687-G890 PolarHBondContact NH1-O 2.85Å; R687-G890 PolarHBondContact NH2-O 3.44Å; A886-G890 PolarHBondContact O-N 2.99Å; Q887-G890 WeakPolarHBondContact O-CA 3.28Å; Q887-G890 PolarHBondContact O-N 2.91Å; E888-G890 PolarHBondContact O-N 3.28Å
891	F	70.5	Confident	65.1	Low	50 Å²	50	50.3 Å²	50.3	22%	0.219	28%	0.278	C	S	.	.			trans	-111.5	170.8	178.5	-59.9	-80.7	0	0	0	112.2	P744 F748 T878 A886 Q887 S889 H895	P744-F891 HydrophobicContact CB-CE1 3.8Å; P744-F891 HydrophobicContact CB-CZ 4.42Å; F748-F891 HydrophobicContact CZ-CD1 4.03Å; T878-F891 HydrophobicContact CG2-CD1 3.81Å; T878-F891 HydrophobicContact CG2-CE1 4.2Å; T878-F891 HydrophobicContact CG2-CG 4.12Å; A886-F891 CarbonylContact C-O 3.07Å; A886-F891 HydrophobicContact CB-CB 4.21Å; A886-F891 CarbonylContact O-C 3.51Å; A886-F891 WeakPolarHBondContact O-CA 3.47Å; A886-F891 PolarHBondContact O-N 3.49Å; Q887-F891 PolarHBondContact N-O 2.78Å; S889-F891 WeakPolarHBondContact O-CD2 3.44Å; S889-F891 WeakPolarHBondContact O-CE2 3.28Å; S889-F891 VanDerWaalsContact OG-CD2 3.31Å; S889-F891 WeakPolarHBondContact OG-CD2 3.25Å; F891-H895 PolarHBondContact O-CD2 3.43Å; F891-H895 VanDerWaalsContact O-CD2 3.29Å
892	G	70.4	Confident	64.3	Low	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	97.4	178.2	173.5	0	0	0	0	0	115.1	T878 S881 S894 H895	T878-G892 WeakPolarHBondContact O-CA 3.41Å; T878-G892 PolarHBondContact O-N 3.41Å; S881-G892 CarbonylContact O-C 3.47Å; S881-G892 WeakPolarHBondContact O-CA 3.47Å; G892-S894 PolarHBondContact O-N 3.42Å; G892-H895 PolarHBondContact O-N 2.91Å; G892-H895 VanDerWaalsContact O-N 3.1Å
893	L	71.4	Confident	64	Low	10 Å²	10	56.3 Å²	56.3	5%	0.052	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-62.3	-27	-171.7	-74.5	163.5	0	0	0	113.8	C880 S881 V882 H895 M896 P904 L907 C908	C880-L893 WeakPolarHBondContact O-CD1 3.42Å; S881-L893 PolarHBondContact O-N 2.98Å; V882-L893 HydrophobicContact CG1-CB 4.4Å; V882-L893 HydrophobicContact CG1-CD1 3.62Å; L893-H895 PolarHBondContact O-N 3.16Å; L893-M896 HydrophobicContact CD2-SD 4.45Å; L893-M896 WeakPolarHBondContact O-CB 3.39Å; L893-M896 PolarHBondContact O-N 3.46Å; L893-M896 VanDerWaalsContact O-N 3.13Å; L893-P904 HydrophobicContact CD2-CB 4.38Å; L893-P904 WeakPolarHBondContact CD2-O 3.21Å; L893-L907 HydrophobicContact CD2-CB 3.79Å; L893-C908 HydrophobicContact CD1-CB 3.55Å
894	S	63.6	Low	64	Low	70 Å²	70	57.6 Å²	57.6	49%	0.49	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-67.2	-25.9	177.9	59.8	0	0	0	0	113.1	Q887 G892	Q887-S894 WeakPolarHBondContact CG-OG 3.4Å; G892-S894 PolarHBondContact O-N 3.42Å
895	H	60.1	Low	64.2	Low	56 Å²	56	61.9 Å²	61.9	26%	0.259	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-93.5	-0.6	176.8	-64.5	-78.3	0	0	0	111.9	F692 Q887 F891 G892 L893 T897	F692-H895 AromaticContact CE1-ND1 3.59Å; Q887-H895 PolarHBondContact O-NE2 3.25Å; F891-H895 PolarHBondContact O-CD2 3.43Å; F891-H895 VanDerWaalsContact O-CD2 3.29Å; G892-H895 PolarHBondContact O-N 2.91Å; G892-H895 VanDerWaalsContact O-N 3.1Å; L893-H895 PolarHBondContact O-N 3.16Å; H895-T897 PolarHBondContact O-N 2.9Å
896	M	60.1	Low	64.7	Low	21 Å²	21	62.8 Å²	62.8	10%	0.103	33%	0.334	C	S	.	.			trans	-80.7	107.3	168.7	-71	-147	127.1	0	0	109.9	F748 F752 L893 Q898 L907	F748-M896 HydrophobicContact CB-CE 3.07Å; F748-M896 HydrophobicContact CD2-CE 3.79Å; F748-M896 HydrophobicContact CD2-CG 4.12Å; F748-M896 HydrophobicContact CG-CE 3.71Å; F752-M896 HydrophobicContact CE2-CE 4.41Å; L893-M896 HydrophobicContact CD2-SD 4.45Å; L893-M896 WeakPolarHBondContact O-CB 3.39Å; L893-M896 PolarHBondContact O-N 3.46Å; L893-M896 VanDerWaalsContact O-N 3.13Å; M896-Q898 PolarHBondContact O-N 3.09Å; M896-L907 HydrophobicContact CE-CD1 4.39Å; M896-L907 HydrophobicContact SD-CD1 3.47Å; M896-L907 WeakPolarHBondContact SD-CD1 3.39Å; M896-L907 HydrophobicContact SD-CD2 4.43Å; M896-L907 HydrophobicContact SD-CG 4.46Å
897	T	53	Low	65	Low	44 Å²	44	62.8 Å²	62.8	27%	0.27	33%	0.334	S	S	.	.			trans	-64.4	131.3	169.3	44.8	0	0	0	0	110.2	P694 H895 S899	P694-T897 HydrophobicContact CB-CG2 4.08Å; P694-T897 WeakPolarHBondContact CB-OG1 3.16Å; P694-T897 HydrophobicContact CG-CG2 4.32Å; H895-T897 PolarHBondContact O-N 2.9Å; T897-S899 PolarHBondContact O-N 3.23Å
898	Q	51.8	Low	65.7	Low	175 Å²	175	58.8 Å²	58.8	82%	0.818	32%	0.315	S	S	*	.			trans	-54	97.7	174.5	-69.7	178.4	-10.4	0	0	110	M896 P904	M896-Q898 PolarHBondContact O-N 3.09Å; Q898-P904 HydrophobicContact CG-CG 4.43Å
899	S	51.7	Low	66.5	Low	21 Å²	21	53.8 Å²	53.8	15%	0.147	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-90.3	147.2	164.6	72.2	0	0	0	0	107.4	T897 F901 L902	T897-S899 PolarHBondContact O-N 3.23Å; S899-F901 PolarHBondContact O-N 2.72Å; S899-L902 PolarHBondContact O-N 3.09Å; S899-L902 PolarHBondContact OG-N 3.35Å
900	S	51.9	Low	67.3	Low	113 Å²	113	51.6 Å²	51.6	79%	0.79	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16	177.4	58.3	0	0	0	0	113.5
901	F	56.4	Low	68.4	Low	115 Å²	115	50.4 Å²	50.4	50%	0.504	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-23.9	-175.6	-120.6	-82.3	0	0	0	114.4	V697 S899	V697-F901 HydrophobicContact CG1-CD2 4.17Å; S899-F901 PolarHBondContact O-N 2.72Å
902	L	65.2	Low	69.3	Low	17 Å²	17	48 Å²	48	9%	0.089	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-139	97	-171.2	-77.8	169.1	0	0	0	109	F752 V800 S899 L907	F752-L902 HydrophobicContact CB-CD1 4.22Å; F752-L902 HydrophobicContact CD1-CD1 4.13Å; F752-L902 HydrophobicContact CD1-CD2 4.16Å; F752-L902 HydrophobicContact CD2-CD1 3.83Å; F752-L902 HydrophobicContact CE1-CD1 4.49Å; F752-L902 HydrophobicContact CE1-CD2 4.13Å; F752-L902 HydrophobicContact CE2-CD1 4.29Å; F752-L902 HydrophobicContact CG-CD1 3.81Å; V800-L902 HydrophobicContact CG1-CD2 4.12Å; S899-L902 PolarHBondContact O-N 3.09Å; S899-L902 PolarHBondContact OG-N 3.35Å; L902-L907 HydrophobicContact CB-CD1 3.7Å; L902-L907 HydrophobicContact CD1-CD1 4.48Å; L902-L907 HydrophobicContact CD2-CD1 3.93Å; L902-L907 HydrophobicContact CD2-CD2 4.3Å; L902-L907 HydrophobicContact CD2-CG 4.06Å; L902-L907 HydrophobicContact CG-CD1 4.24Å
903	K	70.7	Confident	70.1	Confident	121 Å²	121	52.6 Å²	52.6	53%	0.526	28%	0.282	S	S	.	.			trans	-72.5	136.3	171.4	-63	179.4	-178	174.8	0	108.8	E905 D906 L907	K903-E905 HydrophobicContact CB-CB 4.46Å; K903-E905 PolarHBondContact O-N 3.46Å; K903-E905 VanDerWaalsContact O-N 3.13Å; K903-D906 HydrophobicContact CB-CB 4.5Å; K903-D906 WeakPolarHBondContact CB-OD2 3.49Å; K903-D906 PolarHBondContact O-N 3.13Å; K903-D906 VanDerWaalsContact O-N 3.13Å; K903-L907 PolarHBondContact O-N 2.96Å
904	P	73	Confident	71	Confident	27 Å²	27	52.2 Å²	52.2	18%	0.175	28%	0.28	C	S	.	.	H	α-helix	trans	-53.7	-31.7	173.1	-26.7	34.4	0	0	0	112.9	L893 Q898 C908	L893-P904 HydrophobicContact CD2-CB 4.38Å; L893-P904 WeakPolarHBondContact CD2-O 3.21Å; Q898-P904 HydrophobicContact CG-CG 4.43Å; P904-C908 WeakPolarHBondContact O-CB 3.46Å; P904-C908 PolarHBondContact O-N 3.26Å
905	E	74.4	Confident	72.3	Confident	101 Å²	101	48.9 Å²	48.9	47%	0.472	26%	0.257	S	S	.	.	H	α-helix	trans	-60.4	-52.4	175.4	-69.2	156.1	-169.2	0	0	112.3	K903 L907 C908 G909 F973	K903-E905 HydrophobicContact CB-CB 4.46Å; K903-E905 PolarHBondContact O-N 3.46Å; K903-E905 VanDerWaalsContact O-N 3.13Å; E905-L907 VanDerWaalsContact C-N 3.33Å; E905-L907 PolarHBondContact O-N 2.98Å; E905-C908 WeakPolarHBondContact O-CB 3.44Å; E905-C908 PolarHBondContact O-N 2.91Å; E905-G909 PolarHBondContact O-N 2.9Å; E905-F973 HydrophobicContact CB-CD2 4.43Å; E905-F973 HydrophobicContact CB-CG 4.37Å; E905-F973 HydrophobicContact CG-CB 4.24Å; E905-F973 HydrophobicContact CG-CD1 3.56Å; E905-F973 HydrophobicContact CG-CD2 4.12Å; E905-F973 HydrophobicContact CG-CE1 3.81Å; E905-F973 HydrophobicContact CG-CE2 4.36Å; E905-F973 HydrophobicContact CG-CG 3.73Å; E905-F973 HydrophobicContact CG-CZ 4.23Å
906	D	77.1	Confident	73.8	Confident	75 Å²	75	46.2 Å²	46.2	40%	0.401	24%	0.244	S	C	.	.	H	α-helix	trans	-64.3	-39.3	-178.1	-59.3	-29.7	0	0	0	111.5	K903 S910	K903-D906 HydrophobicContact CB-CB 4.5Å; K903-D906 WeakPolarHBondContact CB-OD2 3.49Å; K903-D906 PolarHBondContact O-N 3.13Å; K903-D906 VanDerWaalsContact O-N 3.13Å; D906-S910 VanDerWaalsContact O-CB 3.26Å; D906-S910 WeakPolarHBondContact O-CB 3.34Å; D906-S910 PolarHBondContact O-N 3.32Å; D906-S910 PolarHBondContact O-OG 3.06Å
907	L	78.5	Confident	75.2	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-68.7	-36.6	175.7	-84.8	150	0	0	0	112.9	F752 L893 M896 L902 K903 E905 G911	F752-L907 HydrophobicContact CE1-CD2 3.98Å; F752-L907 HydrophobicContact CE2-CD2 4.12Å; F752-L907 HydrophobicContact CZ-CD2 3.39Å; L893-L907 HydrophobicContact CD2-CB 3.79Å; M896-L907 HydrophobicContact CE-CD1 4.39Å; M896-L907 HydrophobicContact SD-CD1 3.47Å; M896-L907 WeakPolarHBondContact SD-CD1 3.39Å; M896-L907 HydrophobicContact SD-CD2 4.43Å; M896-L907 HydrophobicContact SD-CG 4.46Å; L902-L907 HydrophobicContact CB-CD1 3.7Å; L902-L907 HydrophobicContact CD1-CD1 4.48Å; L902-L907 HydrophobicContact CD2-CD1 3.93Å; L902-L907 HydrophobicContact CD2-CD2 4.3Å; L902-L907 HydrophobicContact CD2-CG 4.06Å; L902-L907 HydrophobicContact CG-CD1 4.24Å; K903-L907 PolarHBondContact O-N 2.96Å; E905-L907 VanDerWaalsContact C-N 3.33Å; E905-L907 PolarHBondContact O-N 2.98Å; L907-G911 PolarHBondContact O-N 2.83Å
908	C	82.9	Confident	77	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-57.1	174	-172.3	0	0	0	0	109.7	L893 P904 E905 S910 G911 Y912 F973	L893-C908 HydrophobicContact CD1-CB 3.55Å; P904-C908 WeakPolarHBondContact O-CB 3.46Å; P904-C908 PolarHBondContact O-N 3.26Å; E905-C908 WeakPolarHBondContact O-CB 3.44Å; E905-C908 PolarHBondContact O-N 2.91Å; C908-S910 VanDerWaalsContact C-N 3.31Å; C908-S910 PolarHBondContact O-N 2.78Å; C908-G911 PolarHBondContact O-N 2.92Å; C908-G911 VanDerWaalsContact O-N 3.08Å; C908-Y912 VanDerWaalsContact O-CD2 3.29Å; C908-Y912 WeakPolarHBondContact O-CD2 3.29Å; C908-Y912 PolarHBondContact O-N 3.25Å; C908-Y912 VanDerWaalsContact SG-CE2 3.56Å; C908-F973 HydrophobicContact CB-CD2 3.79Å; C908-F973 HydrophobicContact CB-CE2 3.69Å
909	G	83	Confident	78.8	Confident	25 Å²	25	35.8 Å²	35.8	26%	0.258	19%	0.193	S	C	.	.	H	α-helix	trans	-55.7	-46.8	179.3	0	0	0	0	0	112	E905 G911 Y912 Q913	E905-G909 PolarHBondContact O-N 2.9Å; G909-G911 PolarHBondContact O-N 3.21Å; G909-Y912 PolarHBondContact O-N 2.83Å; G909-Q913 WeakPolarHBondContact O-CB 3.38Å; G909-Q913 PolarHBondContact O-N 3.24Å
910	S	83.3	Confident	80.7	Confident	17 Å²	17	37.8 Å²	37.8	12%	0.119	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-49.3	175	-58.5	0	0	0	0	111.3	D906 C908 Y912 Q913 V914	D906-S910 VanDerWaalsContact O-CB 3.26Å; D906-S910 WeakPolarHBondContact O-CB 3.34Å; D906-S910 PolarHBondContact O-N 3.32Å; D906-S910 PolarHBondContact O-OG 3.06Å; C908-S910 VanDerWaalsContact C-N 3.31Å; C908-S910 PolarHBondContact O-N 2.78Å; S910-Y912 VanDerWaalsContact C-N 3.35Å; S910-Y912 PolarHBondContact O-N 2.79Å; S910-Q913 WeakPolarHBondContact O-CB 3.33Å; S910-Q913 PolarHBondContact O-N 2.84Å; S910-Q913 VanDerWaalsContact O-N 3.11Å; S910-V914 VanDerWaalsContact O-CG2 3.25Å; S910-V914 WeakPolarHBondContact O-CG2 3.49Å; S910-V914 PolarHBondContact O-N 3.01Å
911	G	88.2	Confident	82.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58	-43.7	-179.9	0	0	0	0	0	113.3	L907 C908 G909 V914 A915	L907-G911 PolarHBondContact O-N 2.83Å; C908-G911 PolarHBondContact O-N 2.92Å; C908-G911 VanDerWaalsContact O-N 3.08Å; G909-G911 PolarHBondContact O-N 3.21Å; G911-V914 PolarHBondContact O-N 2.61Å; G911-A915 WeakPolarHBondContact O-CB 3.39Å; G911-A915 PolarHBondContact O-N 3.25Å
912	Y	89	Confident	84.1	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-44.3	173.5	-87.4	-80.6	0	0	0	112	C908 G909 S910 V914 A915 G916 F946 V974 S977 M978 F985	C908-Y912 VanDerWaalsContact O-CD2 3.29Å; C908-Y912 WeakPolarHBondContact O-CD2 3.29Å; C908-Y912 PolarHBondContact O-N 3.25Å; C908-Y912 VanDerWaalsContact SG-CE2 3.56Å; G909-Y912 PolarHBondContact O-N 2.83Å; S910-Y912 VanDerWaalsContact C-N 3.35Å; S910-Y912 PolarHBondContact O-N 2.79Å; Y912-V914 PolarHBondContact O-N 3.06Å; Y912-A915 PolarHBondContact O-N 3.25Å; Y912-G916 PolarHBondContact O-N 3.27Å; Y912-F946 HydrophobicContact CD1-CB 4.38Å; Y912-F946 AromaticContact CD1-CD1 3.83Å; Y912-F946 HydrophobicContact CD1-CD1 3.83Å; Y912-F946 HydrophobicContact CD2-CD1 4.15Å; Y912-F946 HydrophobicContact CD2-CE1 4.4Å; Y912-F946 HydrophobicContact CE1-CB 3.91Å; Y912-F946 AromaticContact CE1-CD1 3.64Å; Y912-F946 HydrophobicContact CE1-CD1 3.64Å; Y912-F946 HydrophobicContact CE1-CG 4.28Å; Y912-F946 WeakPolarHBondContact CE1-O 3.37Å; Y912-F946 AromaticContact CE2-CD1 3.99Å; Y912-F946 HydrophobicContact CE2-CD1 3.99Å; Y912-F946 HydrophobicContact CE2-CE1 4.35Å; Y912-F946 HydrophobicContact CG-CD1 4.04Å; Y912-F946 AromaticContact CZ-CD1 3.7Å; Y912-V974 HydrophobicContact CE2-CG1 4.31Å; Y912-S977 VanDerWaalsContact CD2-CB 3.48Å; Y912-M978 HydrophobicContact CD1-CG 4.22Å; Y912-M978 HydrophobicContact CE1-CB 4.17Å; Y912-M978 HydrophobicContact CE1-CE 4.5Å; Y912-M978 HydrophobicContact CE1-CG 3.29Å; Y912-M978 HydrophobicContact CE2-CG 4.39Å; Y912-M978 VanDerWaalsContact CZ-CG 3.42Å; Y912-M978 WeakPolarHBondContact OH-CE 3.45Å; Y912-M978 WeakPolarHBondContact OH-CG 3.15Å; Y912-F985 HydrophobicContact CD1-CE2 4.34Å; Y912-F985 HydrophobicContact CD1-CZ 4.09Å
913	Q	87.8	Confident	85.3	Confident	95 Å²	95	27.4 Å²	27.4	44%	0.444	14%	0.137	S	C	.	.	H	α-helix	trans	-61.3	-44.3	177.3	-170.4	-175.6	2.7	0	0	111.5	G909 S910 G916 M917	G909-Q913 WeakPolarHBondContact O-CB 3.38Å; G909-Q913 PolarHBondContact O-N 3.24Å; S910-Q913 WeakPolarHBondContact O-CB 3.33Å; S910-Q913 PolarHBondContact O-N 2.84Å; S910-Q913 VanDerWaalsContact O-N 3.11Å; Q913-G916 PolarHBondContact O-N 3.29Å; Q913-M917 HydrophobicContact CG-CE 4.28Å; Q913-M917 WeakPolarHBondContact O-CG 3.3Å; Q913-M917 PolarHBondContact O-N 2.98Å
914	V	88.9	Confident	86.1	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-64.7	-46.9	177	-175.8	0	0	0	0	111.5	L795 F796 I876 S910 G911 Y912 G916 M917 L918	L795-V914 HydrophobicContact CB-CG2 3.89Å; L795-V914 HydrophobicContact CD1-CG1 3.74Å; L795-V914 HydrophobicContact CD2-CB 4.44Å; L795-V914 HydrophobicContact CD2-CG1 3.99Å; L795-V914 HydrophobicContact CD2-CG2 3.81Å; L795-V914 HydrophobicContact CG-CG1 4.32Å; L795-V914 HydrophobicContact CG-CG2 4.29Å; F796-V914 HydrophobicContact CE1-CG2 4.19Å; F796-V914 HydrophobicContact CE2-CG1 4.5Å; F796-V914 HydrophobicContact CE2-CG2 4.05Å; F796-V914 HydrophobicContact CZ-CB 4.23Å; F796-V914 HydrophobicContact CZ-CG2 3.77Å; I876-V914 HydrophobicContact CD1-CB 4.2Å; I876-V914 HydrophobicContact CD1-CG1 3.36Å; I876-V914 HydrophobicContact CG1-CG1 4.27Å; S910-V914 VanDerWaalsContact O-CG2 3.25Å; S910-V914 WeakPolarHBondContact O-CG2 3.49Å; S910-V914 PolarHBondContact O-N 3.01Å; G911-V914 PolarHBondContact O-N 2.61Å; Y912-V914 PolarHBondContact O-N 3.06Å; V914-G916 PolarHBondContact O-N 3.07Å; V914-M917 HydrophobicContact CB-CE 4.49Å; V914-M917 HydrophobicContact CG2-CE 4.32Å; V914-M917 PolarHBondContact O-N 3.23Å; V914-L918 HydrophobicContact CG1-CD1 4.11Å; V914-L918 HydrophobicContact CG1-CG 4.41Å; V914-L918 WeakPolarHBondContact O-CB 3.4Å; V914-L918 WeakPolarHBondContact O-CG 3.41Å; V914-L918 PolarHBondContact O-N 3.48Å
915	A	91.3	Very high	86.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.7	-40.1	175.5	0	0	0	0	0	110.9	G911 Y912 L918 V919 L942 F946 F985	G911-A915 WeakPolarHBondContact O-CB 3.39Å; G911-A915 PolarHBondContact O-N 3.25Å; Y912-A915 PolarHBondContact O-N 3.25Å; A915-L918 PolarHBondContact O-N 3.21Å; A915-V919 WeakPolarHBondContact O-CB 3.45Å; A915-V919 WeakPolarHBondContact O-CG2 3.34Å; A915-V919 PolarHBondContact O-N 2.68Å; A915-L942 HydrophobicContact CB-CD2 4.24Å; A915-F946 HydrophobicContact CB-CB 4.42Å; A915-F946 HydrophobicContact CB-CD1 4.24Å; A915-F946 HydrophobicContact CB-CD2 4Å; A915-F946 HydrophobicContact CB-CE2 4.36Å; A915-F946 HydrophobicContact CB-CG 3.96Å; A915-F985 HydrophobicContact CB-CE1 4.16Å; A915-F985 HydrophobicContact CB-CZ 4.44Å
916	G	90.8	Very high	87.4	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.3	-52	176.2	0	0	0	0	0	111.9	Y912 Q913 V914 V919 R920 F985	Y912-G916 PolarHBondContact O-N 3.27Å; Q913-G916 PolarHBondContact O-N 3.29Å; V914-G916 PolarHBondContact O-N 3.07Å; G916-V919 PolarHBondContact O-N 2.97Å; G916-R920 VanDerWaalsContact O-CB 3.29Å; G916-R920 WeakPolarHBondContact O-CB 3.4Å; G916-R920 PolarHBondContact O-N 3.4Å; G916-F985 VanDerWaalsContact CA-CE1 3.42Å
917	M	89.6	Confident	87.8	Confident	22 Å²	22	17 Å²	17	11%	0.108	9%	0.086	C	C	.	.	H	α-helix	trans	-61.4	-46.1	176.9	-71.3	-175.3	-66.3	0	0	112.5	L795 E839 Q913 V914 V919 R920 H921	L795-M917 HydrophobicContact CD2-CE 3.48Å; L795-M917 VanDerWaalsContact CD2-CE 3.48Å; E839-M917 HydrophobicContact CB-SD 4.22Å; Q913-M917 HydrophobicContact CG-CE 4.28Å; Q913-M917 WeakPolarHBondContact O-CG 3.3Å; Q913-M917 PolarHBondContact O-N 2.98Å; V914-M917 HydrophobicContact CB-CE 4.49Å; V914-M917 HydrophobicContact CG2-CE 4.32Å; V914-M917 PolarHBondContact O-N 3.23Å; M917-V919 PolarHBondContact O-N 3.49Å; M917-R920 PolarHBondContact O-N 2.71Å; M917-H921 PolarHBondContact O-CD2 2.8Å; M917-H921 PolarHBondContact O-N 3.47Å
918	L	91	Very high	87.8	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.8	-46.3	178.7	-81.8	173.2	0	0	0	111.3	F842 I869 L872 I876 V914 A915 C922 L926 L942	F842-L918 HydrophobicContact CD1-CD2 4.17Å; F842-L918 HydrophobicContact CE1-CD2 3.51Å; F842-L918 HydrophobicContact CE2-CD2 4.07Å; F842-L918 HydrophobicContact CE2-CG 4.43Å; F842-L918 HydrophobicContact CZ-CD2 3.46Å; F842-L918 VanDerWaalsContact CZ-CD2 3.46Å; F842-L918 HydrophobicContact CZ-CG 4.18Å; I869-L918 HydrophobicContact CG2-CD2 3.94Å; L872-L918 HydrophobicContact CD2-CD1 4.36Å; L872-L918 HydrophobicContact CD2-CD2 4.41Å; L872-L918 HydrophobicContact CG-CD1 4.43Å; I876-L918 HydrophobicContact CD1-CD1 3.49Å; I876-L918 VanDerWaalsContact CD1-CD1 3.49Å; V914-L918 HydrophobicContact CG1-CD1 4.11Å; V914-L918 HydrophobicContact CG1-CG 4.41Å; V914-L918 WeakPolarHBondContact O-CB 3.4Å; V914-L918 WeakPolarHBondContact O-CG 3.41Å; V914-L918 PolarHBondContact O-N 3.48Å; A915-L918 PolarHBondContact O-N 3.21Å; L918-C922 VanDerWaalsContact O-CA 3.28Å; L918-C922 WeakPolarHBondContact O-CA 3.43Å; L918-C922 WeakPolarHBondContact O-CB 3.3Å; L918-C922 PolarHBondContact O-N 3.32Å; L918-L926 HydrophobicContact CB-CD1 4.3Å; L918-L942 HydrophobicContact CB-CD1 4.47Å
919	V	91.2	Very high	87	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.3	-45.5	178.3	165.8	0	0	0	0	110.8	A915 G916 M917 H921 S923 F939 L942 F947 F985 G988	A915-V919 WeakPolarHBondContact O-CB 3.45Å; A915-V919 WeakPolarHBondContact O-CG2 3.34Å; A915-V919 PolarHBondContact O-N 2.68Å; G916-V919 PolarHBondContact O-N 2.97Å; M917-V919 PolarHBondContact O-N 3.49Å; V919-H921 VanDerWaalsContact C-N 3.28Å; V919-H921 PolarHBondContact O-N 2.93Å; V919-S923 WeakPolarHBondContact CG1-OG 3.02Å; V919-S923 WeakPolarHBondContact O-CB 3.3Å; V919-S923 PolarHBondContact O-N 3.25Å; V919-S923 PolarHBondContact O-OG 3.47Å; V919-F939 HydrophobicContact CG1-CE2 4.13Å; V919-F939 HydrophobicContact CG2-CD2 4.41Å; V919-F939 HydrophobicContact CG2-CE2 4.26Å; V919-L942 HydrophobicContact CG2-CB 4.48Å; V919-L942 HydrophobicContact CG2-CD1 3.88Å; V919-F947 HydrophobicContact CB-CE1 4.44Å; V919-F947 HydrophobicContact CB-CZ 3.68Å; V919-F947 HydrophobicContact CG1-CE1 3.86Å; V919-F947 HydrophobicContact CG1-CZ 3.59Å; V919-F947 HydrophobicContact CG2-CE1 4.3Å; V919-F947 HydrophobicContact CG2-CE2 3.8Å; V919-F947 HydrophobicContact CG2-CZ 3.28Å; V919-F985 HydrophobicContact CB-CD1 4.36Å; V919-F985 HydrophobicContact CG1-CD1 4.47Å; V919-G988 WeakPolarHBondContact O-CA 3.47Å
920	R	90.8	Very high	85.8	Confident	63 Å²	63	25.1 Å²	25.1	24%	0.238	13%	0.134	C	C	.	.	H	α-helix	trans	-56.2	-42.1	178.4	172	166.9	159.9	-150.1	-19.5	112.7	E839 G916 M917 E984 R987 Q991	E839-R920 IonicContact OE1-CZ 3.8Å; E839-R920 IonicContact OE1-NH1 3.8Å; E839-R920 PolarHBondContact OE1-NH1 3.23Å; E839-R920 IonicContact OE1-NH2 2.84Å; E839-R920 PolarHBondContact OE1-NH2 2.89Å; G916-R920 VanDerWaalsContact O-CB 3.29Å; G916-R920 WeakPolarHBondContact O-CB 3.4Å; G916-R920 PolarHBondContact O-N 3.4Å; M917-R920 PolarHBondContact O-N 2.71Å; R920-E984 HydrophobicContact CB-CB 4.41Å; R920-E984 WeakPolarHBondContact CD-OE2 3.49Å; R920-E984 IonicContact CZ-OE2 3.19Å; R920-E984 IonicContact NE-OE2 3.77Å; R920-E984 IonicContact NH1-OE1 3.61Å; R920-E984 IonicContact NH1-OE2 2.74Å; R920-E984 PolarHBondContact NH1-OE2 2.73Å; R920-R987 HydrophobicContact CG-CB 4.3Å; R920-Q991 PolarHBondContact O-NE2 3.01Å
921	H	90	Very high	84.4	Confident	25 Å²	25	30.5 Å²	30.5	12%	0.116	17%	0.166	C	C	.	.	H	α-helix	trans	-102.3	-26	-171.7	-65	-65.7	0	0	0	113.9	E839 F842 I843 A846 M917 V919	E839-H921 WeakPolarHBondContact CG-NE2 3.48Å; E839-H921 IonicContact OE1-NE2 2.65Å; E839-H921 PolarHBondContact OE1-NE2 2.94Å; F842-H921 HydrophobicContact CB-CB 3.78Å; I843-H921 WeakPolarHBondContact CG1-CE1 3.47Å; I843-H921 WeakPolarHBondContact CG1-ND1 3.45Å; A846-H921 VanDerWaalsContact CB-O 3.3Å; A846-H921 WeakPolarHBondContact CB-O 3.47Å; M917-H921 PolarHBondContact O-CD2 2.8Å; M917-H921 PolarHBondContact O-N 3.47Å; V919-H921 VanDerWaalsContact C-N 3.28Å; V919-H921 PolarHBondContact O-N 2.93Å
922	C	90.3	Very high	82.8	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-120.2	11.5	-169.9	-54.7	0	0	0	0	113.8	F865 L918 M924 L925 L926	F865-C922 HydrophobicContact CE1-CB 4.11Å; F865-C922 HydrophobicContact CZ-CB 3.81Å; L918-C922 VanDerWaalsContact O-CA 3.28Å; L918-C922 WeakPolarHBondContact O-CA 3.43Å; L918-C922 WeakPolarHBondContact O-CB 3.3Å; L918-C922 PolarHBondContact O-N 3.32Å; C922-M924 VanDerWaalsContact C-N 3.34Å; C922-M924 PolarHBondContact O-N 2.98Å; C922-L925 WeakPolarHBondContact O-CB 3.39Å; C922-L925 PolarHBondContact O-N 3.47Å; C922-L926 HydrophobicContact CB-CD1 4.03Å; C922-L926 HydrophobicContact CB-CG 4.13Å; C922-L926 WeakPolarHBondContact O-CG 3.44Å; C922-L926 PolarHBondContact O-N 2.92Å
923	S	89.8	Confident	80.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-51.6	-48	179.9	-79.3	0	0	0	0	113.4	V919 L925 L926 Y927 G988	V919-S923 WeakPolarHBondContact CG1-OG 3.02Å; V919-S923 WeakPolarHBondContact O-CB 3.3Å; V919-S923 PolarHBondContact O-N 3.25Å; V919-S923 PolarHBondContact O-OG 3.47Å; S923-L925 PolarHBondContact O-N 3.31Å; S923-L926 PolarHBondContact O-N 3.36Å; S923-Y927 WeakPolarHBondContact O-CB 3.39Å; S923-Y927 PolarHBondContact O-N 3.38Å; S923-G988 VanDerWaalsContact CB-O 3.28Å; S923-G988 WeakPolarHBondContact CB-O 3.4Å; S923-G988 VanDerWaalsContact OG-C 3.24Å; S923-G988 WeakPolarHBondContact OG-CA 3.17Å; S923-G988 PolarHBondContact OG-O 2.9Å
924	M	86.7	Confident	79.4	Confident	81 Å²	81	43.5 Å²	43.5	40%	0.399	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-30.1	179.3	-73.7	-167.5	174.4	0	0	113.3	K862 C922 Q991	K862-M924 WeakPolarHBondContact CE-O 3.34Å; K862-M924 PolarHBondContact NZ-O 3.08Å; C922-M924 VanDerWaalsContact C-N 3.34Å; C922-M924 PolarHBondContact O-N 2.98Å; M924-Q991 HydrophobicContact CE-CB 4.1Å; M924-Q991 WeakPolarHBondContact CE-O 3.21Å; M924-Q991 HydrophobicContact CG-CB 4.05Å
925	L	87	Confident	78	Confident	3 Å²	3	46 Å²	46	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-82.4	-42.5	178.3	-72.2	168.7	0	0	0	111.7	I845 F849 F861 K862 F865 V866 C922 S923	I845-L925 HydrophobicContact CG2-CD1 4.1Å; F849-L925 HydrophobicContact CB-CD1 4.45Å; F849-L925 HydrophobicContact CB-CD2 4.01Å; F849-L925 HydrophobicContact CD1-CD2 4.09Å; F849-L925 HydrophobicContact CD1-CG 4.48Å; F849-L925 HydrophobicContact CD2-CD2 3.47Å; F849-L925 VanDerWaalsContact CD2-CD2 3.47Å; F849-L925 HydrophobicContact CE1-CD2 4.41Å; F849-L925 HydrophobicContact CE2-CD2 3.81Å; F849-L925 HydrophobicContact CG-CD2 3.59Å; F849-L925 HydrophobicContact CG-CG 4.31Å; F849-L925 HydrophobicContact CZ-CD2 4.27Å; F861-L925 HydrophobicContact CD1-CD2 4.19Å; F861-L925 HydrophobicContact CE1-CD1 4.45Å; F861-L925 HydrophobicContact CE1-CD2 4.25Å; K862-L925 HydrophobicContact CB-CD2 4.16Å; K862-L925 WeakPolarHBondContact CE-O 3.48Å; K862-L925 HydrophobicContact CG-CD2 4.29Å; F865-L925 HydrophobicContact CD1-CB 3.57Å; F865-L925 HydrophobicContact CD1-CD1 4.09Å; F865-L925 HydrophobicContact CD1-CG 4.29Å; F865-L925 HydrophobicContact CD2-CD1 4.06Å; F865-L925 HydrophobicContact CE1-CB 3.55Å; F865-L925 HydrophobicContact CE1-CD1 3.98Å; F865-L925 HydrophobicContact CE1-CG 4.37Å; F865-L925 HydrophobicContact CE2-CD1 3.93Å; F865-L925 HydrophobicContact CG-CB 4.31Å; F865-L925 HydrophobicContact CG-CD1 4.13Å; F865-L925 HydrophobicContact CZ-CB 4.28Å; F865-L925 HydrophobicContact CZ-CD1 3.89Å; V866-L925 WeakPolarHBondContact CG2-O 3.44Å; C922-L925 WeakPolarHBondContact O-CB 3.39Å; C922-L925 PolarHBondContact O-N 3.47Å; S923-L925 PolarHBondContact O-N 3.31Å
926	L	87.7	Confident	77	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-77	-26.9	-176.8	-66.4	173.3	0	0	0	113.4	F865 I869 L918 C922 S923 S928 F939 L942	F865-L926 HydrophobicContact CD1-CD2 4.5Å; F865-L926 HydrophobicContact CE1-CD2 3.81Å; F865-L926 HydrophobicContact CE1-CG 4.15Å; I869-L926 HydrophobicContact CG2-CD2 4.27Å; L918-L926 HydrophobicContact CB-CD1 4.3Å; C922-L926 HydrophobicContact CB-CD1 4.03Å; C922-L926 HydrophobicContact CB-CG 4.13Å; C922-L926 WeakPolarHBondContact O-CG 3.44Å; C922-L926 PolarHBondContact O-N 2.92Å; S923-L926 PolarHBondContact O-N 3.36Å; L926-S928 PolarHBondContact O-N 3.49Å; L926-F939 HydrophobicContact CB-CB 4.1Å; L926-L942 HydrophobicContact CD1-CD1 4.03Å
927	Y	86.6	Confident	76.6	Confident	23 Å²	23	49.9 Å²	49.9	9%	0.09	30%	0.295	C	S	.	.			trans	-80	115.3	-179.1	-175.8	-112.7	0	0	0	111.2	K862 S923 F939 L992 D997 Y999 I1000	K862-Y927 WeakPolarHBondContact CE-O 3.1Å; K862-Y927 PolarHBondContact NZ-O 3.08Å; S923-Y927 WeakPolarHBondContact O-CB 3.39Å; S923-Y927 PolarHBondContact O-N 3.38Å; Y927-F939 HydrophobicContact CD2-CB 4.27Å; Y927-F939 AromaticContact CD2-CD1 3.66Å; Y927-F939 HydrophobicContact CD2-CD1 3.66Å; Y927-F939 HydrophobicContact CD2-CE1 4.29Å; Y927-F939 HydrophobicContact CD2-CG 4.1Å; Y927-F939 HydrophobicContact CE2-CD1 4.38Å; Y927-L992 HydrophobicContact CD1-CD1 4.43Å; Y927-L992 HydrophobicContact CD1-CD2 4.05Å; Y927-L992 HydrophobicContact CD2-CD1 4.38Å; Y927-L992 HydrophobicContact CG-CD1 4.06Å; Y927-L992 HydrophobicContact CG-CD2 4.03Å; Y927-D997 PolarHBondContact OH-OD2 3.42Å; Y927-Y999 HydrophobicContact CE2-CD1 4.14Å; Y927-Y999 HydrophobicContact CE2-CE1 4.36Å; Y927-I1000 HydrophobicContact CD2-CD1 4.21Å; Y927-I1000 HydrophobicContact CE1-CD1 4.37Å; Y927-I1000 HydrophobicContact CE1-CG1 4.4Å; Y927-I1000 HydrophobicContact CE2-CD1 3.74Å
928	S	77.1	Confident	76.4	Confident	42 Å²	42	49.7 Å²	49.7	29%	0.294	30%	0.296	S	S	.	.			trans	-124.3	130	168.9	59.6	0	0	0	0	109	L926 V930 S937	L926-S928 PolarHBondContact O-N 3.49Å; S928-V930 PolarHBondContact O-N 3.43Å; S928-S937 WeakPolarHBondContact OG-CB 3.26Å
929	P	66.4	Low	76.2	Confident	87 Å²	87	49.7 Å²	49.7	57%	0.565	30%	0.296	S	S	*	.			trans	-60.3	129.7	173.6	25	-31.6	0	0	0	109.2	T931	P929-T931 PolarHBondContact O-N 2.86Å
930	V	58	Low	75.9	Confident	67 Å²	67	50.4 Å²	50.4	41%	0.406	30%	0.299	S	S	.	.			trans	-60.8	109.3	-179.4	177.6	0	0	0	0	109.2	S928 T932 S935 E940	S928-V930 PolarHBondContact O-N 3.43Å; V930-T932 VanDerWaalsContact CG1-O 3.27Å; V930-T932 WeakPolarHBondContact CG1-O 2.96Å; V930-S935 WeakPolarHBondContact CG1-O 3.28Å; V930-E940 VanDerWaalsContact CG2-OE1 3.31Å; V930-E940 WeakPolarHBondContact CG2-OE1 3.42Å; V930-E940 WeakPolarHBondContact CG2-OE2 3.48Å
931	T	54.1	Low	75.7	Confident	129 Å²	129	49.5 Å²	49.5	79%	0.791	30%	0.299	S	S	*	.			trans	-91.3	-16.5	178.5	50.4	0	0	0	0	113.2	P929	P929-T931 PolarHBondContact O-N 2.86Å
932	T	54.1	Low	75.7	Confident	81 Å²	81	48.3 Å²	48.3	50%	0.497	29%	0.293	S	S	.	.	S	Bend	trans	-132.6	131.4	-171.6	32	0	0	0	0	110.9	V930 G934 S935	V930-T932 VanDerWaalsContact CG1-O 3.27Å; V930-T932 WeakPolarHBondContact CG1-O 2.96Å; T932-G934 PolarHBondContact O-N 3.29Å; T932-G934 VanDerWaalsContact O-N 3.16Å; T932-S935 PolarHBondContact O-N 2.74Å; T932-S935 PolarHBondContact O-OG 3.37Å; T932-S935 VanDerWaalsContact O-OG 3.08Å; T932-S935 PolarHBondContact OG1-OG 3.11Å
933	E	49.4	Very low	75.6	Confident	209 Å²	209	48.3 Å²	48.3	98%	0.977	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	119.6	174	-75.4	-176.6	159.9	0	0	109.8
934	G	56.2	Low	75.4	Confident	79 Å²	79	51.2 Å²	51.2	81%	0.814	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	101	-13.5	176.9	0	0	0	0	0	116.3	T932	T932-G934 PolarHBondContact O-N 3.29Å; T932-G934 VanDerWaalsContact O-N 3.16Å
935	S	60.9	Low	75.3	Confident	53 Å²	53	48.3 Å²	48.3	37%	0.371	30%	0.295	S	S	.	.			trans	-90.4	107.4	174.3	62.8	0	0	0	0	110.8	V930 T932	V930-S935 WeakPolarHBondContact CG1-O 3.28Å; T932-S935 PolarHBondContact O-N 2.74Å; T932-S935 PolarHBondContact O-OG 3.37Å; T932-S935 VanDerWaalsContact O-OG 3.08Å; T932-S935 PolarHBondContact OG1-OG 3.11Å
936	V	70.3	Confident	75.3	Confident	74 Å²	74	48.2 Å²	48.2	45%	0.448	29%	0.294	S	S	.	.			trans	-83.7	129.8	173.5	-172.5	0	0	0	0	108.7	E940 N941	V936-E940 HydrophobicContact CG1-CB 3.44Å; V936-E940 VanDerWaalsContact CG1-CB 3.44Å; V936-N941 WeakPolarHBondContact CG1-OD1 3.35Å
937	S	80.7	Confident	75.2	Confident	8 Å²	8	48.2 Å²	48.2	6%	0.056	29%	0.294	C	S	.	.			trans	-68.1	156.6	176.9	66.1	0	0	0	0	111.4	S928 F939 E940 N941	S928-S937 WeakPolarHBondContact OG-CB 3.26Å; S937-F939 PolarHBondContact O-N 3.33Å; S937-E940 PolarHBondContact N-OE2 2.55Å; S937-E940 PolarHBondContact O-N 2.93Å; S937-E940 VanDerWaalsContact O-N 3.08Å; S937-E940 WeakPolarHBondContact OG-CB 3.33Å; S937-E940 VanDerWaalsContact OG-CD 3.23Å; S937-E940 WeakPolarHBondContact OG-CG 3.41Å; S937-E940 PolarHBondContact OG-N 3.5Å; S937-E940 PolarHBondContact OG-OE2 2.96Å; S937-N941 PolarHBondContact O-N 3.42Å
938	S	85.8	Confident	75.1	Confident	18 Å²	18	47.3 Å²	47.3	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-57.7	-36.8	177.9	-53.7	0	0	0	0	112.3	G870 N941 L942	G870-S938 WeakPolarHBondContact CA-OG 3.32Å; S938-N941 PolarHBondContact O-N 3.42Å; S938-L942 WeakPolarHBondContact O-CG 3.37Å; S938-L942 PolarHBondContact O-N 2.95Å; S938-L942 VanDerWaalsContact O-N 3.09Å
939	F	88.1	Confident	75.4	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-47.4	174	-178.7	-94.6	0	0	0	112.2	V919 L926 Y927 S937 N941 L942 V943 I989 L992 I1000 I1003	V919-F939 HydrophobicContact CG1-CE2 4.13Å; V919-F939 HydrophobicContact CG2-CD2 4.41Å; V919-F939 HydrophobicContact CG2-CE2 4.26Å; L926-F939 HydrophobicContact CB-CB 4.1Å; Y927-F939 HydrophobicContact CD2-CB 4.27Å; Y927-F939 AromaticContact CD2-CD1 3.66Å; Y927-F939 HydrophobicContact CD2-CD1 3.66Å; Y927-F939 HydrophobicContact CD2-CE1 4.29Å; Y927-F939 HydrophobicContact CD2-CG 4.1Å; Y927-F939 HydrophobicContact CE2-CD1 4.38Å; S937-F939 PolarHBondContact O-N 3.33Å; F939-N941 VanDerWaalsContact C-N 3.3Å; F939-N941 PolarHBondContact O-N 3.24Å; F939-L942 WeakPolarHBondContact O-CB 3.15Å; F939-L942 PolarHBondContact O-N 3.13Å; F939-L942 VanDerWaalsContact O-N 3.16Å; F939-V943 HydrophobicContact CD1-CG2 3.99Å; F939-V943 HydrophobicContact CE1-CG2 3.59Å; F939-V943 HydrophobicContact CZ-CG2 3.96Å; F939-V943 WeakPolarHBondContact O-CG2 3.43Å; F939-V943 PolarHBondContact O-N 3.25Å; F939-I989 HydrophobicContact CZ-CG1 4.08Å; F939-L992 HydrophobicContact CE1-CD1 3.93Å; F939-L992 HydrophobicContact CE2-CD1 3.97Å; F939-L992 HydrophobicContact CZ-CD1 3.61Å; F939-I1000 HydrophobicContact CE1-CD1 4.22Å; F939-I1003 HydrophobicContact CE1-CD1 4.33Å
940	E	84.4	Confident	76	Confident	16 Å²	16	46.2 Å²	46.2	8%	0.075	27%	0.269	C	S	.	.	H	α-helix	trans	-64.8	-35.1	178.2	-70.3	169.2	155.5	0	0	112.1	V930 V936 S937 V943 N944 Y999	V930-E940 VanDerWaalsContact CG2-OE1 3.31Å; V930-E940 WeakPolarHBondContact CG2-OE1 3.42Å; V930-E940 WeakPolarHBondContact CG2-OE2 3.48Å; V936-E940 HydrophobicContact CG1-CB 3.44Å; V936-E940 VanDerWaalsContact CG1-CB 3.44Å; S937-E940 PolarHBondContact N-OE2 2.55Å; S937-E940 PolarHBondContact O-N 2.93Å; S937-E940 VanDerWaalsContact O-N 3.08Å; S937-E940 WeakPolarHBondContact OG-CB 3.33Å; S937-E940 VanDerWaalsContact OG-CD 3.23Å; S937-E940 WeakPolarHBondContact OG-CG 3.41Å; S937-E940 PolarHBondContact OG-N 3.5Å; S937-E940 PolarHBondContact OG-OE2 2.96Å; E940-V943 PolarHBondContact O-N 2.92Å; E940-N944 WeakPolarHBondContact O-CB 3.2Å; E940-N944 PolarHBondContact O-N 2.96Å; E940-N944 PolarHBondContact O-ND2 3.2Å; E940-Y999 HydrophobicContact CG-CE1 3.81Å; E940-Y999 WeakPolarHBondContact CG-OH 3.4Å; E940-Y999 WeakPolarHBondContact OE1-CE1 3.38Å
941	N	86	Confident	77.1	Confident	43 Å²	43	44 Å²	44	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-59.9	-47.3	171.6	-84.5	-21.5	0	0	0	110.9	V936 S937 S938 F939 V943 N944 H945	V936-N941 WeakPolarHBondContact CG1-OD1 3.35Å; S937-N941 PolarHBondContact O-N 3.42Å; S938-N941 PolarHBondContact O-N 3.42Å; F939-N941 VanDerWaalsContact C-N 3.3Å; F939-N941 PolarHBondContact O-N 3.24Å; N941-V943 VanDerWaalsContact C-N 3.31Å; N941-V943 PolarHBondContact O-N 3.08Å; N941-N944 PolarHBondContact O-N 3.26Å; N941-H945 WeakPolarHBondContact O-CB 3.45Å; N941-H945 PolarHBondContact O-N 2.82Å; N941-H945 VanDerWaalsContact O-N 3.09Å; N941-H945 PolarHBondContact O-ND1 3.43Å
942	L	89.9	Confident	78.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-44.7	174.7	-68.3	171.4	0	0	0	110.9	A915 L918 V919 L926 S938 F939 N944 H945 F946 F947	A915-L942 HydrophobicContact CB-CD2 4.24Å; L918-L942 HydrophobicContact CB-CD1 4.47Å; V919-L942 HydrophobicContact CG2-CB 4.48Å; V919-L942 HydrophobicContact CG2-CD1 3.88Å; L926-L942 HydrophobicContact CD1-CD1 4.03Å; S938-L942 WeakPolarHBondContact O-CG 3.37Å; S938-L942 PolarHBondContact O-N 2.95Å; S938-L942 VanDerWaalsContact O-N 3.09Å; F939-L942 WeakPolarHBondContact O-CB 3.15Å; F939-L942 PolarHBondContact O-N 3.13Å; F939-L942 VanDerWaalsContact O-N 3.16Å; L942-N944 PolarHBondContact O-N 2.81Å; L942-H945 PolarHBondContact O-N 3.4Å; L942-F946 HydrophobicContact CD2-CD2 4.22Å; L942-F946 HydrophobicContact CD2-CE2 4.32Å; L942-F946 PolarHBondContact O-N 2.92Å; L942-F947 HydrophobicContact CB-CE2 4.11Å; L942-F947 VanDerWaalsContact O-CD2 3.29Å; L942-F947 WeakPolarHBondContact O-CD2 3.29Å
943	V	87.7	Confident	79.3	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	21%	0.208	C	C	.	.	I	π-helix	trans	-56.5	-51.8	177	171.8	0	0	0	0	111.3	F939 E940 N941 H945 F947 L948 I1003	F939-V943 HydrophobicContact CD1-CG2 3.99Å; F939-V943 HydrophobicContact CE1-CG2 3.59Å; F939-V943 HydrophobicContact CZ-CG2 3.96Å; F939-V943 WeakPolarHBondContact O-CG2 3.43Å; F939-V943 PolarHBondContact O-N 3.25Å; E940-V943 PolarHBondContact O-N 2.92Å; N941-V943 VanDerWaalsContact C-N 3.31Å; N941-V943 PolarHBondContact O-N 3.08Å; V943-H945 PolarHBondContact O-N 2.91Å; V943-F947 VanDerWaalsContact CA-CD2 3.48Å; V943-F947 HydrophobicContact CB-CB 4.34Å; V943-F947 HydrophobicContact CB-CD2 4.44Å; V943-F947 HydrophobicContact CB-CG 4.4Å; V943-F947 HydrophobicContact CG1-CB 4.14Å; V943-F947 HydrophobicContact CG2-CB 4.48Å; V943-F947 HydrophobicContact CG2-CD1 4.36Å; V943-F947 HydrophobicContact CG2-CD2 4.26Å; V943-F947 HydrophobicContact CG2-CG 4.13Å; V943-F947 WeakPolarHBondContact O-CA 2.9Å; V943-F947 WeakPolarHBondContact O-CB 3.33Å; V943-F947 PolarHBondContact O-N 2.84Å; V943-L948 HydrophobicContact CG1-CB 4.23Å; V943-L948 HydrophobicContact CG1-CD1 4.19Å; V943-L948 PolarHBondContact O-N 3.35Å; V943-I1003 HydrophobicContact CG1-CD1 4.34Å; V943-I1003 HydrophobicContact CG1-CG1 4.49Å; V943-I1003 HydrophobicContact CG2-CD1 4.45Å
944	N	85.6	Confident	80.3	Confident	61 Å²	61	31.8 Å²	31.8	33%	0.326	18%	0.18	S	C	.	.	I	π-helix	trans	-68.1	-20.2	-177.2	-66.8	-25.6	0	0	0	113.7	E940 N941 L942 P949	E940-N944 WeakPolarHBondContact O-CB 3.2Å; E940-N944 PolarHBondContact O-N 2.96Å; E940-N944 PolarHBondContact O-ND2 3.2Å; N941-N944 PolarHBondContact O-N 3.26Å; L942-N944 PolarHBondContact O-N 2.81Å; N944-P949 VanDerWaalsContact O-CA 3.3Å; N944-P949 WeakPolarHBondContact O-CA 3.4Å
945	H	86.2	Confident	80.6	Confident	20 Å²	20	28.7 Å²	28.7	9%	0.093	15%	0.145	C	C	.	.	I	π-helix	trans	-102.5	-28.7	-176	-71.9	76.9	0	0	0	114	C877 S881 S883 N941 L942 V943	C877-H945 HydrophobicContact CB-CB 4.16Å; S881-H945 WeakPolarHBondContact OG-CB 3.45Å; S881-H945 PolarHBondContact OG-CD2 3.46Å; S881-H945 VanDerWaalsContact OG-CD2 3.26Å; S881-H945 PolarHBondContact OG-O 3.13Å; S881-H945 VanDerWaalsContact OG-O 3.13Å; S883-H945 PolarHBondContact OG-CD2 2.97Å; S883-H945 VanDerWaalsContact OG-CD2 3.31Å; N941-H945 WeakPolarHBondContact O-CB 3.45Å; N941-H945 PolarHBondContact O-N 2.82Å; N941-H945 VanDerWaalsContact O-N 3.09Å; N941-H945 PolarHBondContact O-ND1 3.43Å; L942-H945 PolarHBondContact O-N 3.4Å; V943-H945 PolarHBondContact O-N 2.91Å
946	F	87.2	Confident	80.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.142	C	C	.	.	I	π-helix	trans	-125.3	-33.5	-173.9	-65.5	-84.8	0	0	0	114.1	I876 C880 Y912 A915 L942 F985	I876-F946 HydrophobicContact CG2-CE2 3.79Å; I876-F946 HydrophobicContact CG2-CZ 3.54Å; C880-F946 HydrophobicContact CB-CE1 4.32Å; C880-F946 HydrophobicContact CB-CZ 4.07Å; Y912-F946 HydrophobicContact CD1-CB 4.38Å; Y912-F946 AromaticContact CD1-CD1 3.83Å; Y912-F946 HydrophobicContact CD1-CD1 3.83Å; Y912-F946 HydrophobicContact CD2-CD1 4.15Å; Y912-F946 HydrophobicContact CD2-CE1 4.4Å; Y912-F946 HydrophobicContact CE1-CB 3.91Å; Y912-F946 AromaticContact CE1-CD1 3.64Å; Y912-F946 HydrophobicContact CE1-CD1 3.64Å; Y912-F946 HydrophobicContact CE1-CG 4.28Å; Y912-F946 WeakPolarHBondContact CE1-O 3.37Å; Y912-F946 AromaticContact CE2-CD1 3.99Å; Y912-F946 HydrophobicContact CE2-CD1 3.99Å; Y912-F946 HydrophobicContact CE2-CE1 4.35Å; Y912-F946 HydrophobicContact CG-CD1 4.04Å; Y912-F946 AromaticContact CZ-CD1 3.7Å; A915-F946 HydrophobicContact CB-CB 4.42Å; A915-F946 HydrophobicContact CB-CD1 4.24Å; A915-F946 HydrophobicContact CB-CD2 4Å; A915-F946 HydrophobicContact CB-CE2 4.36Å; A915-F946 HydrophobicContact CB-CG 3.96Å; L942-F946 HydrophobicContact CD2-CD2 4.22Å; L942-F946 HydrophobicContact CD2-CE2 4.32Å; L942-F946 PolarHBondContact O-N 2.92Å; F946-F985 HydrophobicContact CB-CZ 4.22Å
947	F	84.2	Confident	79.7	Confident	1 Å²	1	30.4 Å²	30.4	0%	0.004	15%	0.145	C	C	.	.	I	π-helix	trans	-92.7	-51.9	-171.5	-62.8	-124.5	0	0	0	110.7	V919 L942 V943 P949 F985 I989 H1011	V919-F947 HydrophobicContact CB-CE1 4.44Å; V919-F947 HydrophobicContact CB-CZ 3.68Å; V919-F947 HydrophobicContact CG1-CE1 3.86Å; V919-F947 HydrophobicContact CG1-CZ 3.59Å; V919-F947 HydrophobicContact CG2-CE1 4.3Å; V919-F947 HydrophobicContact CG2-CE2 3.8Å; V919-F947 HydrophobicContact CG2-CZ 3.28Å; L942-F947 HydrophobicContact CB-CE2 4.11Å; L942-F947 VanDerWaalsContact O-CD2 3.29Å; L942-F947 WeakPolarHBondContact O-CD2 3.29Å; V943-F947 VanDerWaalsContact CA-CD2 3.48Å; V943-F947 HydrophobicContact CB-CB 4.34Å; V943-F947 HydrophobicContact CB-CD2 4.44Å; V943-F947 HydrophobicContact CB-CG 4.4Å; V943-F947 HydrophobicContact CG1-CB 4.14Å; V943-F947 HydrophobicContact CG2-CB 4.48Å; V943-F947 HydrophobicContact CG2-CD1 4.36Å; V943-F947 HydrophobicContact CG2-CD2 4.26Å; V943-F947 HydrophobicContact CG2-CG 4.13Å; V943-F947 WeakPolarHBondContact O-CA 2.9Å; V943-F947 WeakPolarHBondContact O-CB 3.33Å; V943-F947 PolarHBondContact O-N 2.84Å; F947-P949 VanDerWaalsContact C-CD 3.42Å; F947-F985 HydrophobicContact CD1-CB 3.77Å; F947-F985 HydrophobicContact CD1-CD1 4.23Å; F947-F985 AromaticContact CD1-CD2 3.91Å; F947-F985 HydrophobicContact CD1-CD2 3.91Å; F947-F985 AromaticContact CD1-CG 3.72Å; F947-F985 HydrophobicContact CD1-CG 3.72Å; F947-F985 HydrophobicContact CD2-CD1 4.49Å; F947-F985 HydrophobicContact CD2-CE1 4.34Å; F947-F985 HydrophobicContact CD2-CE2 4.43Å; F947-F985 HydrophobicContact CD2-CZ 4.34Å; F947-F985 HydrophobicContact CE1-CB 3.22Å; F947-F985 AromaticContact CE1-CD1 3.4Å; F947-F985 HydrophobicContact CE1-CD1 3.4Å; F947-F985 VanDerWaalsContact CE1-CD1 3.4Å; F947-F985 AromaticContact CE1-CD2 3.88Å; F947-F985 HydrophobicContact CE1-CD2 3.88Å; F947-F985 HydrophobicContact CE1-CE1 4.15Å; F947-F985 AromaticContact CE1-CG 3.21Å; F947-F985 HydrophobicContact CE1-CG 3.21Å; F947-F985 AromaticContact CE2-CD1 3.69Å; F947-F985 HydrophobicContact CE2-CD1 3.69Å; F947-F985 HydrophobicContact CE2-CD2 4.46Å; F947-F985 AromaticContact CE2-CE1 3.58Å; F947-F985 HydrophobicContact CE2-CE1 3.58Å; F947-F985 HydrophobicContact CE2-CE2 4.42Å; F947-F985 HydrophobicContact CE2-CG 4.13Å; F947-F985 AromaticContact CE2-CZ 3.99Å; F947-F985 HydrophobicContact CE2-CZ 3.99Å; F947-F985 HydrophobicContact CG-CD2 4.22Å; F947-F985 HydrophobicContact CG-CE2 4.47Å; F947-F985 HydrophobicContact CG-CG 4.35Å; F947-F985 HydrophobicContact CZ-CB 3.87Å; F947-F985 AromaticContact CZ-CD1 3.01Å; F947-F985 HydrophobicContact CZ-CD1 3.01Å; F947-F985 HydrophobicContact CZ-CD2 4.1Å; F947-F985 AromaticContact CZ-CE1 3.42Å; F947-F985 HydrophobicContact CZ-CE1 3.42Å; F947-F985 VanDerWaalsContact CZ-CE1 3.42Å; F947-F985 HydrophobicContact CZ-CE2 4.45Å; F947-F985 AromaticContact CZ-CG 3.39Å; F947-F985 HydrophobicContact CZ-CG 3.39Å; F947-F985 HydrophobicContact CZ-CZ 4.15Å; F947-I989 HydrophobicContact CD1-CD1 4.28Å; F947-I989 HydrophobicContact CE1-CD1 4.26Å; F947-H1011 PolarHBondContact O-CE1 3.02Å
948	L	84.7	Confident	78.1	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.021	17%	0.174	C	C	.	.	S	Bend	trans	-134.9	58.8	-173	-72.4	172.7	0	0	0	109.7	V943 Y953 I1003 D1006 I1007 I1010	V943-L948 HydrophobicContact CG1-CB 4.23Å; V943-L948 HydrophobicContact CG1-CD1 4.19Å; V943-L948 PolarHBondContact O-N 3.35Å; L948-Y953 HydrophobicContact CB-CE2 3.99Å; L948-I1003 HydrophobicContact CD1-CG2 4.06Å; L948-D1006 HydrophobicContact CD1-CB 3.99Å; L948-D1006 HydrophobicContact CD2-CB 4.36Å; L948-I1007 HydrophobicContact CD1-CG1 3.91Å; L948-I1007 HydrophobicContact CD2-CG1 3.97Å; L948-I1007 HydrophobicContact CG-CG1 3.9Å; L948-I1010 HydrophobicContact CD2-CB 4.49Å; L948-I1010 HydrophobicContact CD2-CD1 3.96Å
949	P	83.3	Confident	76.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.			trans	-59.7	142.7	176.5	23.8	-31.6	0	0	0	111.3	N944 F947 Q951 L952 F970 M978	N944-P949 VanDerWaalsContact O-CA 3.3Å; N944-P949 WeakPolarHBondContact O-CA 3.4Å; F947-P949 VanDerWaalsContact C-CD 3.42Å; P949-Q951 PolarHBondContact O-N 2.95Å; P949-L952 HydrophobicContact CG-CD1 3.98Å; P949-L952 HydrophobicContact CG-CG 4.07Å; P949-L952 WeakPolarHBondContact O-CB 3.24Å; P949-L952 PolarHBondContact O-N 3.38Å; P949-F970 HydrophobicContact CB-CZ 4.24Å; P949-F970 HydrophobicContact CG-CE2 4.18Å; P949-F970 HydrophobicContact CG-CZ 3.91Å; P949-M978 HydrophobicContact CG-CE 3.59Å
950	R	79.8	Confident	74.2	Confident	106 Å²	106	48.9 Å²	48.9	40%	0.4	24%	0.242	S	C	.	.	H	α-helix	trans	-50.5	-34.5	-173.7	178.5	175.8	165.9	-157.4	-13	113.3	V885 E888 L952 Y953 E954	V885-R950 HydrophobicContact CG2-CB 4.38Å; E888-R950 IonicContact OE1-CZ 2.77Å; E888-R950 IonicContact OE1-NH1 2.74Å; E888-R950 PolarHBondContact OE1-NH1 2.98Å; E888-R950 IonicContact OE1-NH2 2.9Å; E888-R950 IonicContact OE2-NH1 3.5Å; E888-R950 PolarHBondContact OE2-NH1 3.31Å; R950-L952 PolarHBondContact O-N 3.34Å; R950-Y953 WeakPolarHBondContact O-CB 3.49Å; R950-Y953 PolarHBondContact O-N 2.98Å; R950-E954 HydrophobicContact CG-CG 4.26Å; R950-E954 IonicContact CZ-OE1 3.65Å; R950-E954 IonicContact NE-OE1 3.47Å; R950-E954 PolarHBondContact NE-OE1 2.88Å; R950-E954 IonicContact NH2-OE1 3.81Å; R950-E954 PolarHBondContact NH2-OE1 3.04Å; R950-E954 PolarHBondContact O-N 3.13Å; R950-E954 VanDerWaalsContact O-N 3.11Å
951	Q	80.2	Confident	71.8	Confident	20 Å²	20	51.6 Å²	51.6	9%	0.093	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-30.1	177.9	-58.2	103.3	-56.8	0	0	113.8	V882 S883 P949 Y953 E954 T955 I969 F970	V882-Q951 PolarHBondContact O-NE2 3.27Å; S883-Q951 VanDerWaalsContact C-NE2 3.3Å; P949-Q951 PolarHBondContact O-N 2.95Å; Q951-Y953 PolarHBondContact O-N 3.36Å; Q951-E954 PolarHBondContact O-N 2.96Å; Q951-T955 WeakPolarHBondContact O-CG2 3.43Å; Q951-T955 PolarHBondContact O-N 2.82Å; Q951-T955 PolarHBondContact O-OG1 3.1Å; Q951-T955 VanDerWaalsContact O-OG1 3.08Å; Q951-I969 HydrophobicContact CB-CG2 4.19Å; Q951-F970 HydrophobicContact CB-CE2 4.33Å; Q951-F970 HydrophobicContact CB-CZ 3.93Å; Q951-F970 HydrophobicContact CG-CZ 4.31Å
952	L	77.1	Confident	69.8	Low	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-69.4	-24.3	175.9	-64.6	-180	0	0	0	112.7	P949 R950 T955 F970 I1010 H1014	P949-L952 HydrophobicContact CG-CD1 3.98Å; P949-L952 HydrophobicContact CG-CG 4.07Å; P949-L952 WeakPolarHBondContact O-CB 3.24Å; P949-L952 PolarHBondContact O-N 3.38Å; R950-L952 PolarHBondContact O-N 3.34Å; L952-T955 PolarHBondContact O-OG1 2.79Å; L952-F970 HydrophobicContact CD2-CD2 4.34Å; L952-F970 HydrophobicContact CD2-CE2 3.87Å; L952-F970 HydrophobicContact CG-CE2 4.14Å; L952-I1010 HydrophobicContact CB-CG2 3.57Å; L952-I1010 HydrophobicContact CD1-CG2 3.89Å; L952-I1010 HydrophobicContact CG-CG2 4.23Å; L952-H1014 PolarHBondContact O-NE2 3.36Å
953	Y	77.5	Confident	67.5	Low	79 Å²	79	61.1 Å²	61.1	31%	0.31	32%	0.318	S	S	.	.	H	α-helix	trans	-83.4	-42.4	173.8	-69.7	-86.6	0	0	0	111.9	L948 R950 Q951 T955 Q956 D1006 I1010	L948-Y953 HydrophobicContact CB-CE2 3.99Å; R950-Y953 WeakPolarHBondContact O-CB 3.49Å; R950-Y953 PolarHBondContact O-N 2.98Å; Q951-Y953 PolarHBondContact O-N 3.36Å; Y953-T955 PolarHBondContact O-N 3.08Å; Y953-T955 VanDerWaalsContact O-N 3.1Å; Y953-Q956 WeakPolarHBondContact O-CB 3.31Å; Y953-Q956 PolarHBondContact O-N 3.3Å; Y953-D1006 HydrophobicContact CE1-CB 4.47Å; Y953-D1006 WeakPolarHBondContact OH-CB 3.39Å; Y953-D1006 PolarHBondContact OH-OD2 2.65Å; Y953-I1010 HydrophobicContact CD1-CD1 3.65Å; Y953-I1010 HydrophobicContact CD2-CD1 4.32Å; Y953-I1010 HydrophobicContact CE1-CD1 3.35Å; Y953-I1010 HydrophobicContact CE2-CD1 4.08Å; Y953-I1010 HydrophobicContact CG-CD1 4.15Å
954	E	70.2	Confident	65.1	Low	83 Å²	83	66 Å²	66	39%	0.388	34%	0.344	S	S	.	.	H	α-helix	trans	-60.6	-23.4	-179.6	-68.5	178.8	163.6	0	0	112.4	R950 Q951 Q956	R950-E954 HydrophobicContact CG-CG 4.26Å; R950-E954 IonicContact CZ-OE1 3.65Å; R950-E954 IonicContact NE-OE1 3.47Å; R950-E954 PolarHBondContact NE-OE1 2.88Å; R950-E954 IonicContact NH2-OE1 3.81Å; R950-E954 PolarHBondContact NH2-OE1 3.04Å; R950-E954 PolarHBondContact O-N 3.13Å; R950-E954 VanDerWaalsContact O-N 3.11Å; Q951-E954 PolarHBondContact O-N 2.96Å; E954-Q956 VanDerWaalsContact C-N 3.29Å; E954-Q956 PolarHBondContact O-N 3.02Å
955	T	63.7	Low	63.2	Low	14 Å²	14	68.6 Å²	68.6	9%	0.086	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	1.8	175.6	52.7	0	0	0	0	114.5	Q951 L952 Y953 F961 I969 K1013 H1014	Q951-T955 WeakPolarHBondContact O-CG2 3.43Å; Q951-T955 PolarHBondContact O-N 2.82Å; Q951-T955 PolarHBondContact O-OG1 3.1Å; Q951-T955 VanDerWaalsContact O-OG1 3.08Å; L952-T955 PolarHBondContact O-OG1 2.79Å; Y953-T955 PolarHBondContact O-N 3.08Å; Y953-T955 VanDerWaalsContact O-N 3.1Å; T955-F961 HydrophobicContact CG2-CE1 4.41Å; T955-F961 HydrophobicContact CG2-CZ 3.73Å; T955-I969 HydrophobicContact CG2-CD1 3.36Å; T955-I969 HydrophobicContact CG2-CG1 3.77Å; T955-I969 HydrophobicContact CG2-CG2 4.25Å; T955-K1013 PolarHBondContact O-NZ 2.9Å; T955-H1014 PolarHBondContact OG1-CE1 3.43Å; T955-H1014 PolarHBondContact OG1-NE2 3.4Å
956	Q	59.3	Low	61.1	Low	67 Å²	67	75.5 Å²	75.5	31%	0.313	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-25	169.1	-67.1	-163.9	11.3	0	0	112.9	Y953 E954 S958	Y953-Q956 WeakPolarHBondContact O-CB 3.31Å; Y953-Q956 PolarHBondContact O-N 3.3Å; E954-Q956 VanDerWaalsContact C-N 3.29Å; E954-Q956 PolarHBondContact O-N 3.02Å; Q956-S958 PolarHBondContact O-N 3.22Å
957	D	52.7	Low	59.1	Low	96 Å²	96	80 Å²	80	51%	0.513	42%	0.421	S	S	.	.			trans	-74.7	85.7	-177.5	-79.2	-14.5	0	0	0	111.3	N959 K960 F961	D957-N959 PolarHBondContact O-N 3.11Å; D957-K960 PolarHBondContact O-N 3.47Å; D957-K960 VanDerWaalsContact O-N 3.11Å; D957-F961 VanDerWaalsContact O-CD2 3.23Å; D957-F961 WeakPolarHBondContact O-CD2 3.46Å
958	S	46.4	Very low	57.7	Low	95 Å²	95	84.2 Å²	84.2	66%	0.664	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-49.1	-25.2	177.1	56.4	0	0	0	0	114.2	Q956 K960	Q956-S958 PolarHBondContact O-N 3.22Å; S958-K960 VanDerWaalsContact C-N 3.32Å; S958-K960 PolarHBondContact O-N 2.93Å
959	N	46.5	Very low	56.6	Low	159 Å²	159	86.4 Å²	86.4	85%	0.85	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-79.1	-5.6	-176	-68.5	-9.3	0	0	0	114.9	D957	D957-N959 PolarHBondContact O-N 3.11Å
960	K	44.9	Very low	56	Low	159 Å²	159	87.1 Å²	87.1	69%	0.691	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-102.4	-2.5	175.8	-79.1	-179.1	177.4	171.9	0	114.5	D957 S958 S962	D957-K960 PolarHBondContact O-N 3.47Å; D957-K960 VanDerWaalsContact O-N 3.11Å; S958-K960 VanDerWaalsContact C-N 3.32Å; S958-K960 PolarHBondContact O-N 2.93Å; K960-S962 PolarHBondContact O-N 3.1Å
961	F	34.9	Very low	55.6	Low	73 Å²	73	85.3 Å²	85.3	32%	0.32	46%	0.46	S	S	.	.			trans	-103.7	62.8	-167.1	-76.3	-84	0	0	0	115.2	T955 D957 L964	T955-F961 HydrophobicContact CG2-CE1 4.41Å; T955-F961 HydrophobicContact CG2-CZ 3.73Å; D957-F961 VanDerWaalsContact O-CD2 3.23Å; D957-F961 WeakPolarHBondContact O-CD2 3.46Å; F961-L964 HydrophobicContact CD1-CB 4.35Å; F961-L964 HydrophobicContact CE1-CB 4.39Å
962	S	44.1	Very low	55.3	Low	119 Å²	119	89 Å²	89	83%	0.832	49%	0.488	S	S	*	.	S	Bend	trans	-106.4	-1	161.9	59.3	0	0	0	0	114.3	K960	K960-S962 PolarHBondContact O-N 3.1Å
963	T	42.1	Very low	55.3	Low	124 Å²	124	91.4 Å²	91.4	76%	0.761	50%	0.498	S	S	*	.	S	Bend	trans	-135.3	2.8	-174.6	51.3	0	0	0	0	116.9
964	L	37.2	Very low	55.6	Low	106 Å²	106	87.6 Å²	87.6	56%	0.555	48%	0.483	S	S	*	.	S	Bend	trans	-119.9	120.6	176	-85.3	143	0	0	0	109.3	F961 E966 D968	F961-L964 HydrophobicContact CD1-CB 4.35Å; F961-L964 HydrophobicContact CE1-CB 4.39Å; L964-E966 PolarHBondContact O-N 2.97Å; L964-D968 HydrophobicContact CD2-CB 4.31Å
965	N	45.1	Very low	56.1	Low	114 Å²	114	85.7 Å²	85.7	61%	0.61	48%	0.475	S	S	*	.			trans	-63.3	135.9	171.4	-69.4	-41.2	0	0	0	107.8	S967 D968	N965-S967 PolarHBondContact O-N 3.39Å; N965-D968 WeakPolarHBondContact CB-OD2 3.4Å; N965-D968 PolarHBondContact N-OD2 3.25Å; N965-D968 VanDerWaalsContact O-CB 3.31Å; N965-D968 WeakPolarHBondContact O-CB 3.45Å; N965-D968 PolarHBondContact O-N 3.33Å
966	E	42	Very low	57	Low	166 Å²	166	91.1 Å²	91.1	78%	0.776	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-56.9	-19	179.1	-72.3	-178.5	145.2	0	0	113.2	L964 D968	L964-E966 PolarHBondContact O-N 2.97Å; E966-D968 VanDerWaalsContact C-N 3.27Å; E966-D968 PolarHBondContact O-N 3.08Å
967	S	46.2	Very low	58.3	Low	94 Å²	94	88.5 Å²	88.5	66%	0.657	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-74.1	-5.9	172.6	56.3	0	0	0	0	115.2	N965	N965-S967 PolarHBondContact O-N 3.39Å
968	D	54.6	Low	59.9	Low	90 Å²	90	84 Å²	84	48%	0.481	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-98.9	-1.2	-169.3	-62.2	-16.6	0	0	0	114.1	L964 N965 E966	L964-D968 HydrophobicContact CD2-CB 4.31Å; N965-D968 WeakPolarHBondContact CB-OD2 3.4Å; N965-D968 PolarHBondContact N-OD2 3.25Å; N965-D968 VanDerWaalsContact O-CB 3.31Å; N965-D968 WeakPolarHBondContact O-CB 3.45Å; N965-D968 PolarHBondContact O-N 3.33Å; E966-D968 VanDerWaalsContact C-N 3.27Å; E966-D968 PolarHBondContact O-N 3.08Å
969	I	60.5	Low	61.7	Low	49 Å²	49	83.5 Å²	83.5	25%	0.251	45%	0.451	S	S	.	.	S	Bend	trans	-73.9	-49.7	-172.8	-58.3	155.6	0	0	0	111.7	Q951 T955	Q951-I969 HydrophobicContact CB-CG2 4.19Å; T955-I969 HydrophobicContact CG2-CD1 3.36Å; T955-I969 HydrophobicContact CG2-CG1 3.77Å; T955-I969 HydrophobicContact CG2-CG2 4.25Å
970	F	70	Confident	63.6	Low	15 Å²	15	82.5 Å²	82.5	7%	0.066	44%	0.441	C	S	.	.	S	Bend	trans	-133.9	143.2	175.2	-70.8	-60	0	0	0	109.5	V882 P949 Q951 L952 V974 M975 M978	V882-F970 HydrophobicContact CB-CD1 4.02Å; V882-F970 HydrophobicContact CB-CE1 3.74Å; V882-F970 HydrophobicContact CG2-CD1 3.86Å; V882-F970 HydrophobicContact CG2-CE1 3.41Å; V882-F970 VanDerWaalsContact CG2-CE1 3.41Å; V882-F970 HydrophobicContact CG2-CZ 4.06Å; P949-F970 HydrophobicContact CB-CZ 4.24Å; P949-F970 HydrophobicContact CG-CE2 4.18Å; P949-F970 HydrophobicContact CG-CZ 3.91Å; Q951-F970 HydrophobicContact CB-CE2 4.33Å; Q951-F970 HydrophobicContact CB-CZ 3.93Å; Q951-F970 HydrophobicContact CG-CZ 4.31Å; L952-F970 HydrophobicContact CD2-CD2 4.34Å; L952-F970 HydrophobicContact CD2-CE2 3.87Å; L952-F970 HydrophobicContact CG-CE2 4.14Å; F970-V974 HydrophobicContact CB-CB 4.03Å; F970-V974 HydrophobicContact CB-CG1 4.02Å; F970-V974 HydrophobicContact CD1-CG1 4.04Å; F970-V974 HydrophobicContact CG-CG1 4Å; F970-M975 HydrophobicContact CB-CG 4.07Å; F970-M975 HydrophobicContact CB-SD 4.08Å; F970-M975 HydrophobicContact CD2-SD 4Å; F970-M978 HydrophobicContact CD2-CE 4.24Å; F970-M978 HydrophobicContact CE2-CE 3.9Å; F970-M978 HydrophobicContact CZ-CE 4.15Å
971	P	71.6	Confident	65.8	Low	68 Å²	68	75.9 Å²	75.9	44%	0.442	41%	0.413	S	S	.	.			trans	-54.8	147.3	168.4	-24.1	32.5	0	0	0	112.2	F973 V974 M975	P971-F973 VanDerWaalsContact C-N 3.25Å; P971-F973 HydrophobicContact CB-CD1 3.51Å; P971-F973 HydrophobicContact CB-CE1 3.13Å; P971-F973 HydrophobicContact CB-CE2 4.46Å; P971-F973 HydrophobicContact CB-CG 4.33Å; P971-F973 HydrophobicContact CB-CZ 3.67Å; P971-F973 HydrophobicContact CG-CE1 3.76Å; P971-F973 HydrophobicContact CG-CZ 3.87Å; P971-F973 PolarHBondContact O-N 2.84Å; P971-F973 VanDerWaalsContact O-N 3.12Å; P971-V974 HydrophobicContact CB-CG2 4.21Å; P971-V974 HydrophobicContact CG-CG2 4.25Å; P971-V974 WeakPolarHBondContact O-CB 3.42Å; P971-V974 PolarHBondContact O-N 3.41Å; P971-M975 PolarHBondContact O-N 3.45Å
972	C	75.3	Confident	68.4	Low	99 Å²	99	72.6 Å²	72.6	67%	0.669	40%	0.398	S	S	*	.	H	α-helix	trans	-50.9	-41.4	-176.6	-62	0	0	0	0	113.7	V974 M975 E976	C972-V974 PolarHBondContact O-N 3.47Å; C972-M975 WeakPolarHBondContact O-CB 3.38Å; C972-M975 PolarHBondContact O-N 2.67Å; C972-M975 VanDerWaalsContact O-N 3.08Å; C972-E976 WeakPolarHBondContact O-CG 2.72Å; C972-E976 PolarHBondContact O-N 2.77Å
973	F	77.2	Confident	70.6	Confident	50 Å²	50	67.4 Å²	67.4	22%	0.219	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-29.9	-179.7	65.7	-99.2	0	0	0	113.5	E905 C908 P971 S977	E905-F973 HydrophobicContact CB-CD2 4.43Å; E905-F973 HydrophobicContact CB-CG 4.37Å; E905-F973 HydrophobicContact CG-CB 4.24Å; E905-F973 HydrophobicContact CG-CD1 3.56Å; E905-F973 HydrophobicContact CG-CD2 4.12Å; E905-F973 HydrophobicContact CG-CE1 3.81Å; E905-F973 HydrophobicContact CG-CE2 4.36Å; E905-F973 HydrophobicContact CG-CG 3.73Å; E905-F973 HydrophobicContact CG-CZ 4.23Å; C908-F973 HydrophobicContact CB-CD2 3.79Å; C908-F973 HydrophobicContact CB-CE2 3.69Å; P971-F973 VanDerWaalsContact C-N 3.25Å; P971-F973 HydrophobicContact CB-CD1 3.51Å; P971-F973 HydrophobicContact CB-CE1 3.13Å; P971-F973 HydrophobicContact CB-CE2 4.46Å; P971-F973 HydrophobicContact CB-CG 4.33Å; P971-F973 HydrophobicContact CB-CZ 3.67Å; P971-F973 HydrophobicContact CG-CE1 3.76Å; P971-F973 HydrophobicContact CG-CZ 3.87Å; P971-F973 PolarHBondContact O-N 2.84Å; P971-F973 VanDerWaalsContact O-N 3.12Å; F973-S977 WeakPolarHBondContact O-CB 3.29Å; F973-S977 PolarHBondContact O-N 2.9Å; F973-S977 PolarHBondContact O-OG 3.07Å
974	V	82.3	Confident	72.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-70.4	-44.6	175.7	178.9	0	0	0	0	109.7	V882 Y912 F970 P971 C972 E976 S977 M978	V882-V974 HydrophobicContact CB-CG1 4.35Å; V882-V974 HydrophobicContact CG1-CG1 4.05Å; V882-V974 HydrophobicContact CG1-CG2 3.78Å; V882-V974 HydrophobicContact CG2-CG1 3.69Å; Y912-V974 HydrophobicContact CE2-CG1 4.31Å; F970-V974 HydrophobicContact CB-CB 4.03Å; F970-V974 HydrophobicContact CB-CG1 4.02Å; F970-V974 HydrophobicContact CD1-CG1 4.04Å; F970-V974 HydrophobicContact CG-CG1 4Å; P971-V974 HydrophobicContact CB-CG2 4.21Å; P971-V974 HydrophobicContact CG-CG2 4.25Å; P971-V974 WeakPolarHBondContact O-CB 3.42Å; P971-V974 PolarHBondContact O-N 3.41Å; C972-V974 PolarHBondContact O-N 3.47Å; V974-E976 VanDerWaalsContact C-N 3.34Å; V974-S977 PolarHBondContact O-N 3.02Å; V974-M978 HydrophobicContact CG1-CE 3.89Å; V974-M978 HydrophobicContact CG1-SD 4.41Å; V974-M978 WeakPolarHBondContact O-CG 3.39Å; V974-M978 PolarHBondContact O-N 3.45Å
975	M	81.1	Confident	75.3	Confident	43 Å²	43	58.2 Å²	58.2	21%	0.212	31%	0.307	C	S	.	.	H	α-helix	trans	-65	-41.8	-179	-66.4	-66.4	-74.5	0	0	111.1	F970 P971 C972 M978 Q979 H1014 F1015	F970-M975 HydrophobicContact CB-CG 4.07Å; F970-M975 HydrophobicContact CB-SD 4.08Å; F970-M975 HydrophobicContact CD2-SD 4Å; P971-M975 PolarHBondContact O-N 3.45Å; C972-M975 WeakPolarHBondContact O-CB 3.38Å; C972-M975 PolarHBondContact O-N 2.67Å; C972-M975 VanDerWaalsContact O-N 3.08Å; M975-M978 PolarHBondContact O-N 3.26Å; M975-Q979 WeakPolarHBondContact O-CB 3.41Å; M975-Q979 PolarHBondContact O-N 3.48Å; M975-H1014 HydrophobicContact CE-CB 4.23Å; M975-F1015 HydrophobicContact CB-CD1 4.47Å; M975-F1015 HydrophobicContact CB-CE1 3.89Å; M975-F1015 HydrophobicContact CE-CD1 3.55Å; M975-F1015 HydrophobicContact CE-CE1 3.15Å; M975-F1015 HydrophobicContact CE-CE2 4.4Å; M975-F1015 HydrophobicContact CE-CG 4.31Å; M975-F1015 HydrophobicContact CE-CZ 3.6Å; M975-F1015 HydrophobicContact CG-CE1 4.29Å; M975-F1015 WeakPolarHBondContact O-CE1 3.2Å; M975-F1015 HydrophobicContact SD-CD1 4.39Å; M975-F1015 HydrophobicContact SD-CE1 3.44Å; M975-F1015 WeakPolarHBondContact SD-CE1 3.49Å; M975-F1015 HydrophobicContact SD-CZ 3.69Å
976	E	83.1	Confident	77.4	Confident	128 Å²	128	52.8 Å²	52.8	60%	0.598	28%	0.279	S	S	*	.	H	α-helix	trans	-60.3	-46.9	173.2	-71.6	173.3	179.2	0	0	111.4	C972 V974 M978 Q979 E980	C972-E976 WeakPolarHBondContact O-CG 2.72Å; C972-E976 PolarHBondContact O-N 2.77Å; V974-E976 VanDerWaalsContact C-N 3.34Å; E976-M978 PolarHBondContact O-N 3.21Å; E976-Q979 PolarHBondContact O-N 3.39Å; E976-E980 WeakPolarHBondContact O-CB 3.49Å; E976-E980 PolarHBondContact O-N 3.11Å
977	S	86	Confident	79.7	Confident	11 Å²	11	47.5 Å²	47.5	8%	0.077	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-41.6	179.2	-58.9	0	0	0	0	112.7	Y912 F973 V974 E980 Q981	Y912-S977 VanDerWaalsContact CD2-CB 3.48Å; F973-S977 WeakPolarHBondContact O-CB 3.29Å; F973-S977 PolarHBondContact O-N 2.9Å; F973-S977 PolarHBondContact O-OG 3.07Å; V974-S977 PolarHBondContact O-N 3.02Å; S977-E980 PolarHBondContact O-N 3.13Å; S977-Q981 WeakPolarHBondContact O-CG 3.4Å; S977-Q981 PolarHBondContact O-N 3.25Å; S977-Q981 VanDerWaalsContact O-N 3.15Å
978	M	87	Confident	81.8	Confident	1 Å²	1	43 Å²	43	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-46.3	174.1	-76.5	179.6	179.4	0	0	111.1	V882 Y912 P949 F970 V974 M975 E976 L982 F1015	V882-M978 HydrophobicContact CG2-CE 4.13Å; Y912-M978 HydrophobicContact CD1-CG 4.22Å; Y912-M978 HydrophobicContact CE1-CB 4.17Å; Y912-M978 HydrophobicContact CE1-CE 4.5Å; Y912-M978 HydrophobicContact CE1-CG 3.29Å; Y912-M978 HydrophobicContact CE2-CG 4.39Å; Y912-M978 VanDerWaalsContact CZ-CG 3.42Å; Y912-M978 WeakPolarHBondContact OH-CE 3.45Å; Y912-M978 WeakPolarHBondContact OH-CG 3.15Å; P949-M978 HydrophobicContact CG-CE 3.59Å; F970-M978 HydrophobicContact CD2-CE 4.24Å; F970-M978 HydrophobicContact CE2-CE 3.9Å; F970-M978 HydrophobicContact CZ-CE 4.15Å; V974-M978 HydrophobicContact CG1-CE 3.89Å; V974-M978 HydrophobicContact CG1-SD 4.41Å; V974-M978 WeakPolarHBondContact O-CG 3.39Å; V974-M978 PolarHBondContact O-N 3.45Å; M975-M978 PolarHBondContact O-N 3.26Å; E976-M978 PolarHBondContact O-N 3.21Å; M978-L982 WeakPolarHBondContact O-CB 3.31Å; M978-L982 PolarHBondContact O-N 3.01Å; M978-L982 VanDerWaalsContact O-N 3.11Å; M978-F1015 HydrophobicContact CB-CE1 3.92Å; M978-F1015 HydrophobicContact CB-CZ 3.73Å; M978-F1015 HydrophobicContact CG-CZ 4.29Å; M978-F1015 HydrophobicContact SD-CE1 4.31Å; M978-F1015 HydrophobicContact SD-CE2 4.45Å; M978-F1015 HydrophobicContact SD-CZ 3.54Å; M978-F1015 VanDerWaalsContact SD-CZ 3.54Å
979	Q	85	Confident	83.5	Confident	86 Å²	86	38.9 Å²	38.9	40%	0.402	20%	0.198	S	C	.	.	H	α-helix	trans	-66.2	-40.1	-179.7	-177.9	176.3	-1.9	0	0	112.2	M975 E976 F1015 A1019	M975-Q979 WeakPolarHBondContact O-CB 3.41Å; M975-Q979 PolarHBondContact O-N 3.48Å; E976-Q979 PolarHBondContact O-N 3.39Å; Q979-F1015 HydrophobicContact CB-CD1 4.23Å; Q979-A1019 HydrophobicContact CG-CB 4.08Å
980	E	86.4	Confident	84.9	Confident	137 Å²	137	37.1 Å²	37.1	64%	0.64	19%	0.191	S	C	*	.	H	α-helix	trans	-65.3	-41.1	180	-172.1	-178.7	177.9	0	0	112.1	E976 S977 P983	E976-E980 WeakPolarHBondContact O-CB 3.49Å; E976-E980 PolarHBondContact O-N 3.11Å; S977-E980 PolarHBondContact O-N 3.13Å; E980-P983 VanDerWaalsContact O-CD 3.28Å; E980-P983 WeakPolarHBondContact O-CD 3.49Å
981	Q	90.4	Very high	85.7	Confident	21 Å²	21	39.6 Å²	39.6	10%	0.098	20%	0.203	C	C	.	.	H	α-helix	trans	-91.6	-7	-175.6	-60.4	-59.4	-40.7	0	0	114.1	S977 P983 E984 F985	S977-Q981 WeakPolarHBondContact O-CG 3.4Å; S977-Q981 PolarHBondContact O-N 3.25Å; S977-Q981 VanDerWaalsContact O-N 3.15Å; Q981-P983 VanDerWaalsContact C-CD 3.41Å; Q981-P983 VanDerWaalsContact C-N 3.32Å; Q981-E984 WeakPolarHBondContact O-CB 3.41Å; Q981-E984 PolarHBondContact O-N 3.48Å; Q981-F985 HydrophobicContact CB-CE1 4.44Å; Q981-F985 HydrophobicContact CB-CE2 4.13Å; Q981-F985 HydrophobicContact CB-CZ 4.02Å; Q981-F985 WeakPolarHBondContact O-CG 3.37Å; Q981-F985 PolarHBondContact O-N 3.05Å; Q981-F985 VanDerWaalsContact O-N 3.11Å
982	L	89.5	Confident	86.5	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-52.5	-39.2	176.5	-174.8	65.1	0	0	0	114.3	M978 E984 F985 T986 I1007 A1019 M1023	M978-L982 WeakPolarHBondContact O-CB 3.31Å; M978-L982 PolarHBondContact O-N 3.01Å; M978-L982 VanDerWaalsContact O-N 3.11Å; L982-E984 PolarHBondContact O-N 3.15Å; L982-F985 WeakPolarHBondContact O-CB 3.32Å; L982-F985 PolarHBondContact O-N 3.46Å; L982-T986 WeakPolarHBondContact O-CB 3.33Å; L982-T986 PolarHBondContact O-N 2.99Å; L982-T986 PolarHBondContact O-OG1 2.97Å; L982-I1007 HydrophobicContact CD1-CG2 3.95Å; L982-A1019 HydrophobicContact CD2-CB 4.1Å; L982-M1023 HydrophobicContact CD2-CB 4.2Å; L982-M1023 HydrophobicContact CG-CB 4.34Å
983	P	89.2	Confident	87.1	Confident	10 Å²	10	37.9 Å²	37.9	7%	0.065	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-40	172.8	-26.8	38.8	0	0	0	113.5	E980 Q981 T986 R987 S1022 H1026	E980-P983 VanDerWaalsContact O-CD 3.28Å; E980-P983 WeakPolarHBondContact O-CD 3.49Å; Q981-P983 VanDerWaalsContact C-CD 3.41Å; Q981-P983 VanDerWaalsContact C-N 3.32Å; P983-T986 WeakPolarHBondContact O-CB 3.36Å; P983-T986 PolarHBondContact O-N 2.97Å; P983-R987 WeakPolarHBondContact O-CG 3.27Å; P983-R987 PolarHBondContact O-N 3.11Å; P983-S1022 WeakPolarHBondContact CG-OG 3.44Å; P983-H1026 HydrophobicContact CB-CB 3.79Å
984	E	90.3	Very high	87.5	Confident	35 Å²	35	36.7 Å²	36.7	16%	0.164	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-45.6	179.2	-54.1	-54.1	141.8	0	0	110.7	R920 Q981 L982 T986 R987 G988	R920-E984 HydrophobicContact CB-CB 4.41Å; R920-E984 WeakPolarHBondContact CD-OE2 3.49Å; R920-E984 IonicContact CZ-OE2 3.19Å; R920-E984 IonicContact NE-OE2 3.77Å; R920-E984 IonicContact NH1-OE1 3.61Å; R920-E984 IonicContact NH1-OE2 2.74Å; R920-E984 PolarHBondContact NH1-OE2 2.73Å; Q981-E984 WeakPolarHBondContact O-CB 3.41Å; Q981-E984 PolarHBondContact O-N 3.48Å; L982-E984 PolarHBondContact O-N 3.15Å; E984-T986 VanDerWaalsContact C-N 3.31Å; E984-T986 PolarHBondContact O-N 3.49Å; E984-R987 PolarHBondContact O-N 2.91Å; E984-R987 IonicContact OE1-CZ 2.82Å; E984-R987 IonicContact OE1-NH1 2.88Å; E984-R987 PolarHBondContact OE1-NH1 3.47Å; E984-R987 IonicContact OE2-NH1 3.29Å; E984-R987 PolarHBondContact OE2-NH1 2.79Å; E984-G988 PolarHBondContact O-N 3.06Å; E984-G988 VanDerWaalsContact O-N 3.07Å
985	F	89.6	Confident	87.6	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.009	21%	0.206	C	C	.	.	H	α-helix	trans	-54.7	-46.2	172.5	-66.4	-17.9	0	0	0	112.4	Y912 A915 G916 V919 F946 F947 Q981 L982 R987 G988 I989	Y912-F985 HydrophobicContact CD1-CE2 4.34Å; Y912-F985 HydrophobicContact CD1-CZ 4.09Å; A915-F985 HydrophobicContact CB-CE1 4.16Å; A915-F985 HydrophobicContact CB-CZ 4.44Å; G916-F985 VanDerWaalsContact CA-CE1 3.42Å; V919-F985 HydrophobicContact CB-CD1 4.36Å; V919-F985 HydrophobicContact CG1-CD1 4.47Å; F946-F985 HydrophobicContact CB-CZ 4.22Å; F947-F985 HydrophobicContact CD1-CB 3.77Å; F947-F985 HydrophobicContact CD1-CD1 4.23Å; F947-F985 AromaticContact CD1-CD2 3.91Å; F947-F985 HydrophobicContact CD1-CD2 3.91Å; F947-F985 AromaticContact CD1-CG 3.72Å; F947-F985 HydrophobicContact CD1-CG 3.72Å; F947-F985 HydrophobicContact CD2-CD1 4.49Å; F947-F985 HydrophobicContact CD2-CE1 4.34Å; F947-F985 HydrophobicContact CD2-CE2 4.43Å; F947-F985 HydrophobicContact CD2-CZ 4.34Å; F947-F985 HydrophobicContact CE1-CB 3.22Å; F947-F985 AromaticContact CE1-CD1 3.4Å; F947-F985 HydrophobicContact CE1-CD1 3.4Å; F947-F985 VanDerWaalsContact CE1-CD1 3.4Å; F947-F985 AromaticContact CE1-CD2 3.88Å; F947-F985 HydrophobicContact CE1-CD2 3.88Å; F947-F985 HydrophobicContact CE1-CE1 4.15Å; F947-F985 AromaticContact CE1-CG 3.21Å; F947-F985 HydrophobicContact CE1-CG 3.21Å; F947-F985 AromaticContact CE2-CD1 3.69Å; F947-F985 HydrophobicContact CE2-CD1 3.69Å; F947-F985 HydrophobicContact CE2-CD2 4.46Å; F947-F985 AromaticContact CE2-CE1 3.58Å; F947-F985 HydrophobicContact CE2-CE1 3.58Å; F947-F985 HydrophobicContact CE2-CE2 4.42Å; F947-F985 HydrophobicContact CE2-CG 4.13Å; F947-F985 AromaticContact CE2-CZ 3.99Å; F947-F985 HydrophobicContact CE2-CZ 3.99Å; F947-F985 HydrophobicContact CG-CD2 4.22Å; F947-F985 HydrophobicContact CG-CE2 4.47Å; F947-F985 HydrophobicContact CG-CG 4.35Å; F947-F985 HydrophobicContact CZ-CB 3.87Å; F947-F985 AromaticContact CZ-CD1 3.01Å; F947-F985 HydrophobicContact CZ-CD1 3.01Å; F947-F985 HydrophobicContact CZ-CD2 4.1Å; F947-F985 AromaticContact CZ-CE1 3.42Å; F947-F985 HydrophobicContact CZ-CE1 3.42Å; F947-F985 VanDerWaalsContact CZ-CE1 3.42Å; F947-F985 HydrophobicContact CZ-CE2 4.45Å; F947-F985 AromaticContact CZ-CG 3.39Å; F947-F985 HydrophobicContact CZ-CG 3.39Å; F947-F985 HydrophobicContact CZ-CZ 4.15Å; Q981-F985 HydrophobicContact CB-CE1 4.44Å; Q981-F985 HydrophobicContact CB-CE2 4.13Å; Q981-F985 HydrophobicContact CB-CZ 4.02Å; Q981-F985 WeakPolarHBondContact O-CG 3.37Å; Q981-F985 PolarHBondContact O-N 3.05Å; Q981-F985 VanDerWaalsContact O-N 3.11Å; L982-F985 WeakPolarHBondContact O-CB 3.32Å; L982-F985 PolarHBondContact O-N 3.46Å; F985-R987 PolarHBondContact O-N 3.47Å; F985-G988 PolarHBondContact O-N 3.08Å; F985-I989 WeakPolarHBondContact O-CG1 3.44Å; F985-I989 PolarHBondContact O-N 3.24Å
986	T	88.8	Confident	87.7	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-44.2	178.5	-60.8	0	0	0	0	111.7	L982 P983 E984 G988 I989 A990 M1023 F1032 I1036	L982-T986 WeakPolarHBondContact O-CB 3.33Å; L982-T986 PolarHBondContact O-N 2.99Å; L982-T986 PolarHBondContact O-OG1 2.97Å; P983-T986 WeakPolarHBondContact O-CB 3.36Å; P983-T986 PolarHBondContact O-N 2.97Å; E984-T986 VanDerWaalsContact C-N 3.31Å; E984-T986 PolarHBondContact O-N 3.49Å; T986-G988 VanDerWaalsContact C-N 3.31Å; T986-G988 PolarHBondContact O-N 3.43Å; T986-I989 PolarHBondContact O-N 3.12Å; T986-A990 WeakPolarHBondContact O-CB 3.48Å; T986-A990 PolarHBondContact O-N 2.91Å; T986-M1023 HydrophobicContact CG2-CE 4.14Å; T986-M1023 HydrophobicContact CG2-CG 3.7Å; T986-M1023 VanDerWaalsContact OG1-CG 3.25Å; T986-M1023 WeakPolarHBondContact OG1-CG 3.45Å; T986-F1032 HydrophobicContact CG2-CD1 4.49Å; T986-F1032 HydrophobicContact CG2-CE1 3.66Å; T986-I1036 HydrophobicContact CG2-CD1 4.09Å
987	R	90.6	Very high	87.8	Confident	55 Å²	55	42.1 Å²	42.1	21%	0.208	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-35.6	178	-70.1	-176.2	-159.6	113.8	-2.3	112.4	R920 P983 E984 F985 Q991 H1026	R920-R987 HydrophobicContact CG-CB 4.3Å; P983-R987 WeakPolarHBondContact O-CG 3.27Å; P983-R987 PolarHBondContact O-N 3.11Å; E984-R987 PolarHBondContact O-N 2.91Å; E984-R987 IonicContact OE1-CZ 2.82Å; E984-R987 IonicContact OE1-NH1 2.88Å; E984-R987 PolarHBondContact OE1-NH1 3.47Å; E984-R987 IonicContact OE2-NH1 3.29Å; E984-R987 PolarHBondContact OE2-NH1 2.79Å; F985-R987 PolarHBondContact O-N 3.47Å; R987-Q991 PolarHBondContact O-NE2 3.43Å; R987-H1026 PolarHBondContact NH2-CD2 3.28Å
988	G	89.8	Confident	87.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68	-49.3	174.9	0	0	0	0	0	112.9	V919 S923 E984 F985 T986 A990 Q991	V919-G988 WeakPolarHBondContact O-CA 3.47Å; S923-G988 VanDerWaalsContact CB-O 3.28Å; S923-G988 WeakPolarHBondContact CB-O 3.4Å; S923-G988 VanDerWaalsContact OG-C 3.24Å; S923-G988 WeakPolarHBondContact OG-CA 3.17Å; S923-G988 PolarHBondContact OG-O 2.9Å; E984-G988 PolarHBondContact O-N 3.06Å; E984-G988 VanDerWaalsContact O-N 3.07Å; F985-G988 PolarHBondContact O-N 3.08Å; T986-G988 VanDerWaalsContact C-N 3.31Å; T986-G988 PolarHBondContact O-N 3.43Å; G988-A990 PolarHBondContact O-N 2.95Å; G988-Q991 VanDerWaalsContact O-CB 3.31Å; G988-Q991 WeakPolarHBondContact O-CB 3.42Å; G988-Q991 PolarHBondContact O-N 3.31Å
989	I	89.6	Confident	87.6	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-36.4	178.4	-66.5	165.6	0	0	0	111.4	F939 F947 F985 T986 Q991 L992 I1000 I1003 I1004 I1007 F1032	F939-I989 HydrophobicContact CZ-CG1 4.08Å; F947-I989 HydrophobicContact CD1-CD1 4.28Å; F947-I989 HydrophobicContact CE1-CD1 4.26Å; F985-I989 WeakPolarHBondContact O-CG1 3.44Å; F985-I989 PolarHBondContact O-N 3.24Å; T986-I989 PolarHBondContact O-N 3.12Å; I989-Q991 PolarHBondContact O-N 3.23Å; I989-Q991 VanDerWaalsContact O-N 3.13Å; I989-L992 WeakPolarHBondContact O-CB 3.13Å; I989-L992 PolarHBondContact O-N 3.45Å; I989-I1000 HydrophobicContact CG2-CG2 3.83Å; I989-I1003 HydrophobicContact CD1-CG2 4.26Å; I989-I1004 HydrophobicContact CG2-CD1 3.86Å; I989-I1004 HydrophobicContact CG2-CG1 3.66Å; I989-I1007 HydrophobicContact CD1-CD1 3.6Å; I989-F1032 HydrophobicContact CB-CZ 4.41Å; I989-F1032 HydrophobicContact CG2-CE2 4.36Å; I989-F1032 HydrophobicContact CG2-CZ 4.07Å
990	A	90	Very high	87.8	Confident	13 Å²	13	46 Å²	46	11%	0.107	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.1	178	0	0	0	0	0	114.1	T986 G988 L992 P1028 F1032	T986-A990 WeakPolarHBondContact O-CB 3.48Å; T986-A990 PolarHBondContact O-N 2.91Å; G988-A990 PolarHBondContact O-N 2.95Å; A990-L992 VanDerWaalsContact C-N 3.34Å; A990-P1028 HydrophobicContact CB-CG 3.32Å; A990-F1032 HydrophobicContact CB-CD1 3.56Å; A990-F1032 HydrophobicContact CB-CD2 4.2Å; A990-F1032 HydrophobicContact CB-CE1 3.58Å; A990-F1032 HydrophobicContact CB-CE2 4.22Å; A990-F1032 HydrophobicContact CB-CG 3.87Å; A990-F1032 HydrophobicContact CB-CZ 3.92Å
991	Q	87.4	Confident	87.8	Confident	67 Å²	67	40.9 Å²	40.9	31%	0.313	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-17.4	176.3	-62.6	169.1	20.9	0	0	112.5	R920 M924 R987 G988 I989	R920-Q991 PolarHBondContact O-NE2 3.01Å; M924-Q991 HydrophobicContact CE-CB 4.1Å; M924-Q991 WeakPolarHBondContact CE-O 3.21Å; M924-Q991 HydrophobicContact CG-CB 4.05Å; R987-Q991 PolarHBondContact O-NE2 3.43Å; G988-Q991 VanDerWaalsContact O-CB 3.31Å; G988-Q991 WeakPolarHBondContact O-CB 3.42Å; G988-Q991 PolarHBondContact O-N 3.31Å; I989-Q991 PolarHBondContact O-N 3.23Å; I989-Q991 VanDerWaalsContact O-N 3.13Å
992	L	88.8	Confident	87.6	Confident	11 Å²	11	47.7 Å²	47.7	6%	0.058	23%	0.233	C	C	.	.	S	Bend	trans	-80.6	165.6	178.3	-57.7	179.6	0	0	0	110.5	Y927 F939 I989 A990 W994 I1000	Y927-L992 HydrophobicContact CD1-CD1 4.43Å; Y927-L992 HydrophobicContact CD1-CD2 4.05Å; Y927-L992 HydrophobicContact CD2-CD1 4.38Å; Y927-L992 HydrophobicContact CG-CD1 4.06Å; Y927-L992 HydrophobicContact CG-CD2 4.03Å; F939-L992 HydrophobicContact CE1-CD1 3.93Å; F939-L992 HydrophobicContact CE2-CD1 3.97Å; F939-L992 HydrophobicContact CZ-CD1 3.61Å; I989-L992 WeakPolarHBondContact O-CB 3.13Å; I989-L992 PolarHBondContact O-N 3.45Å; A990-L992 VanDerWaalsContact C-N 3.34Å; L992-W994 PolarHBondContact O-N 3.12Å; L992-I1000 HydrophobicContact CB-CG1 4.32Å; L992-I1000 HydrophobicContact CB-CG2 4.35Å; L992-I1000 HydrophobicContact CD1-CD1 3.62Å; L992-I1000 HydrophobicContact CD1-CG1 4.28Å
993	N	86.5	Confident	87.6	Confident	120 Å²	120	47.9 Å²	47.9	64%	0.642	23%	0.234	S	C	*	.			trans	-76.1	55.4	179.5	-77.1	-24.7	0	0	0	112.6	R995 S996 D997	N993-R995 PolarHBondContact O-N 3.24Å; N993-S996 PolarHBondContact O-N 3.03Å; N993-S996 VanDerWaalsContact O-N 3.1Å; N993-S996 PolarHBondContact O-OG 2.86Å; N993-D997 VanDerWaalsContact O-CB 3.24Å; N993-D997 WeakPolarHBondContact O-CB 3.46Å; N993-D997 PolarHBondContact O-N 3.4Å
994	W	86.4	Confident	87.5	Confident	24 Å²	24	47.4 Å²	47.4	9%	0.091	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-11.8	-174.9	60.2	-98.4	0	0	0	115.3	L992 I1000 C1001 I1004 D1031 F1032 H1035	L992-W994 PolarHBondContact O-N 3.12Å; W994-I1000 HydrophobicContact CB-CG2 3.7Å; W994-C1001 PolarHBondContact O-SG 3.49Å; W994-I1004 HydrophobicContact CB-CD1 3.72Å; W994-I1004 HydrophobicContact CG-CD1 4.5Å; W994-D1031 HydrophobicContact CH2-CB 4.23Å; W994-D1031 HydrophobicContact CZ2-CB 4.28Å; W994-F1032 HydrophobicContact CB-CE2 4.37Å; W994-F1032 AromaticContact CD1-CD2 3.66Å; W994-F1032 AromaticContact CD1-CE2 3.9Å; W994-F1032 AromaticContact CD2-CD2 3.73Å; W994-F1032 HydrophobicContact CD2-CD2 3.73Å; W994-F1032 HydrophobicContact CD2-CE2 4.24Å; W994-F1032 AromaticContact CE2-CD2 3.57Å; W994-F1032 HydrophobicContact CE3-CD2 4.4Å; W994-F1032 AromaticContact CG-CD2 3.83Å; W994-F1032 HydrophobicContact CG-CD2 3.83Å; W994-F1032 AromaticContact CG-CE2 3.93Å; W994-F1032 HydrophobicContact CG-CE2 3.93Å; W994-F1032 HydrophobicContact CZ2-CB 3.98Å; W994-F1032 HydrophobicContact CZ2-CD2 4.1Å; W994-F1032 AromaticContact NE1-CD2 3.52Å; W994-H1035 HydrophobicContact CE3-CB 4.31Å; W994-H1035 AromaticContact CE3-CD2 3.48Å; W994-H1035 VanDerWaalsContact CE3-CD2 3.48Å; W994-H1035 AromaticContact CE3-CG 3.88Å; W994-H1035 AromaticContact CE3-NE2 3.87Å; W994-H1035 HydrophobicContact CH2-CB 4.04Å; W994-H1035 HydrophobicContact CZ3-CB 3.62Å; W994-H1035 AromaticContact CZ3-CD2 3.59Å; W994-H1035 AromaticContact CZ3-CG 3.46Å; W994-H1035 VanDerWaalsContact CZ3-CG 3.46Å; W994-H1035 AromaticContact CZ3-ND1 3.94Å
995	R	83.6	Confident	87.4	Confident	162 Å²	162	50.1 Å²	50.1	61%	0.611	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-37	174.8	-69.8	-174.3	-175.3	176.9	4.8	113.2	N993 D1031	N993-R995 PolarHBondContact O-N 3.24Å; R995-D1031 IonicContact CZ-OD2 3.46Å; R995-D1031 IonicContact NH2-OD2 3.14Å; R995-D1031 PolarHBondContact NH2-OD2 3.24Å
996	S	83.4	Confident	87.3	Confident	93 Å²	93	51.3 Å²	51.3	65%	0.65	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-23.7	-173.5	54.7	0	0	0	0	112.1	N993 P998	N993-S996 PolarHBondContact O-N 3.03Å; N993-S996 VanDerWaalsContact O-N 3.1Å; N993-S996 PolarHBondContact O-OG 2.86Å; S996-P998 VanDerWaalsContact O-CD 3.31Å; S996-P998 WeakPolarHBondContact O-CD 3.31Å
997	D	84.9	Confident	87.3	Confident	31 Å²	31	51.3 Å²	51.3	17%	0.166	25%	0.249	C	C	.	.			trans	-90.3	107.9	-177.8	-163.1	-46.9	0	0	0	111	Y927 N993 Y999 I1000 C1001	Y927-D997 PolarHBondContact OH-OD2 3.42Å; N993-D997 VanDerWaalsContact O-CB 3.24Å; N993-D997 WeakPolarHBondContact O-CB 3.46Å; N993-D997 PolarHBondContact O-N 3.4Å; D997-Y999 PolarHBondContact O-N 3.26Å; D997-Y999 WeakPolarHBondContact OD1-CB 3.23Å; D997-Y999 PolarHBondContact OD1-N 2.84Å; D997-I1000 HydrophobicContact CB-CB 4.16Å; D997-I1000 HydrophobicContact CB-CG1 3.95Å; D997-I1000 PolarHBondContact O-N 3.1Å; D997-I1000 PolarHBondContact OD1-N 2.85Å; D997-C1001 PolarHBondContact O-N 2.99Å; D997-C1001 VanDerWaalsContact O-N 3.08Å; D997-C1001 PolarHBondContact O-SG 3.39Å; D997-C1001 VanDerWaalsContact O-SG 3.36Å
998	P	85.2	Confident	87.1	Confident	103 Å²	103	48.9 Å²	48.9	67%	0.669	24%	0.24	S	C	*	.	H	α-helix	trans	-66.4	-26.4	-177.2	28.3	-35	0	0	0	112.7	S996 R1002	S996-P998 VanDerWaalsContact O-CD 3.31Å; S996-P998 WeakPolarHBondContact O-CD 3.31Å; P998-R1002 WeakPolarHBondContact O-CB 3.47Å; P998-R1002 PolarHBondContact O-N 3.29Å
999	Y	85.3	Confident	86.9	Confident	76 Å²	76	52.1 Å²	52.1	30%	0.298	25%	0.254	S	S	.	.	H	α-helix	trans	-70.2	-45.3	178.6	177.3	-106.8	0	0	0	110.6	Y927 E940 D997 R1002 I1003	Y927-Y999 HydrophobicContact CE2-CD1 4.14Å; Y927-Y999 HydrophobicContact CE2-CE1 4.36Å; E940-Y999 HydrophobicContact CG-CE1 3.81Å; E940-Y999 WeakPolarHBondContact CG-OH 3.4Å; E940-Y999 WeakPolarHBondContact OE1-CE1 3.38Å; D997-Y999 PolarHBondContact O-N 3.26Å; D997-Y999 WeakPolarHBondContact OD1-CB 3.23Å; D997-Y999 PolarHBondContact OD1-N 2.84Å; Y999-R1002 WeakPolarHBondContact O-CB 3.37Å; Y999-R1002 PolarHBondContact O-N 3.03Å; Y999-R1002 VanDerWaalsContact O-N 3.13Å; Y999-I1003 HydrophobicContact CD1-CD1 3.76Å; Y999-I1003 HydrophobicContact CE1-CD1 3.2Å; Y999-I1003 HydrophobicContact CE1-CG1 4.18Å; Y999-I1003 HydrophobicContact CE2-CD1 4.34Å; Y999-I1003 PolarHBondContact O-N 3.35Å
1000	I	88.3	Confident	86.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.7	-41.7	175.7	-57.4	-56.4	0	0	0	111.2	Y927 F939 I989 L992 W994 D997 R1002 I1003 I1004	Y927-I1000 HydrophobicContact CD2-CD1 4.21Å; Y927-I1000 HydrophobicContact CE1-CD1 4.37Å; Y927-I1000 HydrophobicContact CE1-CG1 4.4Å; Y927-I1000 HydrophobicContact CE2-CD1 3.74Å; F939-I1000 HydrophobicContact CE1-CD1 4.22Å; I989-I1000 HydrophobicContact CG2-CG2 3.83Å; L992-I1000 HydrophobicContact CB-CG1 4.32Å; L992-I1000 HydrophobicContact CB-CG2 4.35Å; L992-I1000 HydrophobicContact CD1-CD1 3.62Å; L992-I1000 HydrophobicContact CD1-CG1 4.28Å; W994-I1000 HydrophobicContact CB-CG2 3.7Å; D997-I1000 HydrophobicContact CB-CB 4.16Å; D997-I1000 HydrophobicContact CB-CG1 3.95Å; D997-I1000 PolarHBondContact O-N 3.1Å; D997-I1000 PolarHBondContact OD1-N 2.85Å; I1000-R1002 PolarHBondContact O-N 2.89Å; I1000-I1003 HydrophobicContact CD1-CD1 4.23Å; I1000-I1003 PolarHBondContact O-N 3.41Å; I1000-I1004 HydrophobicContact CG2-CD1 3.99Å; I1000-I1004 WeakPolarHBondContact O-CG1 3.38Å; I1000-I1004 PolarHBondContact O-N 3.44Å
1001	C	86.1	Confident	86.2	Confident	29 Å²	29	51.6 Å²	51.6	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-54.1	-43.5	172	-68.2	0	0	0	0	111.7	W994 D997 I1004 K1005	W994-C1001 PolarHBondContact O-SG 3.49Å; D997-C1001 PolarHBondContact O-N 2.99Å; D997-C1001 VanDerWaalsContact O-N 3.08Å; D997-C1001 PolarHBondContact O-SG 3.39Å; D997-C1001 VanDerWaalsContact O-SG 3.36Å; C1001-I1004 PolarHBondContact O-N 3.43Å; C1001-K1005 WeakPolarHBondContact O-CB 3.28Å; C1001-K1005 PolarHBondContact O-N 2.92Å
1002	R	86.8	Confident	85.9	Confident	165 Å²	165	50.2 Å²	50.2	62%	0.623	24%	0.241	S	C	*	.	H	α-helix	trans	-65.4	-44.9	179.4	-178.7	179.1	177.5	169.4	-0.4	111.7	P998 Y999 I1000 I1004 K1005 D1006	P998-R1002 WeakPolarHBondContact O-CB 3.47Å; P998-R1002 PolarHBondContact O-N 3.29Å; Y999-R1002 WeakPolarHBondContact O-CB 3.37Å; Y999-R1002 PolarHBondContact O-N 3.03Å; Y999-R1002 VanDerWaalsContact O-N 3.13Å; I1000-R1002 PolarHBondContact O-N 2.89Å; R1002-I1004 VanDerWaalsContact C-N 3.33Å; R1002-I1004 PolarHBondContact O-N 3.49Å; R1002-K1005 PolarHBondContact O-N 3.11Å; R1002-D1006 IonicContact NE-OD2 2.63Å; R1002-D1006 WeakPolarHBondContact O-CB 3.24Å; R1002-D1006 PolarHBondContact O-N 2.63Å
1003	I	88.4	Confident	85.3	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-56.5	-48.5	175.5	-72.3	167.3	0	0	0	110.5	F939 V943 L948 I989 Y999 I1000 K1005 D1006 I1007	F939-I1003 HydrophobicContact CE1-CD1 4.33Å; V943-I1003 HydrophobicContact CG1-CD1 4.34Å; V943-I1003 HydrophobicContact CG1-CG1 4.49Å; V943-I1003 HydrophobicContact CG2-CD1 4.45Å; L948-I1003 HydrophobicContact CD1-CG2 4.06Å; I989-I1003 HydrophobicContact CD1-CG2 4.26Å; Y999-I1003 HydrophobicContact CD1-CD1 3.76Å; Y999-I1003 HydrophobicContact CE1-CD1 3.2Å; Y999-I1003 HydrophobicContact CE1-CG1 4.18Å; Y999-I1003 HydrophobicContact CE2-CD1 4.34Å; Y999-I1003 PolarHBondContact O-N 3.35Å; I1000-I1003 HydrophobicContact CD1-CD1 4.23Å; I1000-I1003 PolarHBondContact O-N 3.41Å; I1003-K1005 VanDerWaalsContact C-N 3.32Å; I1003-K1005 PolarHBondContact O-N 3.5Å; I1003-D1006 PolarHBondContact O-N 3.42Å; I1003-I1007 HydrophobicContact CG2-CD1 3.6Å; I1003-I1007 HydrophobicContact CG2-CG1 4.21Å; I1003-I1007 VanDerWaalsContact O-CG1 3.27Å; I1003-I1007 WeakPolarHBondContact O-CG1 3.42Å; I1003-I1007 PolarHBondContact O-N 2.95Å
1004	I	88.4	Confident	84.9	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-46.5	-179.8	-64.8	160.5	0	0	0	110.5	I989 W994 I1000 C1001 R1002 D1006 I1007 V1008 F1032 I1036 F1039	I989-I1004 HydrophobicContact CG2-CD1 3.86Å; I989-I1004 HydrophobicContact CG2-CG1 3.66Å; W994-I1004 HydrophobicContact CB-CD1 3.72Å; W994-I1004 HydrophobicContact CG-CD1 4.5Å; I1000-I1004 HydrophobicContact CG2-CD1 3.99Å; I1000-I1004 WeakPolarHBondContact O-CG1 3.38Å; I1000-I1004 PolarHBondContact O-N 3.44Å; C1001-I1004 PolarHBondContact O-N 3.43Å; R1002-I1004 VanDerWaalsContact C-N 3.33Å; R1002-I1004 PolarHBondContact O-N 3.49Å; I1004-D1006 PolarHBondContact O-N 3.31Å; I1004-I1007 PolarHBondContact O-N 2.91Å; I1004-V1008 WeakPolarHBondContact O-CG2 3.32Å; I1004-V1008 PolarHBondContact O-N 2.91Å; I1004-F1032 HydrophobicContact CD1-CE2 3.65Å; I1004-F1032 HydrophobicContact CD1-CZ 4.21Å; I1004-F1032 HydrophobicContact CG1-CE2 4.41Å; I1004-I1036 HydrophobicContact CG2-CG1 4.15Å; I1004-F1039 HydrophobicContact CG2-CD2 4.01Å; I1004-F1039 HydrophobicContact CG2-CE2 4.15Å
1005	K	87.8	Confident	84.4	Confident	93 Å²	93	51.1 Å²	51.1	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-46.8	177.8	-176	-176.7	177.2	-176.3	0	111.5	C1001 R1002 I1003 V1008 K1009 F1039	C1001-K1005 WeakPolarHBondContact O-CB 3.28Å; C1001-K1005 PolarHBondContact O-N 2.92Å; R1002-K1005 PolarHBondContact O-N 3.11Å; I1003-K1005 VanDerWaalsContact C-N 3.32Å; I1003-K1005 PolarHBondContact O-N 3.5Å; K1005-V1008 PolarHBondContact O-N 3.39Å; K1005-K1009 WeakPolarHBondContact O-CB 3.25Å; K1005-K1009 PolarHBondContact O-N 3.23Å; K1005-F1039 HydrophobicContact CB-CD1 4.36Å; K1005-F1039 HydrophobicContact CB-CE1 4.33Å; K1005-F1039 HydrophobicContact CB-CE2 4.49Å; K1005-F1039 HydrophobicContact CB-CG 4.5Å; K1005-F1039 HydrophobicContact CB-CZ 4.39Å; K1005-F1039 HydrophobicContact CD-CE1 4.42Å; K1005-F1039 HydrophobicContact CG-CD1 4.19Å; K1005-F1039 HydrophobicContact CG-CE1 4.41Å
1006	D	88	Confident	84.2	Confident	26 Å²	26	44.2 Å²	44.2	14%	0.139	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-41.7	-179.7	-75.3	-3.4	0	0	0	111	L948 Y953 R1002 I1003 I1004 K1009 I1010	L948-D1006 HydrophobicContact CD1-CB 3.99Å; L948-D1006 HydrophobicContact CD2-CB 4.36Å; Y953-D1006 HydrophobicContact CE1-CB 4.47Å; Y953-D1006 WeakPolarHBondContact OH-CB 3.39Å; Y953-D1006 PolarHBondContact OH-OD2 2.65Å; R1002-D1006 IonicContact NE-OD2 2.63Å; R1002-D1006 WeakPolarHBondContact O-CB 3.24Å; R1002-D1006 PolarHBondContact O-N 2.63Å; I1003-D1006 PolarHBondContact O-N 3.42Å; I1004-D1006 PolarHBondContact O-N 3.31Å; D1006-K1009 PolarHBondContact O-N 3.49Å; D1006-I1010 HydrophobicContact CB-CD1 4.26Å; D1006-I1010 WeakPolarHBondContact O-CB 3.38Å; D1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; D1006-I1010 PolarHBondContact O-N 2.87Å
1007	I	88.6	Confident	84.1	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-54.2	173.5	-70.2	168.3	0	0	0	110	L948 L982 I989 I1003 I1004 K1009 I1010 H1011 M1023	L948-I1007 HydrophobicContact CD1-CG1 3.91Å; L948-I1007 HydrophobicContact CD2-CG1 3.97Å; L948-I1007 HydrophobicContact CG-CG1 3.9Å; L982-I1007 HydrophobicContact CD1-CG2 3.95Å; I989-I1007 HydrophobicContact CD1-CD1 3.6Å; I1003-I1007 HydrophobicContact CG2-CD1 3.6Å; I1003-I1007 HydrophobicContact CG2-CG1 4.21Å; I1003-I1007 VanDerWaalsContact O-CG1 3.27Å; I1003-I1007 WeakPolarHBondContact O-CG1 3.42Å; I1003-I1007 PolarHBondContact O-N 2.95Å; I1004-I1007 PolarHBondContact O-N 2.91Å; I1007-K1009 PolarHBondContact O-N 2.72Å; I1007-I1010 PolarHBondContact O-N 3.02Å; I1007-H1011 WeakPolarHBondContact O-CB 3.5Å; I1007-H1011 PolarHBondContact O-N 3.33Å; I1007-H1011 PolarHBondContact O-ND1 2.95Å; I1007-M1023 HydrophobicContact CG2-CE 4.16Å; I1007-M1023 HydrophobicContact CG2-SD 3.84Å
1008	V	86.8	Confident	84.1	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-57	-50.2	-178.6	171.9	0	0	0	0	110.6	I1004 K1005 Y1012 I1020 M1023 I1036 F1039 A1040	I1004-V1008 WeakPolarHBondContact O-CG2 3.32Å; I1004-V1008 PolarHBondContact O-N 2.91Å; K1005-V1008 PolarHBondContact O-N 3.39Å; V1008-Y1012 WeakPolarHBondContact O-CB 3.41Å; V1008-Y1012 PolarHBondContact O-N 3.31Å; V1008-Y1012 VanDerWaalsContact O-N 3.09Å; V1008-I1020 HydrophobicContact CG1-CG2 4.45Å; V1008-M1023 HydrophobicContact CG2-CE 4.44Å; V1008-M1023 HydrophobicContact CG2-SD 4.49Å; V1008-I1036 HydrophobicContact CG2-CG2 3.82Å; V1008-F1039 HydrophobicContact CG1-CB 4.48Å; V1008-A1040 HydrophobicContact CG1-CB 3.83Å
1009	K	83.9	Confident	84	Confident	68 Å²	68	36.3 Å²	36.3	30%	0.296	18%	0.176	S	C	.	.	H	α-helix	trans	-63.1	-50.1	-178.1	-173.5	-176.1	179	-165.5	0	112.3	K1005 D1006 I1007 K1013 D1043	K1005-K1009 WeakPolarHBondContact O-CB 3.25Å; K1005-K1009 PolarHBondContact O-N 3.23Å; D1006-K1009 PolarHBondContact O-N 3.49Å; I1007-K1009 PolarHBondContact O-N 2.72Å; K1009-K1013 PolarHBondContact O-N 3.23Å; K1009-D1043 WeakPolarHBondContact CB-OD2 3.16Å
1010	I	83.2	Confident	84.2	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-74.1	-43.9	-172.1	-69.2	172.9	0	0	0	110.7	L948 L952 Y953 D1006 I1007 K1013 H1014	L948-I1010 HydrophobicContact CD2-CB 4.49Å; L948-I1010 HydrophobicContact CD2-CD1 3.96Å; L952-I1010 HydrophobicContact CB-CG2 3.57Å; L952-I1010 HydrophobicContact CD1-CG2 3.89Å; L952-I1010 HydrophobicContact CG-CG2 4.23Å; Y953-I1010 HydrophobicContact CD1-CD1 3.65Å; Y953-I1010 HydrophobicContact CD2-CD1 4.32Å; Y953-I1010 HydrophobicContact CE1-CD1 3.35Å; Y953-I1010 HydrophobicContact CE2-CD1 4.08Å; Y953-I1010 HydrophobicContact CG-CD1 4.15Å; D1006-I1010 HydrophobicContact CB-CD1 4.26Å; D1006-I1010 WeakPolarHBondContact O-CB 3.38Å; D1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; D1006-I1010 PolarHBondContact O-N 2.87Å; I1007-I1010 PolarHBondContact O-N 3.02Å; I1010-K1013 PolarHBondContact O-N 3.11Å; I1010-H1014 PolarHBondContact O-CD2 3.36Å; I1010-H1014 VanDerWaalsContact O-CD2 3.29Å; I1010-H1014 PolarHBondContact O-N 2.84Å
1011	H	82.4	Confident	84.2	Confident	3 Å²	3	32.8 Å²	32.8	1%	0.014	16%	0.162	C	C	.	.	H	α-helix	trans	-73.2	-32.9	-178.1	-71.3	50.1	0	0	0	111.9	F947 I1007 K1013 H1014 F1015 G1016 I1020	F947-H1011 PolarHBondContact O-CE1 3.02Å; I1007-H1011 WeakPolarHBondContact O-CB 3.5Å; I1007-H1011 PolarHBondContact O-N 3.33Å; I1007-H1011 PolarHBondContact O-ND1 2.95Å; H1011-K1013 PolarHBondContact O-N 3.42Å; H1011-H1014 PolarHBondContact O-N 2.96Å; H1011-F1015 HydrophobicContact CB-CD2 3.72Å; H1011-F1015 HydrophobicContact CB-CE2 4.31Å; H1011-F1015 AromaticContact CD2-CD2 3.5Å; H1011-F1015 VanDerWaalsContact CD2-CD2 3.5Å; H1011-F1015 WeakPolarHBondContact CD2-CD2 3.49Å; H1011-F1015 AromaticContact CD2-CE2 3.44Å; H1011-F1015 VanDerWaalsContact CD2-CE2 3.44Å; H1011-F1015 WeakPolarHBondContact CD2-CE2 3.35Å; H1011-F1015 AromaticContact CG-CD2 3.66Å; H1011-F1015 AromaticContact CG-CE2 3.78Å; H1011-F1015 AromaticContact NE2-CE2 3.79Å; H1011-F1015 WeakPolarHBondContact O-CA 3.49Å; H1011-F1015 WeakPolarHBondContact O-CB 3.37Å; H1011-F1015 PolarHBondContact O-N 3.09Å; H1011-G1016 PolarHBondContact O-N 2.83Å; H1011-I1020 HydrophobicContact CB-CD1 3.57Å
1012	Y	81.1	Confident	84.4	Confident	37 Å²	37	33 Å²	33	15%	0.145	16%	0.164	C	C	.	.	H	α-helix	trans	-60	-38.4	171.9	-167.9	-93.1	0	0	0	111.6	V1008 G1016 P1017 I1020 W1072 F1075	V1008-Y1012 WeakPolarHBondContact O-CB 3.41Å; V1008-Y1012 PolarHBondContact O-N 3.31Å; V1008-Y1012 VanDerWaalsContact O-N 3.09Å; Y1012-G1016 VanDerWaalsContact O-CA 3.27Å; Y1012-G1016 WeakPolarHBondContact O-CA 3.44Å; Y1012-G1016 PolarHBondContact O-N 3.39Å; Y1012-P1017 HydrophobicContact CE2-CB 4Å; Y1012-I1020 HydrophobicContact CD2-CB 4.34Å; Y1012-I1020 HydrophobicContact CD2-CG1 3.92Å; Y1012-I1020 HydrophobicContact CG-CG1 4.4Å; Y1012-W1072 PolarHBondContact OH-N 3.13Å; Y1012-F1075 HydrophobicContact CE2-CB 4.41Å; Y1012-F1075 HydrophobicContact CE2-CG 4.44Å
1013	K	77	Confident	84.5	Confident	105 Å²	105	25.1 Å²	25.1	46%	0.457	13%	0.134	S	C	.	.	H	α-helix	trans	-69	-48.1	176.4	-172.9	-174.6	176	-171.4	0	112.2	T955 K1009 I1010 H1011	T955-K1013 PolarHBondContact O-NZ 2.9Å; K1009-K1013 PolarHBondContact O-N 3.23Å; I1010-K1013 PolarHBondContact O-N 3.11Å; H1011-K1013 PolarHBondContact O-N 3.42Å
1014	H	77.1	Confident	84.6	Confident	43 Å²	43	24.8 Å²	24.8	20%	0.199	13%	0.133	C	C	.	.	H	α-helix	trans	-90.6	-37.2	-168.8	-73	-67.4	0	0	0	115.2	L952 T955 M975 I1010 H1011	L952-H1014 PolarHBondContact O-NE2 3.36Å; T955-H1014 PolarHBondContact OG1-CE1 3.43Å; T955-H1014 PolarHBondContact OG1-NE2 3.4Å; M975-H1014 HydrophobicContact CE-CB 4.23Å; I1010-H1014 PolarHBondContact O-CD2 3.36Å; I1010-H1014 VanDerWaalsContact O-CD2 3.29Å; I1010-H1014 PolarHBondContact O-N 2.84Å; H1011-H1014 PolarHBondContact O-N 2.96Å
1015	F	77.1	Confident	84.6	Confident	26 Å²	26	26.8 Å²	26.8	11%	0.114	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-8.4	-179.9	-56.1	-79.4	0	0	0	113	M975 M978 Q979 H1011 A1019	M975-F1015 HydrophobicContact CB-CD1 4.47Å; M975-F1015 HydrophobicContact CB-CE1 3.89Å; M975-F1015 HydrophobicContact CE-CD1 3.55Å; M975-F1015 HydrophobicContact CE-CE1 3.15Å; M975-F1015 HydrophobicContact CE-CE2 4.4Å; M975-F1015 HydrophobicContact CE-CG 4.31Å; M975-F1015 HydrophobicContact CE-CZ 3.6Å; M975-F1015 HydrophobicContact CG-CE1 4.29Å; M975-F1015 WeakPolarHBondContact O-CE1 3.2Å; M975-F1015 HydrophobicContact SD-CD1 4.39Å; M975-F1015 HydrophobicContact SD-CE1 3.44Å; M975-F1015 WeakPolarHBondContact SD-CE1 3.49Å; M975-F1015 HydrophobicContact SD-CZ 3.69Å; M978-F1015 HydrophobicContact CB-CE1 3.92Å; M978-F1015 HydrophobicContact CB-CZ 3.73Å; M978-F1015 HydrophobicContact CG-CZ 4.29Å; M978-F1015 HydrophobicContact SD-CE1 4.31Å; M978-F1015 HydrophobicContact SD-CE2 4.45Å; M978-F1015 HydrophobicContact SD-CZ 3.54Å; M978-F1015 VanDerWaalsContact SD-CZ 3.54Å; Q979-F1015 HydrophobicContact CB-CD1 4.23Å; H1011-F1015 HydrophobicContact CB-CD2 3.72Å; H1011-F1015 HydrophobicContact CB-CE2 4.31Å; H1011-F1015 AromaticContact CD2-CD2 3.5Å; H1011-F1015 VanDerWaalsContact CD2-CD2 3.5Å; H1011-F1015 WeakPolarHBondContact CD2-CD2 3.49Å; H1011-F1015 AromaticContact CD2-CE2 3.44Å; H1011-F1015 VanDerWaalsContact CD2-CE2 3.44Å; H1011-F1015 WeakPolarHBondContact CD2-CE2 3.35Å; H1011-F1015 AromaticContact CG-CD2 3.66Å; H1011-F1015 AromaticContact CG-CE2 3.78Å; H1011-F1015 AromaticContact NE2-CE2 3.79Å; H1011-F1015 WeakPolarHBondContact O-CA 3.49Å; H1011-F1015 WeakPolarHBondContact O-CB 3.37Å; H1011-F1015 PolarHBondContact O-N 3.09Å; F1015-A1019 HydrophobicContact CB-CB 3.59Å; F1015-A1019 HydrophobicContact CG-CB 4.49Å
1016	G	78.6	Confident	84.5	Confident	17 Å²	17	26 Å²	26	18%	0.175	14%	0.141	C	C	.	.			trans	78.8	-176.9	-180	0	0	0	0	0	114.4	H1011 Y1012 G1018 A1019	H1011-G1016 PolarHBondContact O-N 2.83Å; Y1012-G1016 VanDerWaalsContact O-CA 3.27Å; Y1012-G1016 WeakPolarHBondContact O-CA 3.44Å; Y1012-G1016 PolarHBondContact O-N 3.39Å; G1016-G1018 VanDerWaalsContact C-N 3.3Å; G1016-G1018 PolarHBondContact O-N 3.01Å; G1016-A1019 PolarHBondContact O-N 3.25Å
1017	P	81.9	Confident	84.6	Confident	19 Å²	19	25.6 Å²	25.6	12%	0.123	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-29.8	-170.7	23.4	-33.5	0	0	0	113.9	Y1012 A1019 I1020 A1021 N1071 N1074 F1075	Y1012-P1017 HydrophobicContact CE2-CB 4Å; P1017-A1019 VanDerWaalsContact C-N 3.34Å; P1017-A1019 PolarHBondContact O-N 2.98Å; P1017-I1020 PolarHBondContact O-N 3.26Å; P1017-A1021 WeakPolarHBondContact O-CB 3.49Å; P1017-A1021 PolarHBondContact O-N 3.46Å; P1017-N1071 VanDerWaalsContact CB-O 3.3Å; P1017-N1071 WeakPolarHBondContact CB-O 3.5Å; P1017-N1071 HydrophobicContact CG-CB 4.35Å; P1017-N1074 HydrophobicContact CG-CB 4.25Å; P1017-F1075 HydrophobicContact CB-CB 3.56Å; P1017-F1075 WeakPolarHBondContact O-CD2 3.48Å
1018	G	83.3	Confident	84.4	Confident	41 Å²	41	29.1 Å²	29.1	42%	0.423	16%	0.162	S	C	.	.	H	α-helix	trans	-62.5	-37.8	-177.7	0	0	0	0	0	113.4	G1016 A1021 S1022	G1016-G1018 VanDerWaalsContact C-N 3.3Å; G1016-G1018 PolarHBondContact O-N 3.01Å; G1018-A1021 PolarHBondContact O-N 3.38Å; G1018-S1022 PolarHBondContact O-N 2.96Å
1019	A	84.7	Confident	84.4	Confident	2 Å²	2	32.3 Å²	32.3	2%	0.017	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-47.7	179.3	0	0	0	0	0	111.9	Q979 L982 F1015 G1016 P1017 A1021 S1022 M1023	Q979-A1019 HydrophobicContact CG-CB 4.08Å; L982-A1019 HydrophobicContact CD2-CB 4.1Å; F1015-A1019 HydrophobicContact CB-CB 3.59Å; F1015-A1019 HydrophobicContact CG-CB 4.49Å; G1016-A1019 PolarHBondContact O-N 3.25Å; P1017-A1019 VanDerWaalsContact C-N 3.34Å; P1017-A1019 PolarHBondContact O-N 2.98Å; A1019-A1021 VanDerWaalsContact C-N 3.32Å; A1019-A1021 PolarHBondContact O-N 3.4Å; A1019-S1022 WeakPolarHBondContact O-CB 3.49Å; A1019-S1022 PolarHBondContact O-N 3.31Å; A1019-M1023 PolarHBondContact O-N 2.77Å
1020	I	88.5	Confident	84.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-36.9	176.8	-54.4	-53.4	0	0	0	111	V1008 H1011 Y1012 P1017 S1022 M1023 V1024 F1075	V1008-I1020 HydrophobicContact CG1-CG2 4.45Å; H1011-I1020 HydrophobicContact CB-CD1 3.57Å; Y1012-I1020 HydrophobicContact CD2-CB 4.34Å; Y1012-I1020 HydrophobicContact CD2-CG1 3.92Å; Y1012-I1020 HydrophobicContact CG-CG1 4.4Å; P1017-I1020 PolarHBondContact O-N 3.26Å; I1020-S1022 VanDerWaalsContact C-N 3.3Å; I1020-S1022 PolarHBondContact O-N 3.13Å; I1020-M1023 WeakPolarHBondContact O-CB 3.13Å; I1020-M1023 PolarHBondContact O-N 3.34Å; I1020-V1024 HydrophobicContact CG2-CG2 4.44Å; I1020-V1024 WeakPolarHBondContact O-CG2 3.41Å; I1020-V1024 PolarHBondContact O-N 2.9Å; I1020-F1075 HydrophobicContact CB-CD2 4.37Å; I1020-F1075 HydrophobicContact CB-CE2 3.93Å; I1020-F1075 HydrophobicContact CG2-CE2 3.66Å; I1020-F1075 HydrophobicContact CG2-CZ 4.22Å
1021	A	88.9	Confident	84.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-59.3	-43.9	174.3	0	0	0	0	0	110.9	P1017 G1018 A1019 M1023 V1024 L1025 F1075 A1078 I1079	P1017-A1021 WeakPolarHBondContact O-CB 3.49Å; P1017-A1021 PolarHBondContact O-N 3.46Å; G1018-A1021 PolarHBondContact O-N 3.38Å; A1019-A1021 VanDerWaalsContact C-N 3.32Å; A1019-A1021 PolarHBondContact O-N 3.4Å; A1021-M1023 PolarHBondContact O-N 2.76Å; A1021-V1024 PolarHBondContact O-N 3.47Å; A1021-L1025 WeakPolarHBondContact O-CB 3.07Å; A1021-L1025 WeakPolarHBondContact O-CG 3.19Å; A1021-L1025 PolarHBondContact O-N 2.89Å; A1021-F1075 HydrophobicContact CB-CD2 3.87Å; A1021-F1075 HydrophobicContact CB-CE2 4.15Å; A1021-A1078 HydrophobicContact CB-CB 3.84Å; A1021-I1079 HydrophobicContact CB-CD1 4.42Å; A1021-I1079 HydrophobicContact CB-CG1 3.89Å
1022	S	89.1	Confident	84.8	Confident	33 Å²	33	36 Å²	36	23%	0.231	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-45.1	173.8	-172.4	0	0	0	0	112.1	P983 G1018 A1019 I1020 V1024 L1025 H1026	P983-S1022 WeakPolarHBondContact CG-OG 3.44Å; G1018-S1022 PolarHBondContact O-N 2.96Å; A1019-S1022 WeakPolarHBondContact O-CB 3.49Å; A1019-S1022 PolarHBondContact O-N 3.31Å; I1020-S1022 VanDerWaalsContact C-N 3.3Å; I1020-S1022 PolarHBondContact O-N 3.13Å; S1022-V1024 PolarHBondContact O-N 3.01Å; S1022-L1025 PolarHBondContact O-N 3.2Å; S1022-H1026 WeakPolarHBondContact O-CB 3.44Å; S1022-H1026 PolarHBondContact O-N 2.89Å; S1022-H1026 PolarHBondContact O-ND1 2.92Å; S1022-H1026 PolarHBondContact OG-CE1 3.3Å; S1022-H1026 VanDerWaalsContact OG-CE1 3.31Å; S1022-H1026 PolarHBondContact OG-ND1 3.42Å; S1022-H1026 VanDerWaalsContact OG-ND1 3.13Å
1023	M	89.5	Confident	85.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-45.3	175.1	165.2	171.1	-168.9	0	0	112.4	L982 T986 I1007 V1008 A1019 I1020 A1021 S1027 I1036	L982-M1023 HydrophobicContact CD2-CB 4.2Å; L982-M1023 HydrophobicContact CG-CB 4.34Å; T986-M1023 HydrophobicContact CG2-CE 4.14Å; T986-M1023 HydrophobicContact CG2-CG 3.7Å; T986-M1023 VanDerWaalsContact OG1-CG 3.25Å; T986-M1023 WeakPolarHBondContact OG1-CG 3.45Å; I1007-M1023 HydrophobicContact CG2-CE 4.16Å; I1007-M1023 HydrophobicContact CG2-SD 3.84Å; V1008-M1023 HydrophobicContact CG2-CE 4.44Å; V1008-M1023 HydrophobicContact CG2-SD 4.49Å; A1019-M1023 PolarHBondContact O-N 2.77Å; I1020-M1023 WeakPolarHBondContact O-CB 3.13Å; I1020-M1023 PolarHBondContact O-N 3.34Å; A1021-M1023 PolarHBondContact O-N 2.76Å; M1023-S1027 PolarHBondContact O-N 3.49Å; M1023-S1027 PolarHBondContact O-OG 3.19Å; M1023-I1036 HydrophobicContact CE-CD1 3.63Å; M1023-I1036 HydrophobicContact CE-CG1 3.97Å; M1023-I1036 HydrophobicContact CE-CG2 4.3Å; M1023-I1036 HydrophobicContact CG-CD1 4.06Å; M1023-I1036 HydrophobicContact CG-CG2 4.37Å; M1023-I1036 HydrophobicContact SD-CG2 4.48Å
1024	V	89.9	Confident	85.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.1	-43.2	176.1	173.5	0	0	0	0	111.1	I1020 A1021 S1022 H1026 S1027 R1033 I1036 L1037 F1075 I1079	I1020-V1024 HydrophobicContact CG2-CG2 4.44Å; I1020-V1024 WeakPolarHBondContact O-CG2 3.41Å; I1020-V1024 PolarHBondContact O-N 2.9Å; A1021-V1024 PolarHBondContact O-N 3.47Å; S1022-V1024 PolarHBondContact O-N 3.01Å; V1024-H1026 PolarHBondContact O-N 2.95Å; V1024-S1027 WeakPolarHBondContact O-CB 3.5Å; V1024-S1027 PolarHBondContact O-N 3.01Å; V1024-S1027 PolarHBondContact O-OG 3.21Å; V1024-R1033 HydrophobicContact CG1-CG 3.69Å; V1024-R1033 PolarHBondContact O-NH1 3.33Å; V1024-I1036 HydrophobicContact CG2-CB 4.36Å; V1024-I1036 HydrophobicContact CG2-CG2 3.6Å; V1024-L1037 HydrophobicContact CG1-CD1 4.11Å; V1024-L1037 HydrophobicContact CG1-CD2 3.92Å; V1024-L1037 HydrophobicContact CG1-CG 3.84Å; V1024-L1037 HydrophobicContact CG2-CD2 4.11Å; V1024-L1037 HydrophobicContact CG2-CG 4.28Å; V1024-F1075 HydrophobicContact CG2-CE2 4.42Å; V1024-F1075 HydrophobicContact CG2-CZ 4.24Å; V1024-I1079 HydrophobicContact CB-CD1 4.04Å; V1024-I1079 HydrophobicContact CB-CG1 4.47Å; V1024-I1079 HydrophobicContact CG1-CD1 3.86Å; V1024-I1079 HydrophobicContact CG1-CG1 4.33Å; V1024-I1079 HydrophobicContact CG1-CG2 4.5Å; V1024-I1079 HydrophobicContact CG2-CD1 4.27Å
1025	L	88.5	Confident	86.2	Confident	41 Å²	41	29.8 Å²	29.8	22%	0.215	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-37.6	-178.9	-73.2	168.1	0	0	0	113	A1021 S1022 I1079 N1082	A1021-L1025 WeakPolarHBondContact O-CB 3.07Å; A1021-L1025 WeakPolarHBondContact O-CG 3.19Å; A1021-L1025 PolarHBondContact O-N 2.89Å; S1022-L1025 PolarHBondContact O-N 3.2Å; L1025-I1079 HydrophobicContact CD2-CG2 4.48Å; L1025-N1082 HydrophobicContact CD1-CB 3.6Å; L1025-N1082 HydrophobicContact CD2-CB 3.74Å; L1025-N1082 HydrophobicContact CG-CB 4.32Å
1026	H	86.8	Confident	86.8	Confident	78 Å²	78	28.5 Å²	28.5	36%	0.361	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	8	-177.7	-62.7	101.9	0	0	0	114.3	P983 R987 S1022 V1024	P983-H1026 HydrophobicContact CB-CB 3.79Å; R987-H1026 PolarHBondContact NH2-CD2 3.28Å; S1022-H1026 WeakPolarHBondContact O-CB 3.44Å; S1022-H1026 PolarHBondContact O-N 2.89Å; S1022-H1026 PolarHBondContact O-ND1 2.92Å; S1022-H1026 PolarHBondContact OG-CE1 3.3Å; S1022-H1026 VanDerWaalsContact OG-CE1 3.31Å; S1022-H1026 PolarHBondContact OG-ND1 3.42Å; S1022-H1026 VanDerWaalsContact OG-ND1 3.13Å; V1024-H1026 PolarHBondContact O-N 2.95Å
1027	S	89	Confident	87.4	Confident	17 Å²	17	27.7 Å²	27.7	12%	0.119	17%	0.165	C	C	.	.			trans	-62.7	128.3	175.9	-70.3	0	0	0	0	111	M1023 V1024 T1029 I1036	M1023-S1027 PolarHBondContact O-N 3.49Å; M1023-S1027 PolarHBondContact O-OG 3.19Å; V1024-S1027 WeakPolarHBondContact O-CB 3.5Å; V1024-S1027 PolarHBondContact O-N 3.01Å; V1024-S1027 PolarHBondContact O-OG 3.21Å; S1027-T1029 PolarHBondContact O-N 3.43Å; S1027-I1036 WeakPolarHBondContact OG-CD1 3.39Å
1028	P	85.4	Confident	87.7	Confident	75 Å²	75	29 Å²	29	49%	0.487	17%	0.17	S	C	.	.	S	Bend	trans	-75.2	-23.9	-170.1	27.7	-34.3	0	0	0	113.9	A990	A990-P1028 HydrophobicContact CB-CG 3.32Å
1029	T	86.4	Confident	87.8	Confident	71 Å²	71	28.9 Å²	28.9	44%	0.436	16%	0.158	S	C	.	.	S	Bend	trans	-126.6	147.4	178.6	67.4	0	0	0	0	111	S1027 D1031 F1032 R1033	S1027-T1029 PolarHBondContact O-N 3.43Å; T1029-D1031 VanDerWaalsContact C-N 3.25Å; T1029-D1031 PolarHBondContact O-N 2.74Å; T1029-F1032 PolarHBondContact O-N 3.38Å; T1029-F1032 VanDerWaalsContact OG1-CB 3.24Å; T1029-F1032 WeakPolarHBondContact OG1-CB 3.37Å; T1029-F1032 PolarHBondContact OG1-N 3.45Å; T1029-R1033 WeakPolarHBondContact O-CB 3.38Å; T1029-R1033 PolarHBondContact O-N 2.89Å
1030	L	83.4	Confident	88	Confident	73 Å²	73	29.1 Å²	29.1	38%	0.382	16%	0.159	S	C	.	.	H	α-helix	trans	-59.5	-38	178.4	-178	61.6	0	0	0	112.2	R1033 T1034 I1088 S1091	L1030-R1033 WeakPolarHBondContact O-CB 3.46Å; L1030-R1033 PolarHBondContact O-N 2.98Å; L1030-T1034 WeakPolarHBondContact O-CB 3.48Å; L1030-T1034 PolarHBondContact O-N 3.46Å; L1030-T1034 PolarHBondContact O-OG1 3.42Å; L1030-I1088 HydrophobicContact CD1-CB 4.19Å; L1030-I1088 HydrophobicContact CD1-CG1 3.8Å; L1030-I1088 HydrophobicContact CD1-CG2 4.06Å; L1030-S1091 WeakPolarHBondContact CD1-OG 3.25Å
1031	D	85.2	Confident	88	Confident	78 Å²	78	29.1 Å²	29.1	42%	0.417	16%	0.159	S	C	.	.	H	α-helix	trans	-68.8	-41.3	-179.4	-71.8	-24.2	0	0	0	112.2	W994 R995 T1029 T1034 H1035	W994-D1031 HydrophobicContact CH2-CB 4.23Å; W994-D1031 HydrophobicContact CZ2-CB 4.28Å; R995-D1031 IonicContact CZ-OD2 3.46Å; R995-D1031 IonicContact NH2-OD2 3.14Å; R995-D1031 PolarHBondContact NH2-OD2 3.24Å; T1029-D1031 VanDerWaalsContact C-N 3.25Å; T1029-D1031 PolarHBondContact O-N 2.74Å; D1031-T1034 PolarHBondContact O-N 3.29Å; D1031-H1035 WeakPolarHBondContact O-CB 3.48Å; D1031-H1035 PolarHBondContact O-N 2.98Å
1032	F	89.3	Confident	87.8	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-42.5	176.1	-173.7	-111.5	0	0	0	111.3	T986 I989 A990 W994 I1004 T1029 T1034 H1035 I1036	T986-F1032 HydrophobicContact CG2-CD1 4.49Å; T986-F1032 HydrophobicContact CG2-CE1 3.66Å; I989-F1032 HydrophobicContact CB-CZ 4.41Å; I989-F1032 HydrophobicContact CG2-CE2 4.36Å; I989-F1032 HydrophobicContact CG2-CZ 4.07Å; A990-F1032 HydrophobicContact CB-CD1 3.56Å; A990-F1032 HydrophobicContact CB-CD2 4.2Å; A990-F1032 HydrophobicContact CB-CE1 3.58Å; A990-F1032 HydrophobicContact CB-CE2 4.22Å; A990-F1032 HydrophobicContact CB-CG 3.87Å; A990-F1032 HydrophobicContact CB-CZ 3.92Å; W994-F1032 HydrophobicContact CB-CE2 4.37Å; W994-F1032 AromaticContact CD1-CD2 3.66Å; W994-F1032 AromaticContact CD1-CE2 3.9Å; W994-F1032 AromaticContact CD2-CD2 3.73Å; W994-F1032 HydrophobicContact CD2-CD2 3.73Å; W994-F1032 HydrophobicContact CD2-CE2 4.24Å; W994-F1032 AromaticContact CE2-CD2 3.57Å; W994-F1032 HydrophobicContact CE3-CD2 4.4Å; W994-F1032 AromaticContact CG-CD2 3.83Å; W994-F1032 HydrophobicContact CG-CD2 3.83Å; W994-F1032 AromaticContact CG-CE2 3.93Å; W994-F1032 HydrophobicContact CG-CE2 3.93Å; W994-F1032 HydrophobicContact CZ2-CB 3.98Å; W994-F1032 HydrophobicContact CZ2-CD2 4.1Å; W994-F1032 AromaticContact NE1-CD2 3.52Å; I1004-F1032 HydrophobicContact CD1-CE2 3.65Å; I1004-F1032 HydrophobicContact CD1-CZ 4.21Å; I1004-F1032 HydrophobicContact CG1-CE2 4.41Å; T1029-F1032 PolarHBondContact O-N 3.38Å; T1029-F1032 VanDerWaalsContact OG1-CB 3.24Å; T1029-F1032 WeakPolarHBondContact OG1-CB 3.37Å; T1029-F1032 PolarHBondContact OG1-N 3.45Å; F1032-T1034 VanDerWaalsContact C-N 3.33Å; F1032-T1034 PolarHBondContact O-N 2.99Å; F1032-H1035 WeakPolarHBondContact O-CB 3.27Å; F1032-H1035 PolarHBondContact O-N 3.27Å; F1032-H1035 VanDerWaalsContact O-N 3.11Å; F1032-I1036 HydrophobicContact CD1-CD1 3.69Å; F1032-I1036 HydrophobicContact CE1-CD1 3.42Å; F1032-I1036 VanDerWaalsContact CE1-CD1 3.42Å; F1032-I1036 HydrophobicContact CE1-CG1 4.33Å; F1032-I1036 HydrophobicContact CG-CD1 4.46Å; F1032-I1036 HydrophobicContact CZ-CD1 3.97Å; F1032-I1036 HydrophobicContact CZ-CG1 4.48Å; F1032-I1036 WeakPolarHBondContact O-CG1 2.99Å; F1032-I1036 PolarHBondContact O-N 3.35Å
1033	R	90.6	Very high	87.5	Confident	11 Å²	11	30.9 Å²	30.9	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-54.7	-49.4	172.4	-176.1	-171.8	179.4	107.9	-10.9	111.6	V1024 T1029 L1030 H1035 I1036 L1037 T1083 I1088 D1092	V1024-R1033 HydrophobicContact CG1-CG 3.69Å; V1024-R1033 PolarHBondContact O-NH1 3.33Å; T1029-R1033 WeakPolarHBondContact O-CB 3.38Å; T1029-R1033 PolarHBondContact O-N 2.89Å; L1030-R1033 WeakPolarHBondContact O-CB 3.46Å; L1030-R1033 PolarHBondContact O-N 2.98Å; R1033-H1035 VanDerWaalsContact C-N 3.25Å; R1033-H1035 PolarHBondContact O-N 3.46Å; R1033-I1036 PolarHBondContact O-N 3.4Å; R1033-L1037 HydrophobicContact CG-CD1 4.37Å; R1033-L1037 PolarHBondContact O-N 3.29Å; R1033-T1083 PolarHBondContact NH2-OG1 2.95Å; R1033-I1088 VanDerWaalsContact NE-CG2 3.32Å; R1033-D1092 IonicContact CZ-OD2 3.18Å; R1033-D1092 IonicContact NE-OD1 3.23Å; R1033-D1092 PolarHBondContact NE-OD1 2.87Å; R1033-D1092 IonicContact NE-OD2 2.87Å; R1033-D1092 PolarHBondContact NE-OD2 3.47Å; R1033-D1092 IonicContact NH2-OD2 2.65Å; R1033-D1092 PolarHBondContact NH2-OD2 3.42Å
1034	T	86.2	Confident	87.3	Confident	13 Å²	13	31.1 Å²	31.1	8%	0.08	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-39.2	178	-60.2	0	0	0	0	111.2	L1030 D1031 F1032 L1037 Q1038 F1095	L1030-T1034 WeakPolarHBondContact O-CB 3.48Å; L1030-T1034 PolarHBondContact O-N 3.46Å; L1030-T1034 PolarHBondContact O-OG1 3.42Å; D1031-T1034 PolarHBondContact O-N 3.29Å; F1032-T1034 VanDerWaalsContact C-N 3.33Å; F1032-T1034 PolarHBondContact O-N 2.99Å; T1034-L1037 PolarHBondContact O-N 3.36Å; T1034-Q1038 WeakPolarHBondContact O-CB 3.38Å; T1034-Q1038 VanDerWaalsContact O-CG 3.27Å; T1034-Q1038 WeakPolarHBondContact O-CG 3.2Å; T1034-Q1038 PolarHBondContact O-N 3.45Å; T1034-F1095 HydrophobicContact CG2-CE2 3.64Å; T1034-F1095 HydrophobicContact CG2-CZ 3.75Å
1035	H	87.8	Confident	86.9	Confident	29 Å²	29	31.5 Å²	31.5	13%	0.134	17%	0.166	C	C	.	.	H	α-helix	trans	-66.5	-42.2	178.5	-167.3	59.8	0	0	0	112.9	W994 D1031 F1032 R1033 Q1038 F1039	W994-H1035 HydrophobicContact CE3-CB 4.31Å; W994-H1035 AromaticContact CE3-CD2 3.48Å; W994-H1035 VanDerWaalsContact CE3-CD2 3.48Å; W994-H1035 AromaticContact CE3-CG 3.88Å; W994-H1035 AromaticContact CE3-NE2 3.87Å; W994-H1035 HydrophobicContact CH2-CB 4.04Å; W994-H1035 HydrophobicContact CZ3-CB 3.62Å; W994-H1035 AromaticContact CZ3-CD2 3.59Å; W994-H1035 AromaticContact CZ3-CG 3.46Å; W994-H1035 VanDerWaalsContact CZ3-CG 3.46Å; W994-H1035 AromaticContact CZ3-ND1 3.94Å; D1031-H1035 WeakPolarHBondContact O-CB 3.48Å; D1031-H1035 PolarHBondContact O-N 2.98Å; F1032-H1035 WeakPolarHBondContact O-CB 3.27Å; F1032-H1035 PolarHBondContact O-N 3.27Å; F1032-H1035 VanDerWaalsContact O-N 3.11Å; R1033-H1035 VanDerWaalsContact C-N 3.25Å; R1033-H1035 PolarHBondContact O-N 3.46Å; H1035-Q1038 WeakPolarHBondContact O-CB 3.29Å; H1035-Q1038 PolarHBondContact O-N 3.19Å; H1035-F1039 AromaticContact CD2-CE2 3.6Å; H1035-F1039 AromaticContact CE1-CE2 3.55Å; H1035-F1039 AromaticContact CE1-CZ 3.68Å; H1035-F1039 AromaticContact NE2-CE2 3.13Å; H1035-F1039 WeakPolarHBondContact NE2-CE2 3.37Å; H1035-F1039 AromaticContact NE2-CZ 3.58Å; H1035-F1039 WeakPolarHBondContact O-CD2 3.14Å; H1035-F1039 PolarHBondContact O-N 3.41Å
1036	I	90.4	Very high	86.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63	-46.1	174.7	-65.3	164.8	0	0	0	110.3	T986 I1004 V1008 M1023 V1024 S1027 F1032 R1033 Q1038 F1039 A1040	T986-I1036 HydrophobicContact CG2-CD1 4.09Å; I1004-I1036 HydrophobicContact CG2-CG1 4.15Å; V1008-I1036 HydrophobicContact CG2-CG2 3.82Å; M1023-I1036 HydrophobicContact CE-CD1 3.63Å; M1023-I1036 HydrophobicContact CE-CG1 3.97Å; M1023-I1036 HydrophobicContact CE-CG2 4.3Å; M1023-I1036 HydrophobicContact CG-CD1 4.06Å; M1023-I1036 HydrophobicContact CG-CG2 4.37Å; M1023-I1036 HydrophobicContact SD-CG2 4.48Å; V1024-I1036 HydrophobicContact CG2-CB 4.36Å; V1024-I1036 HydrophobicContact CG2-CG2 3.6Å; S1027-I1036 WeakPolarHBondContact OG-CD1 3.39Å; F1032-I1036 HydrophobicContact CD1-CD1 3.69Å; F1032-I1036 HydrophobicContact CE1-CD1 3.42Å; F1032-I1036 VanDerWaalsContact CE1-CD1 3.42Å; F1032-I1036 HydrophobicContact CE1-CG1 4.33Å; F1032-I1036 HydrophobicContact CG-CD1 4.46Å; F1032-I1036 HydrophobicContact CZ-CD1 3.97Å; F1032-I1036 HydrophobicContact CZ-CG1 4.48Å; F1032-I1036 WeakPolarHBondContact O-CG1 2.99Å; F1032-I1036 PolarHBondContact O-N 3.35Å; R1033-I1036 PolarHBondContact O-N 3.4Å; I1036-Q1038 VanDerWaalsContact C-N 3.31Å; I1036-Q1038 PolarHBondContact O-N 2.91Å; I1036-F1039 PolarHBondContact O-N 2.99Å; I1036-A1040 PolarHBondContact O-N 3.35Å
1037	L	90.3	Very high	86.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.9	-42	176.3	-79.3	174.4	0	0	0	112	V1024 R1033 T1034 F1039 A1040 T1041 F1075 I1079 D1092 F1095 L1096	V1024-L1037 HydrophobicContact CG1-CD1 4.11Å; V1024-L1037 HydrophobicContact CG1-CD2 3.92Å; V1024-L1037 HydrophobicContact CG1-CG 3.84Å; V1024-L1037 HydrophobicContact CG2-CD2 4.11Å; V1024-L1037 HydrophobicContact CG2-CG 4.28Å; R1033-L1037 HydrophobicContact CG-CD1 4.37Å; R1033-L1037 PolarHBondContact O-N 3.29Å; T1034-L1037 PolarHBondContact O-N 3.36Å; L1037-F1039 PolarHBondContact O-N 2.85Å; L1037-A1040 PolarHBondContact O-N 3.32Å; L1037-T1041 VanDerWaalsContact O-CB 3.29Å; L1037-T1041 WeakPolarHBondContact O-CB 3.4Å; L1037-T1041 PolarHBondContact O-N 3.45Å; L1037-T1041 PolarHBondContact O-OG1 3.17Å; L1037-F1075 HydrophobicContact CD2-CE1 4.17Å; L1037-F1075 HydrophobicContact CD2-CZ 3.98Å; L1037-I1079 HydrophobicContact CD2-CD1 3.98Å; L1037-D1092 HydrophobicContact CD1-CB 3.94Å; L1037-D1092 WeakPolarHBondContact CD1-OD1 3.42Å; L1037-F1095 HydrophobicContact CB-CB 4.04Å; L1037-F1095 HydrophobicContact CB-CD2 4.16Å; L1037-F1095 HydrophobicContact CB-CG 4.02Å; L1037-F1095 HydrophobicContact CD1-CD2 4.35Å; L1037-L1096 HydrophobicContact CD2-CD2 3.88Å
1038	Q	87.6	Confident	85.5	Confident	46 Å²	46	31.6 Å²	31.6	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-55.6	-49.7	174.5	-80.5	171.2	4.2	0	0	111.7	T1034 H1035 I1036 T1041 Y1042 F1095	T1034-Q1038 WeakPolarHBondContact O-CB 3.38Å; T1034-Q1038 VanDerWaalsContact O-CG 3.27Å; T1034-Q1038 WeakPolarHBondContact O-CG 3.2Å; T1034-Q1038 PolarHBondContact O-N 3.45Å; H1035-Q1038 WeakPolarHBondContact O-CB 3.29Å; H1035-Q1038 PolarHBondContact O-N 3.19Å; I1036-Q1038 VanDerWaalsContact C-N 3.31Å; I1036-Q1038 PolarHBondContact O-N 2.91Å; Q1038-T1041 PolarHBondContact O-N 3.46Å; Q1038-Y1042 HydrophobicContact CB-CD2 4.34Å; Q1038-Y1042 HydrophobicContact CB-CE2 3.86Å; Q1038-Y1042 HydrophobicContact CG-CE2 4.35Å; Q1038-Y1042 WeakPolarHBondContact O-CB 3.27Å; Q1038-Y1042 WeakPolarHBondContact O-CD2 3.36Å; Q1038-Y1042 PolarHBondContact O-N 3.33Å; Q1038-F1095 HydrophobicContact CB-CE1 4.33Å; Q1038-F1095 HydrophobicContact CG-CD1 4.02Å; Q1038-F1095 HydrophobicContact CG-CE1 3.25Å; Q1038-F1095 HydrophobicContact CG-CZ 3.63Å
1039	F	86.5	Confident	85	Confident	39 Å²	39	30.8 Å²	30.8	17%	0.171	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-47.6	178.1	-73.8	-51.9	0	0	0	112.4	I1004 K1005 V1008 H1035 I1036 L1037 T1041 Y1042 D1043	I1004-F1039 HydrophobicContact CG2-CD2 4.01Å; I1004-F1039 HydrophobicContact CG2-CE2 4.15Å; K1005-F1039 HydrophobicContact CB-CD1 4.36Å; K1005-F1039 HydrophobicContact CB-CE1 4.33Å; K1005-F1039 HydrophobicContact CB-CE2 4.49Å; K1005-F1039 HydrophobicContact CB-CG 4.5Å; K1005-F1039 HydrophobicContact CB-CZ 4.39Å; K1005-F1039 HydrophobicContact CD-CE1 4.42Å; K1005-F1039 HydrophobicContact CG-CD1 4.19Å; K1005-F1039 HydrophobicContact CG-CE1 4.41Å; V1008-F1039 HydrophobicContact CG1-CB 4.48Å; H1035-F1039 AromaticContact CD2-CE2 3.6Å; H1035-F1039 AromaticContact CE1-CE2 3.55Å; H1035-F1039 AromaticContact CE1-CZ 3.68Å; H1035-F1039 AromaticContact NE2-CE2 3.13Å; H1035-F1039 WeakPolarHBondContact NE2-CE2 3.37Å; H1035-F1039 AromaticContact NE2-CZ 3.58Å; H1035-F1039 WeakPolarHBondContact O-CD2 3.14Å; H1035-F1039 PolarHBondContact O-N 3.41Å; I1036-F1039 PolarHBondContact O-N 2.99Å; L1037-F1039 PolarHBondContact O-N 2.85Å; F1039-T1041 VanDerWaalsContact C-N 3.32Å; F1039-T1041 PolarHBondContact O-N 3.39Å; F1039-Y1042 PolarHBondContact O-N 2.97Å; F1039-D1043 PolarHBondContact O-N 3.49Å
1040	A	88.7	Confident	84.5	Confident	6 Å²	6	32.6 Å²	32.6	5%	0.05	16%	0.163	C	C	.	.	H	α-helix	trans	-58.5	-45.4	178.8	0	0	0	0	0	111.5	V1008 I1036 L1037 Q1044 W1072 F1075	V1008-A1040 HydrophobicContact CG1-CB 3.83Å; I1036-A1040 PolarHBondContact O-N 3.35Å; L1037-A1040 PolarHBondContact O-N 3.32Å; A1040-Q1044 VanDerWaalsContact O-CB 3.31Å; A1040-Q1044 WeakPolarHBondContact O-CB 3.47Å; A1040-Q1044 PolarHBondContact O-N 3.42Å; A1040-W1072 HydrophobicContact CB-CH2 4.22Å; A1040-W1072 HydrophobicContact CB-CZ3 4.16Å; A1040-W1072 WeakPolarHBondContact O-CZ3 3.47Å; A1040-F1075 HydrophobicContact CB-CZ 4.26Å
1041	T	88.5	Confident	84	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.6	-41.8	178	-62.9	0	0	0	0	111.8	L1037 Q1038 F1039 Q1044 I1045 W1072 F1095 P1099 L1151	L1037-T1041 VanDerWaalsContact O-CB 3.29Å; L1037-T1041 WeakPolarHBondContact O-CB 3.4Å; L1037-T1041 PolarHBondContact O-N 3.45Å; L1037-T1041 PolarHBondContact O-OG1 3.17Å; Q1038-T1041 PolarHBondContact O-N 3.46Å; F1039-T1041 VanDerWaalsContact C-N 3.32Å; F1039-T1041 PolarHBondContact O-N 3.39Å; T1041-Q1044 PolarHBondContact O-N 2.75Å; T1041-I1045 HydrophobicContact CG2-CD1 3.72Å; T1041-I1045 HydrophobicContact CG2-CG1 4.32Å; T1041-I1045 WeakPolarHBondContact O-CB 3.31Å; T1041-I1045 VanDerWaalsContact O-CG1 3.22Å; T1041-I1045 WeakPolarHBondContact O-CG1 3.42Å; T1041-I1045 PolarHBondContact O-N 3.39Å; T1041-W1072 WeakPolarHBondContact OG1-CH2 3.41Å; T1041-F1095 WeakPolarHBondContact CG2-O 3.08Å; T1041-F1095 WeakPolarHBondContact OG1-CB 3.48Å; T1041-F1095 PolarHBondContact OG1-O 3.38Å; T1041-P1099 HydrophobicContact CG2-CG 3.94Å; T1041-L1151 HydrophobicContact CG2-CD2 3.72Å
1042	Y	85.3	Confident	83.2	Confident	44 Å²	44	29.4 Å²	29.4	17%	0.173	14%	0.143	C	C	.	.	H	α-helix	trans	-67.6	-42	179.8	-65.7	-32.8	0	0	0	112.8	Q1038 F1039 Q1044 I1045 T1046 L1151 K1154	Q1038-Y1042 HydrophobicContact CB-CD2 4.34Å; Q1038-Y1042 HydrophobicContact CB-CE2 3.86Å; Q1038-Y1042 HydrophobicContact CG-CE2 4.35Å; Q1038-Y1042 WeakPolarHBondContact O-CB 3.27Å; Q1038-Y1042 WeakPolarHBondContact O-CD2 3.36Å; Q1038-Y1042 PolarHBondContact O-N 3.33Å; F1039-Y1042 PolarHBondContact O-N 2.97Å; Y1042-Q1044 VanDerWaalsContact C-N 3.32Å; Y1042-I1045 HydrophobicContact CD1-CD1 4.47Å; Y1042-I1045 PolarHBondContact O-N 3.23Å; Y1042-T1046 WeakPolarHBondContact O-CB 3.37Å; Y1042-T1046 PolarHBondContact O-N 3.01Å; Y1042-T1046 PolarHBondContact O-OG1 3.37Å; Y1042-L1151 HydrophobicContact CD1-CD2 4.3Å; Y1042-L1151 HydrophobicContact CE1-CD2 3.63Å; Y1042-K1154 HydrophobicContact CD1-CD 3.56Å; Y1042-K1154 HydrophobicContact CE1-CD 3.16Å; Y1042-K1154 HydrophobicContact CE1-CG 4.42Å; Y1042-K1154 HydrophobicContact CE2-CD 4.27Å; Y1042-K1154 HydrophobicContact CG-CD 4.28Å
1043	D	81.9	Confident	82.2	Confident	28 Å²	28	35.1 Å²	35.1	15%	0.15	18%	0.177	C	C	.	.	H	α-helix	trans	-63	-42.5	174.4	-82.5	9.3	0	0	0	110.1	K1009 F1039 I1045 T1046 Y1047	K1009-D1043 WeakPolarHBondContact CB-OD2 3.16Å; F1039-D1043 PolarHBondContact O-N 3.49Å; D1043-I1045 PolarHBondContact O-N 3.16Å; D1043-T1046 WeakPolarHBondContact O-CB 3.4Å; D1043-T1046 PolarHBondContact O-N 2.9Å; D1043-T1046 VanDerWaalsContact O-N 3.16Å; D1043-Y1047 WeakPolarHBondContact O-CD2 3.02Å; D1043-Y1047 PolarHBondContact O-N 2.95Å
1044	Q	84.8	Confident	80.9	Confident	5 Å²	5	37.8 Å²	37.8	2%	0.023	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-42.6	176.9	-173	70.6	10.2	0	0	113.3	A1040 T1041 Y1042 T1046 Y1047 L1048 I1068 W1072 P1099	A1040-Q1044 VanDerWaalsContact O-CB 3.31Å; A1040-Q1044 WeakPolarHBondContact O-CB 3.47Å; A1040-Q1044 PolarHBondContact O-N 3.42Å; T1041-Q1044 PolarHBondContact O-N 2.75Å; Y1042-Q1044 VanDerWaalsContact C-N 3.32Å; Q1044-T1046 PolarHBondContact O-N 2.81Å; Q1044-Y1047 PolarHBondContact O-N 2.84Å; Q1044-L1048 HydrophobicContact CG-CD1 4.28Å; Q1044-L1048 WeakPolarHBondContact O-CB 3.19Å; Q1044-L1048 WeakPolarHBondContact O-CG 3.39Å; Q1044-L1048 PolarHBondContact O-N 2.98Å; Q1044-I1068 PolarHBondContact NE2-O 3.14Å; Q1044-W1072 HydrophobicContact CB-CD2 4.29Å; Q1044-W1072 HydrophobicContact CB-CE3 3.62Å; Q1044-W1072 HydrophobicContact CB-CH2 4.32Å; Q1044-W1072 HydrophobicContact CB-CZ3 3.63Å; Q1044-W1072 HydrophobicContact CG-CB 4.34Å; Q1044-W1072 HydrophobicContact CG-CD2 3.69Å; Q1044-W1072 HydrophobicContact CG-CE3 3.4Å; Q1044-W1072 VanDerWaalsContact CG-CE3 3.4Å; Q1044-W1072 HydrophobicContact CG-CG 4.08Å; Q1044-W1072 HydrophobicContact CG-CZ3 3.96Å; Q1044-P1099 HydrophobicContact CB-CG 4.37Å; Q1044-P1099 HydrophobicContact CG-CB 3.76Å; Q1044-P1099 HydrophobicContact CG-CG 4.1Å
1045	I	82	Confident	79.5	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-41.4	174.4	-71.9	165.1	0	0	0	109.7	T1041 Y1042 D1043 L1048 T1049 P1099 L1102 L1151 T1155	T1041-I1045 HydrophobicContact CG2-CD1 3.72Å; T1041-I1045 HydrophobicContact CG2-CG1 4.32Å; T1041-I1045 WeakPolarHBondContact O-CB 3.31Å; T1041-I1045 VanDerWaalsContact O-CG1 3.22Å; T1041-I1045 WeakPolarHBondContact O-CG1 3.42Å; T1041-I1045 PolarHBondContact O-N 3.39Å; Y1042-I1045 HydrophobicContact CD1-CD1 4.47Å; Y1042-I1045 PolarHBondContact O-N 3.23Å; D1043-I1045 PolarHBondContact O-N 3.16Å; I1045-L1048 PolarHBondContact O-N 2.82Å; I1045-T1049 WeakPolarHBondContact O-CB 3.18Å; I1045-T1049 PolarHBondContact O-N 3.44Å; I1045-T1049 PolarHBondContact O-OG1 3.35Å; I1045-P1099 HydrophobicContact CG1-CG 4.42Å; I1045-L1102 HydrophobicContact CG1-CD2 4.41Å; I1045-L1102 HydrophobicContact CG2-CD2 4.26Å; I1045-L1151 HydrophobicContact CD1-CD2 4.29Å; I1045-T1155 HydrophobicContact CD1-CG2 3.9Å; I1045-T1155 HydrophobicContact CG1-CG2 4.35Å; I1045-T1155 HydrophobicContact CG2-CG2 4.3Å
1046	T	79.8	Confident	78.3	Confident	64 Å²	64	44.8 Å²	44.8	39%	0.393	24%	0.239	S	C	.	.	H	α-helix	trans	-61.9	-49.9	177.8	-53.4	0	0	0	0	110.3	Y1042 D1043 Q1044 L1048 T1049 E1050	Y1042-T1046 WeakPolarHBondContact O-CB 3.37Å; Y1042-T1046 PolarHBondContact O-N 3.01Å; Y1042-T1046 PolarHBondContact O-OG1 3.37Å; D1043-T1046 WeakPolarHBondContact O-CB 3.4Å; D1043-T1046 PolarHBondContact O-N 2.9Å; D1043-T1046 VanDerWaalsContact O-N 3.16Å; Q1044-T1046 PolarHBondContact O-N 2.81Å; T1046-L1048 PolarHBondContact O-N 2.87Å; T1046-T1049 PolarHBondContact O-N 2.65Å; T1046-T1049 VanDerWaalsContact O-N 3.14Å; T1046-E1050 HydrophobicContact CG2-CG 4.25Å; T1046-E1050 WeakPolarHBondContact CG2-OE1 3.37Å; T1046-E1050 WeakPolarHBondContact O-CB 3.22Å; T1046-E1050 WeakPolarHBondContact O-CG 3.36Å; T1046-E1050 PolarHBondContact O-N 3.23Å
1047	Y	78.5	Confident	76.9	Confident	69 Å²	69	47.6 Å²	47.6	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-58.2	-44.6	175.8	-77.3	-60.6	0	0	0	113.1	D1043 Q1044 T1049 S1051	D1043-Y1047 WeakPolarHBondContact O-CD2 3.02Å; D1043-Y1047 PolarHBondContact O-N 2.95Å; Q1044-Y1047 PolarHBondContact O-N 2.84Å; Y1047-T1049 VanDerWaalsContact C-N 3.33Å; Y1047-T1049 PolarHBondContact O-N 3.33Å; Y1047-S1051 VanDerWaalsContact O-CB 3.24Å; Y1047-S1051 WeakPolarHBondContact O-CB 3.34Å; Y1047-S1051 PolarHBondContact O-N 3.49Å
1048	L	76.9	Confident	75.6	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-38.2	176.9	-75.6	171.1	0	0	0	111.9	Q1044 I1045 T1046 S1051 I1068 P1099 L1102	Q1044-L1048 HydrophobicContact CG-CD1 4.28Å; Q1044-L1048 WeakPolarHBondContact O-CB 3.19Å; Q1044-L1048 WeakPolarHBondContact O-CG 3.39Å; Q1044-L1048 PolarHBondContact O-N 2.98Å; I1045-L1048 PolarHBondContact O-N 2.82Å; T1046-L1048 PolarHBondContact O-N 2.87Å; L1048-S1051 PolarHBondContact O-OG 3.41Å; L1048-I1068 HydrophobicContact CD2-CG2 3.62Å; L1048-I1068 HydrophobicContact CG-CG2 3.92Å; L1048-P1099 HydrophobicContact CD1-CB 3.92Å; L1048-L1102 HydrophobicContact CB-CD2 4.28Å; L1048-L1102 HydrophobicContact CD1-CD2 4.28Å
1049	T	75.5	Confident	74.3	Confident	59 Å²	59	52.3 Å²	52.3	36%	0.362	30%	0.302	S	S	.	.	H	α-helix	trans	-73.3	-45	-179.7	-52.6	0	0	0	0	111.3	I1045 T1046 Y1047 S1051 K1052	I1045-T1049 WeakPolarHBondContact O-CB 3.18Å; I1045-T1049 PolarHBondContact O-N 3.44Å; I1045-T1049 PolarHBondContact O-OG1 3.35Å; T1046-T1049 PolarHBondContact O-N 2.65Å; T1046-T1049 VanDerWaalsContact O-N 3.14Å; Y1047-T1049 VanDerWaalsContact C-N 3.33Å; Y1047-T1049 PolarHBondContact O-N 3.33Å; T1049-S1051 VanDerWaalsContact C-N 3.3Å; T1049-S1051 PolarHBondContact O-N 3.07Å; T1049-K1052 WeakPolarHBondContact O-CB 3.39Å; T1049-K1052 PolarHBondContact O-N 3.4Å; T1049-K1052 VanDerWaalsContact O-N 3.13Å
1050	E	75.2	Confident	73.3	Confident	108 Å²	108	56 Å²	56	51%	0.505	32%	0.32	S	S	.	.	H	α-helix	trans	-63.6	-35.9	176	-72.4	178.7	175.6	0	0	111.7	T1046 K1052 V1053 L1054	T1046-E1050 HydrophobicContact CG2-CG 4.25Å; T1046-E1050 WeakPolarHBondContact CG2-OE1 3.37Å; T1046-E1050 WeakPolarHBondContact O-CB 3.22Å; T1046-E1050 WeakPolarHBondContact O-CG 3.36Å; T1046-E1050 PolarHBondContact O-N 3.23Å; E1050-K1052 PolarHBondContact O-N 3.02Å; E1050-K1052 VanDerWaalsContact O-N 3.12Å; E1050-V1053 PolarHBondContact O-N 3.31Å; E1050-L1054 PolarHBondContact O-N 2.93Å; E1050-L1054 VanDerWaalsContact O-N 3.14Å
1051	S	72.4	Confident	72.2	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-23.8	175	79.8	0	0	0	0	113.5	Y1047 L1048 T1049 V1053 Q1061 Q1065	Y1047-S1051 VanDerWaalsContact O-CB 3.24Å; Y1047-S1051 WeakPolarHBondContact O-CB 3.34Å; Y1047-S1051 PolarHBondContact O-N 3.49Å; L1048-S1051 PolarHBondContact O-OG 3.41Å; T1049-S1051 VanDerWaalsContact C-N 3.3Å; T1049-S1051 PolarHBondContact O-N 3.07Å; S1051-V1053 VanDerWaalsContact C-N 3.3Å; S1051-Q1061 PolarHBondContact O-NE2 3.45Å; S1051-Q1065 PolarHBondContact O-NE2 3.21Å; S1051-Q1065 VanDerWaalsContact OG-CG 3.26Å; S1051-Q1065 WeakPolarHBondContact OG-CG 3.46Å; S1051-Q1065 PolarHBondContact OG-NE2 3.29Å
1052	K	68.8	Low	71.3	Confident	85 Å²	85	61.2 Å²	61.2	37%	0.37	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-22.4	174.5	-64	-177.6	-179.7	-178.7	0	112.4	T1049 E1050 D1157	T1049-K1052 WeakPolarHBondContact O-CB 3.39Å; T1049-K1052 PolarHBondContact O-N 3.4Å; T1049-K1052 VanDerWaalsContact O-N 3.13Å; E1050-K1052 PolarHBondContact O-N 3.02Å; E1050-K1052 VanDerWaalsContact O-N 3.12Å; K1052-D1157 IonicContact NZ-OD2 3.01Å; K1052-D1157 PolarHBondContact NZ-OD2 3Å
1053	V	68.5	Low	70.4	Confident	119 Å²	119	62.8 Å²	62.8	72%	0.721	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-11.7	-172.3	-167.6	0	0	0	0	112.3	E1050 S1051	E1050-V1053 PolarHBondContact O-N 3.31Å; S1051-V1053 VanDerWaalsContact C-N 3.3Å
1054	L	63.3	Low	69.9	Low	67 Å²	67	66 Å²	66	35%	0.351	37%	0.37	S	S	.	.			trans	-60.6	123.3	-177.5	-106.4	142.3	0	0	0	112	E1050 V1056 Y1064	E1050-L1054 PolarHBondContact O-N 2.93Å; E1050-L1054 VanDerWaalsContact O-N 3.14Å; L1054-V1056 HydrophobicContact CB-CG2 3.99Å; L1054-V1056 HydrophobicContact CD2-CG2 3.56Å; L1054-V1056 HydrophobicContact CG-CG2 4.41Å; L1054-V1056 PolarHBondContact O-N 3.05Å; L1054-Y1064 HydrophobicContact CD1-CD1 4.3Å; L1054-Y1064 HydrophobicContact CD1-CE1 3.78Å
1055	P	57.9	Low	69.3	Low	132 Å²	132	66.4 Å²	66.4	86%	0.857	37%	0.372	S	S	*	.			trans	-82.3	66.8	-178	34.5	-35.2	0	0	0	110.9
1056	V	61.3	Low	68.9	Low	57 Å²	57	67.3 Å²	67.3	35%	0.345	38%	0.376	S	S	.	.	S	Bend	trans	-122.2	159.7	-175.7	-158.4	0	0	0	0	109.4	L1054 E1060	L1054-V1056 HydrophobicContact CB-CG2 3.99Å; L1054-V1056 HydrophobicContact CD2-CG2 3.56Å; L1054-V1056 HydrophobicContact CG-CG2 4.41Å; L1054-V1056 PolarHBondContact O-N 3.05Å; V1056-E1060 HydrophobicContact CB-CB 4.43Å; V1056-E1060 HydrophobicContact CG1-CB 3.47Å; V1056-E1060 VanDerWaalsContact CG1-CB 3.47Å; V1056-E1060 HydrophobicContact CG1-CG 4.19Å; V1056-E1060 WeakPolarHBondContact CG1-OE2 3.38Å
1057	S	60.4	Low	68.7	Low	60 Å²	60	68.2 Å²	68.2	42%	0.42	38%	0.378	S	S	.	.			trans	-55.7	143.5	175	78	0	0	0	0	110.7	C1059 E1060 Q1061	S1057-C1059 PolarHBondContact O-N 3.33Å; S1057-C1059 VanDerWaalsContact O-N 3.14Å; S1057-E1060 PolarHBondContact O-N 2.92Å; S1057-E1060 VanDerWaalsContact OG-CD 3.23Å; S1057-E1060 WeakPolarHBondContact OG-CG 3.48Å; S1057-E1060 PolarHBondContact OG-OE1 3.45Å; S1057-Q1061 PolarHBondContact O-N 3.18Å
1058	G	64	Low	68.7	Low	44 Å²	44	65.8 Å²	65.8	45%	0.454	37%	0.37	S	S	.	.	H	α-helix	trans	-56.2	-34.8	-173.9	0	0	0	0	0	114	I1062	G1058-I1062 WeakPolarHBondContact O-CD1 3.3Å; G1058-I1062 VanDerWaalsContact O-CG1 3.25Å; G1058-I1062 WeakPolarHBondContact O-CG1 3.48Å; G1058-I1062 PolarHBondContact O-N 3.42Å; G1058-I1062 VanDerWaalsContact O-N 3.07Å
1059	C	61.2	Low	68.9	Low	100 Å²	100	65.6 Å²	65.6	68%	0.676	37%	0.369	S	S	*	.	H	α-helix	trans	-66.4	-42.5	174.4	-86	0	0	0	0	112.9	S1057 I1062 T1063	S1057-C1059 PolarHBondContact O-N 3.33Å; S1057-C1059 VanDerWaalsContact O-N 3.14Å; C1059-I1062 PolarHBondContact O-N 3.35Å; C1059-T1063 WeakPolarHBondContact O-CB 3.49Å; C1059-T1063 PolarHBondContact O-N 3.31Å; C1059-T1063 PolarHBondContact O-OG1 3.15Å
1060	E	64.1	Low	69.3	Low	116 Å²	116	63.6 Å²	63.6	54%	0.542	36%	0.357	S	S	.	.	H	α-helix	trans	-66.5	-40	177.4	-77.5	165.4	-119.3	0	0	111.1	V1056 S1057 T1063 Y1064	V1056-E1060 HydrophobicContact CB-CB 4.43Å; V1056-E1060 HydrophobicContact CG1-CB 3.47Å; V1056-E1060 VanDerWaalsContact CG1-CB 3.47Å; V1056-E1060 HydrophobicContact CG1-CG 4.19Å; V1056-E1060 WeakPolarHBondContact CG1-OE2 3.38Å; S1057-E1060 PolarHBondContact O-N 2.92Å; S1057-E1060 VanDerWaalsContact OG-CD 3.23Å; S1057-E1060 WeakPolarHBondContact OG-CG 3.48Å; S1057-E1060 PolarHBondContact OG-OE1 3.45Å; E1060-T1063 PolarHBondContact O-N 3.34Å; E1060-Y1064 VanDerWaalsContact O-CB 3.22Å; E1060-Y1064 WeakPolarHBondContact O-CB 3.48Å; E1060-Y1064 PolarHBondContact O-N 3.16Å
1061	Q	66.3	Low	69.7	Low	50 Å²	50	61.6 Å²	61.6	23%	0.234	35%	0.35	C	S	.	.	H	α-helix	trans	-60.6	-47.3	175.8	-169.9	-178.5	16.1	0	0	111.7	S1051 S1057 T1063 Y1064 Q1065	S1051-Q1061 PolarHBondContact O-NE2 3.45Å; S1057-Q1061 PolarHBondContact O-N 3.18Å; Q1061-T1063 PolarHBondContact O-N 3.19Å; Q1061-Y1064 PolarHBondContact O-N 2.86Å; Q1061-Q1065 WeakPolarHBondContact O-CB 3.18Å; Q1061-Q1065 VanDerWaalsContact O-CG 3.29Å; Q1061-Q1065 WeakPolarHBondContact O-CG 3.42Å; Q1061-Q1065 PolarHBondContact O-N 3.35Å
1062	I	68.4	Low	70.4	Confident	67 Å²	67	61.6 Å²	61.6	34%	0.344	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-43.5	177.1	-67.6	165.4	0	0	0	110.7	G1058 C1059 Q1065 H1066	G1058-I1062 WeakPolarHBondContact O-CD1 3.3Å; G1058-I1062 VanDerWaalsContact O-CG1 3.25Å; G1058-I1062 WeakPolarHBondContact O-CG1 3.48Å; G1058-I1062 PolarHBondContact O-N 3.42Å; G1058-I1062 VanDerWaalsContact O-N 3.07Å; C1059-I1062 PolarHBondContact O-N 3.35Å; I1062-Q1065 PolarHBondContact O-N 3.01Å; I1062-H1066 WeakPolarHBondContact O-CB 3.4Å; I1062-H1066 PolarHBondContact O-N 3.45Å
1063	T	68.1	Low	71.3	Confident	77 Å²	77	57.6 Å²	57.6	47%	0.472	33%	0.332	S	S	.	.	H	α-helix	trans	-64.8	-42.1	179.6	-52.6	0	0	0	0	111.4	C1059 E1060 Q1061 H1066 N1067	C1059-T1063 WeakPolarHBondContact O-CB 3.49Å; C1059-T1063 PolarHBondContact O-N 3.31Å; C1059-T1063 PolarHBondContact O-OG1 3.15Å; E1060-T1063 PolarHBondContact O-N 3.34Å; Q1061-T1063 PolarHBondContact O-N 3.19Å; T1063-H1066 WeakPolarHBondContact O-CB 3.45Å; T1063-H1066 PolarHBondContact O-N 3.44Å; T1063-N1067 VanDerWaalsContact O-CG 3.28Å; T1063-N1067 PolarHBondContact O-N 2.92Å
1064	Y	69.8	Low	72.2	Confident	96 Å²	96	55 Å²	55	38%	0.376	32%	0.315	S	S	.	.	H	α-helix	trans	-62.6	-49.3	176.4	-179	-110.8	0	0	0	111.7	L1054 E1060 Q1061 H1066 N1067 I1068	L1054-Y1064 HydrophobicContact CD1-CD1 4.3Å; L1054-Y1064 HydrophobicContact CD1-CE1 3.78Å; E1060-Y1064 VanDerWaalsContact O-CB 3.22Å; E1060-Y1064 WeakPolarHBondContact O-CB 3.48Å; E1060-Y1064 PolarHBondContact O-N 3.16Å; Q1061-Y1064 PolarHBondContact O-N 2.86Å; Y1064-H1066 VanDerWaalsContact C-N 3.35Å; Y1064-H1066 PolarHBondContact O-N 2.97Å; Y1064-N1067 PolarHBondContact O-N 3.34Å; Y1064-I1068 HydrophobicContact CD1-CD1 3.62Å; Y1064-I1068 HydrophobicContact CD2-CD1 4.42Å; Y1064-I1068 HydrophobicContact CE1-CD1 3.24Å; Y1064-I1068 HydrophobicContact CE1-CG1 4.45Å; Y1064-I1068 HydrophobicContact CE2-CD1 4.1Å; Y1064-I1068 HydrophobicContact CG-CD1 4.2Å; Y1064-I1068 WeakPolarHBondContact O-CG1 3.46Å; Y1064-I1068 PolarHBondContact O-N 2.7Å
1065	Q	72.6	Confident	73.5	Confident	13 Å²	13	51.8 Å²	51.8	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-41.3	175.8	-75.8	-179.5	-16.8	0	0	112.2	S1051 Q1061 I1062 N1067 I1068 L1069 L1109	S1051-Q1065 PolarHBondContact O-NE2 3.21Å; S1051-Q1065 VanDerWaalsContact OG-CG 3.26Å; S1051-Q1065 WeakPolarHBondContact OG-CG 3.46Å; S1051-Q1065 PolarHBondContact OG-NE2 3.29Å; Q1061-Q1065 WeakPolarHBondContact O-CB 3.18Å; Q1061-Q1065 VanDerWaalsContact O-CG 3.29Å; Q1061-Q1065 WeakPolarHBondContact O-CG 3.42Å; Q1061-Q1065 PolarHBondContact O-N 3.35Å; I1062-Q1065 PolarHBondContact O-N 3.01Å; Q1065-N1067 PolarHBondContact O-N 3.31Å; Q1065-I1068 PolarHBondContact O-N 2.88Å; Q1065-L1069 PolarHBondContact O-N 3.4Å; Q1065-L1109 HydrophobicContact CB-CD1 3.43Å; Q1065-L1109 VanDerWaalsContact CB-CD1 3.43Å; Q1065-L1109 HydrophobicContact CB-CD2 3.92Å; Q1065-L1109 HydrophobicContact CB-CG 4.14Å; Q1065-L1109 HydrophobicContact CG-CD1 4.29Å
1066	H	74.2	Confident	75	Confident	27 Å²	27	45.5 Å²	45.5	13%	0.125	26%	0.257	C	S	.	.	H	α-helix	trans	-57.3	-47.4	174.9	170.3	-89.6	0	0	0	111.5	I1062 T1063 Y1064 L1069 S1070 A1112 L1113	I1062-H1066 WeakPolarHBondContact O-CB 3.4Å; I1062-H1066 PolarHBondContact O-N 3.45Å; T1063-H1066 WeakPolarHBondContact O-CB 3.45Å; T1063-H1066 PolarHBondContact O-N 3.44Å; Y1064-H1066 VanDerWaalsContact C-N 3.35Å; Y1064-H1066 PolarHBondContact O-N 2.97Å; H1066-L1069 PolarHBondContact O-N 2.92Å; H1066-S1070 VanDerWaalsContact O-CB 3.3Å; H1066-S1070 WeakPolarHBondContact O-CB 3.29Å; H1066-S1070 PolarHBondContact O-N 2.92Å; H1066-A1112 PolarHBondContact CD2-O 3.43Å; H1066-A1112 VanDerWaalsContact CD2-O 3.23Å; H1066-A1112 PolarHBondContact NE2-O 3.23Å; H1066-A1112 VanDerWaalsContact NE2-O 3.11Å; H1066-L1113 WeakPolarHBondContact NE2-CA 3.31Å
1067	N	76.1	Confident	76.4	Confident	82 Å²	82	46.3 Å²	46.3	44%	0.439	26%	0.255	S	S	.	.	H	α-helix	trans	-64.8	-42.9	179.3	-70.4	-10.5	0	0	0	111.8	T1063 Y1064 Q1065 L1069 S1070 N1071	T1063-N1067 VanDerWaalsContact O-CG 3.28Å; T1063-N1067 PolarHBondContact O-N 2.92Å; Y1064-N1067 PolarHBondContact O-N 3.34Å; Q1065-N1067 PolarHBondContact O-N 3.31Å; N1067-L1069 VanDerWaalsContact C-N 3.34Å; N1067-L1069 PolarHBondContact O-N 3.04Å; N1067-S1070 PolarHBondContact O-N 3.48Å; N1067-N1071 WeakPolarHBondContact O-CB 3.22Å; N1067-N1071 VanDerWaalsContact O-CG 3.23Å; N1067-N1071 PolarHBondContact O-N 3.46Å; N1067-N1071 PolarHBondContact O-ND2 2.92Å
1068	I	78.6	Confident	77.8	Confident	18 Å²	18	44.7 Å²	44.7	9%	0.092	24%	0.244	C	C	.	.	H	α-helix	trans	-56.7	-47.8	174.8	-74	170.3	0	0	0	110.9	Q1044 L1048 Y1064 Q1065 W1072	Q1044-I1068 PolarHBondContact NE2-O 3.14Å; L1048-I1068 HydrophobicContact CD2-CG2 3.62Å; L1048-I1068 HydrophobicContact CG-CG2 3.92Å; Y1064-I1068 HydrophobicContact CD1-CD1 3.62Å; Y1064-I1068 HydrophobicContact CD2-CD1 4.42Å; Y1064-I1068 HydrophobicContact CE1-CD1 3.24Å; Y1064-I1068 HydrophobicContact CE1-CG1 4.45Å; Y1064-I1068 HydrophobicContact CE2-CD1 4.1Å; Y1064-I1068 HydrophobicContact CG-CD1 4.2Å; Y1064-I1068 WeakPolarHBondContact O-CG1 3.46Å; Y1064-I1068 PolarHBondContact O-N 2.7Å; Q1065-I1068 PolarHBondContact O-N 2.88Å; I1068-W1072 PolarHBondContact O-N 3.43Å
1069	L	81.4	Confident	79.1	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-70.9	-44.5	-179	-178.8	59.3	0	0	0	112	Q1065 H1066 N1067 N1071 W1072 V1073 S1103 L1109 L1113	Q1065-L1069 PolarHBondContact O-N 3.4Å; H1066-L1069 PolarHBondContact O-N 2.92Å; N1067-L1069 VanDerWaalsContact C-N 3.34Å; N1067-L1069 PolarHBondContact O-N 3.04Å; L1069-N1071 VanDerWaalsContact C-N 3.3Å; L1069-N1071 PolarHBondContact O-N 2.83Å; L1069-W1072 PolarHBondContact O-N 3.12Å; L1069-V1073 HydrophobicContact CD1-CG2 4.03Å; L1069-V1073 HydrophobicContact CG-CG2 4.22Å; L1069-V1073 WeakPolarHBondContact O-CG2 3.48Å; L1069-V1073 PolarHBondContact O-N 3.47Å; L1069-S1103 WeakPolarHBondContact CD1-OG 3.36Å; L1069-S1103 VanDerWaalsContact CD2-OG 3.25Å; L1069-S1103 WeakPolarHBondContact CD2-OG 3.25Å; L1069-L1109 HydrophobicContact CB-CD2 3.83Å; L1069-L1109 HydrophobicContact CD2-CD2 3.71Å; L1069-L1109 HydrophobicContact CG-CD2 4.4Å; L1069-L1113 HydrophobicContact CB-CD2 4.44Å; L1069-L1113 HydrophobicContact CD2-CD1 3.69Å; L1069-L1113 HydrophobicContact CD2-CD2 4.12Å; L1069-L1113 HydrophobicContact CD2-CG 4.04Å; L1069-L1113 HydrophobicContact CG-CD1 4.24Å; L1069-L1113 HydrophobicContact CG-CD2 4.12Å
1070	S	82.5	Confident	80.4	Confident	16 Å²	16	39.1 Å²	39.1	11%	0.112	20%	0.196	C	C	.	.	H	α-helix	trans	-58.1	-44.7	179.1	-173.6	0	0	0	0	111	H1066 N1067 W1072 V1073 N1074 S1117	H1066-S1070 VanDerWaalsContact O-CB 3.3Å; H1066-S1070 WeakPolarHBondContact O-CB 3.29Å; H1066-S1070 PolarHBondContact O-N 2.92Å; N1067-S1070 PolarHBondContact O-N 3.48Å; S1070-W1072 PolarHBondContact O-N 2.66Å; S1070-V1073 PolarHBondContact O-N 2.77Å; S1070-N1074 VanDerWaalsContact O-CG 3.23Å; S1070-N1074 PolarHBondContact O-N 3.14Å; S1070-N1074 PolarHBondContact O-ND2 2.9Å; S1070-S1117 PolarHBondContact OG-OG 3.47Å
1071	N	83.6	Confident	81.5	Confident	66 Å²	66	36 Å²	36	35%	0.353	19%	0.187	S	C	.	.	H	α-helix	trans	-60.7	-44.1	175.9	-73.3	-13.6	0	0	0	112.1	P1017 N1067 L1069 N1074 F1075	P1017-N1071 VanDerWaalsContact CB-O 3.3Å; P1017-N1071 WeakPolarHBondContact CB-O 3.5Å; P1017-N1071 HydrophobicContact CG-CB 4.35Å; N1067-N1071 WeakPolarHBondContact O-CB 3.22Å; N1067-N1071 VanDerWaalsContact O-CG 3.23Å; N1067-N1071 PolarHBondContact O-N 3.46Å; N1067-N1071 PolarHBondContact O-ND2 2.92Å; L1069-N1071 VanDerWaalsContact C-N 3.3Å; L1069-N1071 PolarHBondContact O-N 2.83Å; N1071-N1074 PolarHBondContact O-N 3.4Å; N1071-F1075 WeakPolarHBondContact O-CB 3.32Å; N1071-F1075 PolarHBondContact O-N 3.32Å
1072	W	88.1	Confident	82.5	Confident	1 Å²	1	37.8 Å²	37.8	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-66.9	-38.7	177.5	-174.2	-94.1	0	0	0	113.1	Y1012 A1040 T1041 Q1044 I1068 L1069 S1070 N1074 F1075 A1076 F1095 L1096 P1099	Y1012-W1072 PolarHBondContact OH-N 3.13Å; A1040-W1072 HydrophobicContact CB-CH2 4.22Å; A1040-W1072 HydrophobicContact CB-CZ3 4.16Å; A1040-W1072 WeakPolarHBondContact O-CZ3 3.47Å; T1041-W1072 WeakPolarHBondContact OG1-CH2 3.41Å; Q1044-W1072 HydrophobicContact CB-CD2 4.29Å; Q1044-W1072 HydrophobicContact CB-CE3 3.62Å; Q1044-W1072 HydrophobicContact CB-CH2 4.32Å; Q1044-W1072 HydrophobicContact CB-CZ3 3.63Å; Q1044-W1072 HydrophobicContact CG-CB 4.34Å; Q1044-W1072 HydrophobicContact CG-CD2 3.69Å; Q1044-W1072 HydrophobicContact CG-CE3 3.4Å; Q1044-W1072 VanDerWaalsContact CG-CE3 3.4Å; Q1044-W1072 HydrophobicContact CG-CG 4.08Å; Q1044-W1072 HydrophobicContact CG-CZ3 3.96Å; I1068-W1072 PolarHBondContact O-N 3.43Å; L1069-W1072 PolarHBondContact O-N 3.12Å; S1070-W1072 PolarHBondContact O-N 2.66Å; W1072-N1074 VanDerWaalsContact C-N 3.31Å; W1072-N1074 PolarHBondContact O-N 2.97Å; W1072-F1075 HydrophobicContact CD2-CD1 4.1Å; W1072-F1075 AromaticContact CE3-CD1 3.89Å; W1072-F1075 HydrophobicContact CE3-CD1 3.89Å; W1072-F1075 HydrophobicContact CE3-CE1 4.36Å; W1072-F1075 AromaticContact CH2-CD1 3.89Å; W1072-F1075 HydrophobicContact CH2-CD1 3.89Å; W1072-F1075 AromaticContact CH2-CE1 3.59Å; W1072-F1075 HydrophobicContact CH2-CE1 3.59Å; W1072-F1075 HydrophobicContact CZ2-CD1 4.06Å; W1072-F1075 AromaticContact CZ2-CE1 3.99Å; W1072-F1075 HydrophobicContact CZ2-CE1 3.99Å; W1072-F1075 AromaticContact CZ3-CD1 3.8Å; W1072-F1075 HydrophobicContact CZ3-CD1 3.8Å; W1072-F1075 AromaticContact CZ3-CE1 3.8Å; W1072-F1075 HydrophobicContact CZ3-CE1 3.8Å; W1072-F1075 WeakPolarHBondContact O-CB 3.42Å; W1072-F1075 PolarHBondContact O-N 2.94Å; W1072-A1076 VanDerWaalsContact O-CB 3.29Å; W1072-A1076 WeakPolarHBondContact O-CB 3.24Å; W1072-A1076 PolarHBondContact O-N 3.49Å; W1072-F1095 WeakPolarHBondContact CZ2-O 3.3Å; W1072-L1096 HydrophobicContact CZ2-CD2 4.39Å; W1072-L1096 PolarHBondContact NE1-O 2.94Å; W1072-L1096 VanDerWaalsContact NE1-O 3.08Å; W1072-P1099 HydrophobicContact CD2-CB 4.11Å; W1072-P1099 HydrophobicContact CD2-CG 4.14Å; W1072-P1099 VanDerWaalsContact CE2-CG 3.48Å; W1072-P1099 HydrophobicContact CG-CB 4.12Å; W1072-P1099 HydrophobicContact CH2-CG 4.26Å; W1072-P1099 HydrophobicContact CZ2-CB 4.4Å; W1072-P1099 HydrophobicContact CZ2-CG 3.57Å
1073	V	87.7	Confident	83.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-41.3	176.3	170.7	0	0	0	0	110.3	L1069 S1070 A1076 Y1077 I1100 S1117 H1120	L1069-V1073 HydrophobicContact CD1-CG2 4.03Å; L1069-V1073 HydrophobicContact CG-CG2 4.22Å; L1069-V1073 WeakPolarHBondContact O-CG2 3.48Å; L1069-V1073 PolarHBondContact O-N 3.47Å; S1070-V1073 PolarHBondContact O-N 2.77Å; V1073-A1076 PolarHBondContact O-N 3.33Å; V1073-Y1077 WeakPolarHBondContact O-CB 3.34Å; V1073-Y1077 PolarHBondContact O-N 3.33Å; V1073-I1100 HydrophobicContact CG2-CD1 4.36Å; V1073-I1100 HydrophobicContact CG2-CG1 4.33Å; V1073-S1117 WeakPolarHBondContact CG1-O 3.5Å; V1073-H1120 HydrophobicContact CG1-CB 3.81Å
1074	N	86.4	Confident	83.9	Confident	65 Å²	65	39.8 Å²	39.8	35%	0.348	20%	0.202	S	C	.	.	H	α-helix	trans	-64.1	-43	175.6	-66.6	-19.8	0	0	0	111.4	P1017 S1070 N1071 W1072 Y1077 A1078	P1017-N1074 HydrophobicContact CG-CB 4.25Å; S1070-N1074 VanDerWaalsContact O-CG 3.23Å; S1070-N1074 PolarHBondContact O-N 3.14Å; S1070-N1074 PolarHBondContact O-ND2 2.9Å; N1071-N1074 PolarHBondContact O-N 3.4Å; W1072-N1074 VanDerWaalsContact C-N 3.31Å; W1072-N1074 PolarHBondContact O-N 2.97Å; N1074-Y1077 PolarHBondContact O-N 3.1Å; N1074-A1078 WeakPolarHBondContact O-CB 3.37Å; N1074-A1078 PolarHBondContact O-N 2.95Å
1075	F	90.6	Very high	84.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.2	-54.5	172.4	171.5	-108	0	0	0	112	Y1012 P1017 I1020 A1021 V1024 L1037 A1040 N1071 W1072 Y1077 A1078 I1079 L1096	Y1012-F1075 HydrophobicContact CE2-CB 4.41Å; Y1012-F1075 HydrophobicContact CE2-CG 4.44Å; P1017-F1075 HydrophobicContact CB-CB 3.56Å; P1017-F1075 WeakPolarHBondContact O-CD2 3.48Å; I1020-F1075 HydrophobicContact CB-CD2 4.37Å; I1020-F1075 HydrophobicContact CB-CE2 3.93Å; I1020-F1075 HydrophobicContact CG2-CE2 3.66Å; I1020-F1075 HydrophobicContact CG2-CZ 4.22Å; A1021-F1075 HydrophobicContact CB-CD2 3.87Å; A1021-F1075 HydrophobicContact CB-CE2 4.15Å; V1024-F1075 HydrophobicContact CG2-CE2 4.42Å; V1024-F1075 HydrophobicContact CG2-CZ 4.24Å; L1037-F1075 HydrophobicContact CD2-CE1 4.17Å; L1037-F1075 HydrophobicContact CD2-CZ 3.98Å; A1040-F1075 HydrophobicContact CB-CZ 4.26Å; N1071-F1075 WeakPolarHBondContact O-CB 3.32Å; N1071-F1075 PolarHBondContact O-N 3.32Å; W1072-F1075 HydrophobicContact CD2-CD1 4.1Å; W1072-F1075 AromaticContact CE3-CD1 3.89Å; W1072-F1075 HydrophobicContact CE3-CD1 3.89Å; W1072-F1075 HydrophobicContact CE3-CE1 4.36Å; W1072-F1075 AromaticContact CH2-CD1 3.89Å; W1072-F1075 HydrophobicContact CH2-CD1 3.89Å; W1072-F1075 AromaticContact CH2-CE1 3.59Å; W1072-F1075 HydrophobicContact CH2-CE1 3.59Å; W1072-F1075 HydrophobicContact CZ2-CD1 4.06Å; W1072-F1075 AromaticContact CZ2-CE1 3.99Å; W1072-F1075 HydrophobicContact CZ2-CE1 3.99Å; W1072-F1075 AromaticContact CZ3-CD1 3.8Å; W1072-F1075 HydrophobicContact CZ3-CD1 3.8Å; W1072-F1075 AromaticContact CZ3-CE1 3.8Å; W1072-F1075 HydrophobicContact CZ3-CE1 3.8Å; W1072-F1075 WeakPolarHBondContact O-CB 3.42Å; W1072-F1075 PolarHBondContact O-N 2.94Å; F1075-Y1077 VanDerWaalsContact C-N 3.31Å; F1075-Y1077 PolarHBondContact O-N 2.74Å; F1075-A1078 PolarHBondContact O-N 3.09Å; F1075-I1079 HydrophobicContact CD1-CD1 4.18Å; F1075-I1079 HydrophobicContact CD2-CD1 4.02Å; F1075-I1079 HydrophobicContact CE1-CD1 3.63Å; F1075-I1079 HydrophobicContact CE2-CD1 3.44Å; F1075-I1079 VanDerWaalsContact CE2-CD1 3.44Å; F1075-I1079 HydrophobicContact CE2-CG1 4.43Å; F1075-I1079 HydrophobicContact CG-CD1 4.36Å; F1075-I1079 HydrophobicContact CZ-CD1 3.23Å; F1075-I1079 PolarHBondContact O-N 2.86Å; F1075-I1079 VanDerWaalsContact O-N 3.12Å; F1075-L1096 HydrophobicContact CD1-CD2 4.16Å; F1075-L1096 HydrophobicContact CE1-CD2 3.73Å
1076	A	90.2	Very high	84.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-38.2	-177.8	0	0	0	0	0	111.9	W1072 V1073 F1080 L1096 I1100 I1124	W1072-A1076 VanDerWaalsContact O-CB 3.29Å; W1072-A1076 WeakPolarHBondContact O-CB 3.24Å; W1072-A1076 PolarHBondContact O-N 3.49Å; V1073-A1076 PolarHBondContact O-N 3.33Å; A1076-F1080 WeakPolarHBondContact O-CB 3.26Å; A1076-F1080 PolarHBondContact O-N 3.48Å; A1076-L1096 HydrophobicContact CB-CB 4.16Å; A1076-L1096 HydrophobicContact CB-CD2 4.15Å; A1076-I1100 HydrophobicContact CB-CD1 4.3Å; A1076-I1124 HydrophobicContact CB-CD1 3.98Å
1077	Y	89.8	Confident	85	Confident	74 Å²	74	42.2 Å²	42.2	29%	0.29	24%	0.243	S	C	.	.	H	α-helix	trans	-66.6	-44.2	176.6	-169.3	-107.1	0	0	0	111.8	V1073 N1074 F1075 I1079 F1080 S1081 H1120 I1124	V1073-Y1077 WeakPolarHBondContact O-CB 3.34Å; V1073-Y1077 PolarHBondContact O-N 3.33Å; N1074-Y1077 PolarHBondContact O-N 3.1Å; F1075-Y1077 VanDerWaalsContact C-N 3.31Å; F1075-Y1077 PolarHBondContact O-N 2.74Å; Y1077-I1079 VanDerWaalsContact C-N 3.29Å; Y1077-I1079 PolarHBondContact O-N 3.39Å; Y1077-F1080 HydrophobicContact CD2-CD1 4.04Å; Y1077-F1080 HydrophobicContact CE2-CD1 4.05Å; Y1077-F1080 HydrophobicContact CE2-CE1 4.21Å; Y1077-F1080 PolarHBondContact O-N 3.42Å; Y1077-S1081 WeakPolarHBondContact O-CB 2.93Å; Y1077-S1081 PolarHBondContact O-N 3.44Å; Y1077-S1081 PolarHBondContact O-OG 3.24Å; Y1077-H1120 AromaticContact CD1-CE1 3.86Å; Y1077-H1120 AromaticContact CD1-ND1 3.88Å; Y1077-H1120 HydrophobicContact CD2-CB 3.76Å; Y1077-H1120 AromaticContact CD2-CD2 3.77Å; Y1077-H1120 AromaticContact CD2-CG 3.69Å; Y1077-H1120 AromaticContact CE1-CD2 3.9Å; Y1077-H1120 AromaticContact CE1-CE1 3.81Å; Y1077-H1120 AromaticContact CE1-NE2 3.61Å; Y1077-H1120 HydrophobicContact CE2-CB 4.31Å; Y1077-H1120 AromaticContact CE2-CD2 3.49Å; Y1077-H1120 VanDerWaalsContact CE2-CD2 3.49Å; Y1077-H1120 WeakPolarHBondContact CE2-CD2 3.22Å; Y1077-H1120 AromaticContact CE2-CG 3.92Å; Y1077-H1120 HydrophobicContact CG-CB 4.04Å; Y1077-H1120 AromaticContact CG-CG 3.77Å; Y1077-H1120 AromaticContact CG-ND1 3.91Å; Y1077-H1120 AromaticContact CZ-CD2 3.55Å; Y1077-H1120 AromaticContact CZ-NE2 3.6Å; Y1077-I1124 HydrophobicContact CD2-CD1 4.13Å; Y1077-I1124 HydrophobicContact CD2-CG1 4.2Å
1078	A	89.6	Confident	85.3	Confident	25 Å²	25	40.7 Å²	40.7	21%	0.207	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-37.1	178.1	0	0	0	0	0	112.3	A1021 N1074 F1075 S1081 N1082	A1021-A1078 HydrophobicContact CB-CB 3.84Å; N1074-A1078 WeakPolarHBondContact O-CB 3.37Å; N1074-A1078 PolarHBondContact O-N 2.95Å; F1075-A1078 PolarHBondContact O-N 3.09Å; A1078-S1081 PolarHBondContact O-OG 3.16Å; A1078-N1082 PolarHBondContact O-ND2 3.49Å
1079	I	91.2	Very high	85.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-71	-47.5	173.8	-66.4	168.6	0	0	0	110.5	A1021 V1024 L1025 L1037 F1075 Y1077 S1081 N1082 T1083 L1096	A1021-I1079 HydrophobicContact CB-CD1 4.42Å; A1021-I1079 HydrophobicContact CB-CG1 3.89Å; V1024-I1079 HydrophobicContact CB-CD1 4.04Å; V1024-I1079 HydrophobicContact CB-CG1 4.47Å; V1024-I1079 HydrophobicContact CG1-CD1 3.86Å; V1024-I1079 HydrophobicContact CG1-CG1 4.33Å; V1024-I1079 HydrophobicContact CG1-CG2 4.5Å; V1024-I1079 HydrophobicContact CG2-CD1 4.27Å; L1025-I1079 HydrophobicContact CD2-CG2 4.48Å; L1037-I1079 HydrophobicContact CD2-CD1 3.98Å; F1075-I1079 HydrophobicContact CD1-CD1 4.18Å; F1075-I1079 HydrophobicContact CD2-CD1 4.02Å; F1075-I1079 HydrophobicContact CE1-CD1 3.63Å; F1075-I1079 HydrophobicContact CE2-CD1 3.44Å; F1075-I1079 VanDerWaalsContact CE2-CD1 3.44Å; F1075-I1079 HydrophobicContact CE2-CG1 4.43Å; F1075-I1079 HydrophobicContact CG-CD1 4.36Å; F1075-I1079 HydrophobicContact CZ-CD1 3.23Å; F1075-I1079 PolarHBondContact O-N 2.86Å; F1075-I1079 VanDerWaalsContact O-N 3.12Å; Y1077-I1079 VanDerWaalsContact C-N 3.29Å; Y1077-I1079 PolarHBondContact O-N 3.39Å; I1079-S1081 VanDerWaalsContact C-N 3.35Å; I1079-S1081 PolarHBondContact O-N 3.34Å; I1079-N1082 PolarHBondContact O-N 3.38Å; I1079-T1083 WeakPolarHBondContact O-CB 3.48Å; I1079-T1083 PolarHBondContact O-N 3.09Å; I1079-T1083 VanDerWaalsContact O-N 3.09Å; I1079-T1083 PolarHBondContact O-OG1 2.66Å; I1079-L1096 HydrophobicContact CB-CD1 4.15Å; I1079-L1096 HydrophobicContact CD1-CD2 3.98Å; I1079-L1096 HydrophobicContact CG2-CD1 3.87Å
1080	F	89.4	Confident	85.7	Confident	28 Å²	28	42.2 Å²	42.2	12%	0.123	24%	0.241	C	C	.	.	H	α-helix	trans	-55.8	-46.5	178.9	161.9	-90.8	0	0	0	112	A1076 Y1077 N1082 Y1089 H1123 I1124 M1127 Y1128	A1076-F1080 WeakPolarHBondContact O-CB 3.26Å; A1076-F1080 PolarHBondContact O-N 3.48Å; Y1077-F1080 HydrophobicContact CD2-CD1 4.04Å; Y1077-F1080 HydrophobicContact CE2-CD1 4.05Å; Y1077-F1080 HydrophobicContact CE2-CE1 4.21Å; Y1077-F1080 PolarHBondContact O-N 3.42Å; F1080-N1082 VanDerWaalsContact C-N 3.32Å; F1080-N1082 PolarHBondContact O-N 3.28Å; F1080-Y1089 AromaticContact CD2-CE2 3.41Å; F1080-Y1089 HydrophobicContact CD2-CE2 3.41Å; F1080-Y1089 VanDerWaalsContact CD2-CE2 3.41Å; F1080-Y1089 AromaticContact CD2-CZ 3.77Å; F1080-Y1089 VanDerWaalsContact CD2-OH 3.27Å; F1080-Y1089 WeakPolarHBondContact CD2-OH 3.37Å; F1080-Y1089 AromaticContact CE2-CE2 3.63Å; F1080-Y1089 HydrophobicContact CE2-CE2 3.63Å; F1080-Y1089 AromaticContact CE2-CZ 3.74Å; F1080-Y1089 WeakPolarHBondContact CE2-OH 3.33Å; F1080-Y1089 HydrophobicContact CG-CE2 4.47Å; F1080-H1123 AromaticContact CE1-CD2 3.52Å; F1080-H1123 AromaticContact CE1-NE2 3.58Å; F1080-H1123 AromaticContact CZ-CD2 3.62Å; F1080-H1123 AromaticContact CZ-NE2 3.39Å; F1080-H1123 WeakPolarHBondContact CZ-NE2 3.37Å; F1080-I1124 HydrophobicContact CB-CG1 4.41Å; F1080-I1124 HydrophobicContact CG-CG1 4.33Å; F1080-M1127 HydrophobicContact CE2-CB 3.73Å; F1080-M1127 HydrophobicContact CE2-CG 4.06Å; F1080-M1127 HydrophobicContact CZ-CB 4.23Å; F1080-M1127 HydrophobicContact CZ-CG 4.04Å; F1080-Y1128 HydrophobicContact CB-CE2 4.34Å; F1080-Y1128 HydrophobicContact CD2-CE2 4.1Å
1081	S	86.6	Confident	85.7	Confident	50 Å²	50	42.2 Å²	42.2	35%	0.35	24%	0.241	S	C	.	.	H	α-helix	trans	-70.2	-27.3	-175.2	64.5	0	0	0	0	113.6	Y1077 A1078 I1079	Y1077-S1081 WeakPolarHBondContact O-CB 2.93Å; Y1077-S1081 PolarHBondContact O-N 3.44Å; Y1077-S1081 PolarHBondContact O-OG 3.24Å; A1078-S1081 PolarHBondContact O-OG 3.16Å; I1079-S1081 VanDerWaalsContact C-N 3.35Å; I1079-S1081 PolarHBondContact O-N 3.34Å
1082	N	87.6	Confident	85.9	Confident	87 Å²	87	39 Å²	39	47%	0.465	22%	0.224	S	C	.	.	H	α-helix	trans	-105.6	3.4	-174.9	-64.4	-48.6	0	0	0	113.6	L1025 A1078 I1079 F1080	L1025-N1082 HydrophobicContact CD1-CB 3.6Å; L1025-N1082 HydrophobicContact CD2-CB 3.74Å; L1025-N1082 HydrophobicContact CG-CB 4.32Å; A1078-N1082 PolarHBondContact O-ND2 3.49Å; I1079-N1082 PolarHBondContact O-N 3.38Å; F1080-N1082 VanDerWaalsContact C-N 3.32Å; F1080-N1082 PolarHBondContact O-N 3.28Å
1083	T	85.9	Confident	85.9	Confident	15 Å²	15	39 Å²	39	9%	0.092	22%	0.224	C	C	.	.			trans	-95.7	103.6	176.9	-58.8	0	0	0	0	110.1	R1033 I1079 I1088	R1033-T1083 PolarHBondContact NH2-OG1 2.95Å; I1079-T1083 WeakPolarHBondContact O-CB 3.48Å; I1079-T1083 PolarHBondContact O-N 3.09Å; I1079-T1083 VanDerWaalsContact O-N 3.09Å; I1079-T1083 PolarHBondContact O-OG1 2.66Å; T1083-I1088 HydrophobicContact CG2-CB 4.01Å; T1083-I1088 HydrophobicContact CG2-CG2 3.77Å
1084	H	80.7	Confident	86	Confident	171 Å²	171	39 Å²	39	79%	0.792	22%	0.224	S	C	*	.			trans	-91.8	-21.8	-174.4	-56.6	-53.5	0	0	0	114.6
1085	S	83.2	Confident	86.2	Confident	52 Å²	52	36 Å²	36	36%	0.364	21%	0.208	S	C	.	.			trans	-87.4	128.3	-179.1	79	0	0	0	0	111.2	G1087 I1088 Y1089	S1085-G1087 VanDerWaalsContact C-N 3.28Å; S1085-G1087 PolarHBondContact O-N 3.4Å; S1085-I1088 PolarHBondContact O-N 3.28Å; S1085-I1088 WeakPolarHBondContact OG-CB 3.18Å; S1085-I1088 WeakPolarHBondContact OG-CD1 3.21Å; S1085-I1088 WeakPolarHBondContact OG-CG1 3.32Å; S1085-I1088 PolarHBondContact OG-N 3.2Å; S1085-Y1089 VanDerWaalsContact O-CB 3.26Å; S1085-Y1089 WeakPolarHBondContact O-CB 3.23Å; S1085-Y1089 PolarHBondContact O-N 2.91Å
1086	S	77.8	Confident	86.2	Confident	95 Å²	95	36 Å²	36	66%	0.664	21%	0.208	S	C	*	.	H	α-helix	trans	-61.4	-35	-178.1	56.2	0	0	0	0	112.9	Y1089 L1090	S1086-Y1089 WeakPolarHBondContact O-CB 3.48Å; S1086-L1090 WeakPolarHBondContact O-CD1 3.35Å; S1086-L1090 VanDerWaalsContact O-CG 3.23Å; S1086-L1090 WeakPolarHBondContact O-CG 3.26Å; S1086-L1090 PolarHBondContact O-N 3.21Å; S1086-L1090 VanDerWaalsContact O-N 3.1Å
1087	G	77.9	Confident	86.1	Confident	40 Å²	40	36 Å²	36	41%	0.412	21%	0.208	S	C	.	.	H	α-helix	trans	-64	-47.7	177.1	0	0	0	0	0	113	S1085 Y1089 L1090 S1091	S1085-G1087 VanDerWaalsContact C-N 3.28Å; S1085-G1087 PolarHBondContact O-N 3.4Å; G1087-Y1089 VanDerWaalsContact C-N 3.35Å; G1087-L1090 PolarHBondContact O-N 3.12Å; G1087-S1091 PolarHBondContact O-N 3.29Å
1088	I	82	Confident	86	Confident	50 Å²	50	32.4 Å²	32.4	26%	0.256	19%	0.194	S	C	.	.	H	α-helix	trans	-68.1	-39.7	177.8	-59.7	177.6	0	0	0	110.4	L1030 R1033 T1083 S1085 L1090 S1091 D1092	L1030-I1088 HydrophobicContact CD1-CB 4.19Å; L1030-I1088 HydrophobicContact CD1-CG1 3.8Å; L1030-I1088 HydrophobicContact CD1-CG2 4.06Å; R1033-I1088 VanDerWaalsContact NE-CG2 3.32Å; T1083-I1088 HydrophobicContact CG2-CB 4.01Å; T1083-I1088 HydrophobicContact CG2-CG2 3.77Å; S1085-I1088 PolarHBondContact O-N 3.28Å; S1085-I1088 WeakPolarHBondContact OG-CB 3.18Å; S1085-I1088 WeakPolarHBondContact OG-CD1 3.21Å; S1085-I1088 WeakPolarHBondContact OG-CG1 3.32Å; S1085-I1088 PolarHBondContact OG-N 3.2Å; I1088-L1090 PolarHBondContact O-N 2.97Å; I1088-S1091 WeakPolarHBondContact CA-OG 3.4Å; I1088-S1091 PolarHBondContact O-N 2.94Å; I1088-S1091 VanDerWaalsContact O-N 3.16Å; I1088-S1091 PolarHBondContact O-OG 3.47Å; I1088-D1092 VanDerWaalsContact O-CG 3.26Å; I1088-D1092 PolarHBondContact O-N 2.83Å; I1088-D1092 VanDerWaalsContact O-N 3.09Å
1089	Y	83.6	Confident	85.9	Confident	29 Å²	29	31.2 Å²	31.2	11%	0.114	18%	0.184	C	C	.	.	H	α-helix	trans	-54.3	-44	176.2	-174.2	-89.7	0	0	0	111.6	F1080 S1085 S1086 G1087 A1093 M1127 Y1128 A1131	F1080-Y1089 AromaticContact CD2-CE2 3.41Å; F1080-Y1089 HydrophobicContact CD2-CE2 3.41Å; F1080-Y1089 VanDerWaalsContact CD2-CE2 3.41Å; F1080-Y1089 AromaticContact CD2-CZ 3.77Å; F1080-Y1089 VanDerWaalsContact CD2-OH 3.27Å; F1080-Y1089 WeakPolarHBondContact CD2-OH 3.37Å; F1080-Y1089 AromaticContact CE2-CE2 3.63Å; F1080-Y1089 HydrophobicContact CE2-CE2 3.63Å; F1080-Y1089 AromaticContact CE2-CZ 3.74Å; F1080-Y1089 WeakPolarHBondContact CE2-OH 3.33Å; F1080-Y1089 HydrophobicContact CG-CE2 4.47Å; S1085-Y1089 VanDerWaalsContact O-CB 3.26Å; S1085-Y1089 WeakPolarHBondContact O-CB 3.23Å; S1085-Y1089 PolarHBondContact O-N 2.91Å; S1086-Y1089 WeakPolarHBondContact O-CB 3.48Å; G1087-Y1089 VanDerWaalsContact C-N 3.35Å; Y1089-A1093 PolarHBondContact O-N 3.37Å; Y1089-M1127 WeakPolarHBondContact OH-CB 3.43Å; Y1089-Y1128 AromaticContact CD1-CD1 3.96Å; Y1089-Y1128 HydrophobicContact CD1-CD1 3.96Å; Y1089-Y1128 AromaticContact CD1-CE1 3.75Å; Y1089-Y1128 HydrophobicContact CD1-CE1 3.75Å; Y1089-Y1128 AromaticContact CD2-CE1 3.79Å; Y1089-Y1128 HydrophobicContact CD2-CE1 3.79Å; Y1089-Y1128 AromaticContact CE1-CD1 3.31Å; Y1089-Y1128 HydrophobicContact CE1-CD1 3.31Å; Y1089-Y1128 AromaticContact CE1-CE1 3.38Å; Y1089-Y1128 HydrophobicContact CE1-CE1 3.38Å; Y1089-Y1128 HydrophobicContact CE1-CG 4.34Å; Y1089-Y1128 HydrophobicContact CE2-CD1 4.14Å; Y1089-Y1128 AromaticContact CE2-CE1 3.44Å; Y1089-Y1128 HydrophobicContact CE2-CE1 3.44Å; Y1089-Y1128 VanDerWaalsContact CE2-CE1 3.44Å; Y1089-Y1128 AromaticContact CE2-CZ 3.8Å; Y1089-Y1128 AromaticContact CG-CE1 3.9Å; Y1089-Y1128 HydrophobicContact CG-CE1 3.9Å; Y1089-Y1128 AromaticContact CZ-CD1 3.38Å; Y1089-Y1128 AromaticContact CZ-CE1 3.17Å; Y1089-Y1128 AromaticContact CZ-CZ 3.85Å; Y1089-Y1128 WeakPolarHBondContact O-CE1 3.45Å; Y1089-Y1128 WeakPolarHBondContact OH-CD1 3.22Å; Y1089-Y1128 WeakPolarHBondContact OH-CE1 3.29Å; Y1089-A1131 HydrophobicContact CD1-CB 3.96Å; Y1089-A1131 HydrophobicContact CE1-CB 3.5Å
1090	L	84.6	Confident	85.6	Confident	22 Å²	22	31.3 Å²	31.3	12%	0.115	18%	0.184	C	C	.	.	H	α-helix	trans	-70.9	-35	178.6	-69.6	167.8	0	0	0	113.9	S1086 G1087 I1088 A1131 V1132 V1135 I1144	S1086-L1090 WeakPolarHBondContact O-CD1 3.35Å; S1086-L1090 VanDerWaalsContact O-CG 3.23Å; S1086-L1090 WeakPolarHBondContact O-CG 3.26Å; S1086-L1090 PolarHBondContact O-N 3.21Å; S1086-L1090 VanDerWaalsContact O-N 3.1Å; G1087-L1090 PolarHBondContact O-N 3.12Å; I1088-L1090 PolarHBondContact O-N 2.97Å; L1090-A1131 VanDerWaalsContact CD2-C 3.48Å; L1090-A1131 HydrophobicContact CD2-CB 3.85Å; L1090-A1131 WeakPolarHBondContact CD2-O 3.18Å; L1090-V1132 HydrophobicContact CD2-CG2 4.07Å; L1090-V1135 HydrophobicContact CD1-CG2 3.47Å; L1090-V1135 VanDerWaalsContact CD1-CG2 3.47Å; L1090-V1135 HydrophobicContact CD2-CG2 3.46Å; L1090-V1135 VanDerWaalsContact CD2-CG2 3.46Å; L1090-V1135 HydrophobicContact CG-CG2 4.05Å; L1090-I1144 HydrophobicContact CB-CD1 4.1Å
1091	S	83	Confident	85.3	Confident	16 Å²	16	31.1 Å²	31.1	11%	0.112	19%	0.185	C	C	.	.	H	α-helix	trans	-70.9	-31.5	178.9	58.2	0	0	0	0	113.1	L1030 G1087 I1088 P1094	L1030-S1091 WeakPolarHBondContact CD1-OG 3.25Å; G1087-S1091 PolarHBondContact O-N 3.29Å; I1088-S1091 WeakPolarHBondContact CA-OG 3.4Å; I1088-S1091 PolarHBondContact O-N 2.94Å; I1088-S1091 VanDerWaalsContact O-N 3.16Å; I1088-S1091 PolarHBondContact O-OG 3.47Å; S1091-P1094 WeakPolarHBondContact O-CD 3.28Å
1092	D	87.8	Confident	84.9	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-77.1	-26.1	-178.5	-66.3	-4.5	0	0	0	112.4	R1033 L1037 I1088 P1094 F1095 L1096	R1033-D1092 IonicContact CZ-OD2 3.18Å; R1033-D1092 IonicContact NE-OD1 3.23Å; R1033-D1092 PolarHBondContact NE-OD1 2.87Å; R1033-D1092 IonicContact NE-OD2 2.87Å; R1033-D1092 PolarHBondContact NE-OD2 3.47Å; R1033-D1092 IonicContact NH2-OD2 2.65Å; R1033-D1092 PolarHBondContact NH2-OD2 3.42Å; L1037-D1092 HydrophobicContact CD1-CB 3.94Å; L1037-D1092 WeakPolarHBondContact CD1-OD1 3.42Å; I1088-D1092 VanDerWaalsContact O-CG 3.26Å; I1088-D1092 PolarHBondContact O-N 2.83Å; I1088-D1092 VanDerWaalsContact O-N 3.09Å; D1092-P1094 VanDerWaalsContact C-CD 3.5Å; D1092-F1095 PolarHBondContact O-N 3.22Å; D1092-L1096 HydrophobicContact CB-CD1 4.12Å; D1092-L1096 HydrophobicContact CB-CG 4.49Å; D1092-L1096 PolarHBondContact O-N 3.27Å; D1092-L1096 VanDerWaalsContact O-N 3.17Å
1093	A	89.3	Confident	84.3	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-49.9	-48	-171.7	0	0	0	0	0	114.4	Y1089 F1095 L1096 V1097 Y1128 V1132 F1166	Y1089-A1093 PolarHBondContact O-N 3.37Å; A1093-F1095 VanDerWaalsContact C-N 3.31Å; A1093-F1095 PolarHBondContact O-N 3.42Å; A1093-L1096 PolarHBondContact O-N 2.97Å; A1093-V1097 VanDerWaalsContact O-CB 3.25Å; A1093-V1097 WeakPolarHBondContact O-CB 3.47Å; A1093-V1097 VanDerWaalsContact O-CG2 3.28Å; A1093-V1097 WeakPolarHBondContact O-CG2 3.38Å; A1093-V1097 PolarHBondContact O-N 3.17Å; A1093-Y1128 HydrophobicContact CB-CD1 3.36Å; A1093-Y1128 HydrophobicContact CB-CE1 3.98Å; A1093-Y1128 HydrophobicContact CB-CG 3.78Å; A1093-V1132 HydrophobicContact CB-CG2 3.82Å; A1093-F1166 HydrophobicContact CB-CZ 4.17Å
1094	P	89.6	Confident	83.4	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.4	-40.1	-179.9	-23.6	36.4	0	0	0	112.7	S1091 D1092 C1098 I1144 L1147 L1151 L1162	S1091-P1094 WeakPolarHBondContact O-CD 3.28Å; D1092-P1094 VanDerWaalsContact C-CD 3.5Å; P1094-C1098 WeakPolarHBondContact O-CB 3.34Å; P1094-C1098 PolarHBondContact O-N 3.47Å; P1094-I1144 HydrophobicContact CG-CG2 3.92Å; P1094-L1147 HydrophobicContact CB-CB 4.42Å; P1094-L1147 HydrophobicContact CG-CB 4.28Å; P1094-L1151 HydrophobicContact CB-CD1 3.67Å; P1094-L1151 WeakPolarHBondContact O-CD1 3.41Å; P1094-L1162 HydrophobicContact CB-CD1 4.49Å
1095	F	90.2	Very high	82.4	Confident	1 Å²	1	20.8 Å²	20.8	0%	0.004	13%	0.132	C	C	.	.	H	α-helix	trans	-71.9	-41	-175.5	-59.2	-66.8	0	0	0	112.4	T1034 L1037 Q1038 T1041 W1072 D1092 A1093 P1099 L1147 L1151	T1034-F1095 HydrophobicContact CG2-CE2 3.64Å; T1034-F1095 HydrophobicContact CG2-CZ 3.75Å; L1037-F1095 HydrophobicContact CB-CB 4.04Å; L1037-F1095 HydrophobicContact CB-CD2 4.16Å; L1037-F1095 HydrophobicContact CB-CG 4.02Å; L1037-F1095 HydrophobicContact CD1-CD2 4.35Å; Q1038-F1095 HydrophobicContact CB-CE1 4.33Å; Q1038-F1095 HydrophobicContact CG-CD1 4.02Å; Q1038-F1095 HydrophobicContact CG-CE1 3.25Å; Q1038-F1095 HydrophobicContact CG-CZ 3.63Å; T1041-F1095 WeakPolarHBondContact CG2-O 3.08Å; T1041-F1095 WeakPolarHBondContact OG1-CB 3.48Å; T1041-F1095 PolarHBondContact OG1-O 3.38Å; W1072-F1095 WeakPolarHBondContact CZ2-O 3.3Å; D1092-F1095 PolarHBondContact O-N 3.22Å; A1093-F1095 VanDerWaalsContact C-N 3.31Å; A1093-F1095 PolarHBondContact O-N 3.42Å; F1095-P1099 WeakPolarHBondContact O-CD 3.35Å; F1095-L1147 HydrophobicContact CE2-CD1 3.87Å; F1095-L1147 HydrophobicContact CZ-CB 4.39Å; F1095-L1147 HydrophobicContact CZ-CD1 4Å; F1095-L1147 HydrophobicContact CZ-CD2 3.8Å; F1095-L1147 HydrophobicContact CZ-CG 4.27Å; F1095-L1151 HydrophobicContact CD1-CD1 3.8Å; F1095-L1151 HydrophobicContact CD1-CD2 4.21Å; F1095-L1151 HydrophobicContact CD1-CG 4.42Å; F1095-L1151 HydrophobicContact CE1-CD1 3.96Å; F1095-L1151 HydrophobicContact CE1-CD2 4.43Å; F1095-L1151 HydrophobicContact CE1-CG 4.36Å
1096	L	90.4	Very high	81.2	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-77.2	-38.2	-177.9	-61.3	-178.6	0	0	0	112.5	L1037 W1072 F1075 A1076 I1079 D1092 A1093 Y1128	L1037-L1096 HydrophobicContact CD2-CD2 3.88Å; W1072-L1096 HydrophobicContact CZ2-CD2 4.39Å; W1072-L1096 PolarHBondContact NE1-O 2.94Å; W1072-L1096 VanDerWaalsContact NE1-O 3.08Å; F1075-L1096 HydrophobicContact CD1-CD2 4.16Å; F1075-L1096 HydrophobicContact CE1-CD2 3.73Å; A1076-L1096 HydrophobicContact CB-CB 4.16Å; A1076-L1096 HydrophobicContact CB-CD2 4.15Å; I1079-L1096 HydrophobicContact CB-CD1 4.15Å; I1079-L1096 HydrophobicContact CD1-CD2 3.98Å; I1079-L1096 HydrophobicContact CG2-CD1 3.87Å; D1092-L1096 HydrophobicContact CB-CD1 4.12Å; D1092-L1096 HydrophobicContact CB-CG 4.49Å; D1092-L1096 PolarHBondContact O-N 3.27Å; D1092-L1096 VanDerWaalsContact O-N 3.17Å; A1093-L1096 PolarHBondContact O-N 2.97Å; L1096-Y1128 HydrophobicContact CB-CE2 4.28Å; L1096-Y1128 HydrophobicContact CD1-CE2 3.9Å; L1096-Y1128 VanDerWaalsContact CD1-OH 3.32Å; L1096-Y1128 WeakPolarHBondContact CD1-OH 3.23Å
1097	V	88.7	Confident	80.2	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-73.9	-36.7	-178.5	167.7	0	0	0	0	112	A1093 I1100 L1101 L1125 Y1128 L1162 Y1165 F1166	A1093-V1097 VanDerWaalsContact O-CB 3.25Å; A1093-V1097 WeakPolarHBondContact O-CB 3.47Å; A1093-V1097 VanDerWaalsContact O-CG2 3.28Å; A1093-V1097 WeakPolarHBondContact O-CG2 3.38Å; A1093-V1097 PolarHBondContact O-N 3.17Å; V1097-I1100 PolarHBondContact O-N 3.41Å; V1097-I1100 VanDerWaalsContact O-N 3.17Å; V1097-L1101 HydrophobicContact CG1-CB 4.41Å; V1097-L1101 WeakPolarHBondContact O-CB 3.49Å; V1097-L1101 PolarHBondContact O-N 3.06Å; V1097-L1125 HydrophobicContact CB-CD2 4.43Å; V1097-L1125 HydrophobicContact CG1-CD2 3.69Å; V1097-L1125 HydrophobicContact CG2-CD2 4.34Å; V1097-Y1128 HydrophobicContact CG2-CD2 3.92Å; V1097-Y1128 HydrophobicContact CG2-CG 4.21Å; V1097-L1162 HydrophobicContact CG1-CD2 3.98Å; V1097-Y1165 HydrophobicContact CG1-CD1 4.1Å; V1097-Y1165 HydrophobicContact CG1-CE1 3.86Å; V1097-F1166 HydrophobicContact CB-CZ 4.08Å; V1097-F1166 HydrophobicContact CG1-CZ 4.13Å; V1097-F1166 HydrophobicContact CG2-CZ 3.98Å
1098	C	87.7	Confident	79.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.2	-50.8	-171.7	-176.6	0	0	0	0	113.7	P1094 I1100 L1101 L1102 L1151 T1155 L1162	P1094-C1098 WeakPolarHBondContact O-CB 3.34Å; P1094-C1098 PolarHBondContact O-N 3.47Å; C1098-I1100 VanDerWaalsContact C-N 3.34Å; C1098-I1100 PolarHBondContact O-N 3.29Å; C1098-L1101 PolarHBondContact O-N 2.84Å; C1098-L1102 WeakPolarHBondContact O-CB 3.19Å; C1098-L1102 PolarHBondContact O-N 3.44Å; C1098-L1151 HydrophobicContact CB-CD1 4.46Å; C1098-T1155 VanDerWaalsContact SG-CG2 3.57Å; C1098-L1162 HydrophobicContact CB-CD1 3.84Å; C1098-L1162 HydrophobicContact CB-CD2 4.09Å; C1098-L1162 HydrophobicContact CB-CG 4.38Å
1099	P	86.3	Confident	77.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68.7	-31.3	-179.7	-24.3	38.9	0	0	0	113.4	T1041 Q1044 I1045 L1048 W1072 F1095 S1103	T1041-P1099 HydrophobicContact CG2-CG 3.94Å; Q1044-P1099 HydrophobicContact CB-CG 4.37Å; Q1044-P1099 HydrophobicContact CG-CB 3.76Å; Q1044-P1099 HydrophobicContact CG-CG 4.1Å; I1045-P1099 HydrophobicContact CG1-CG 4.42Å; L1048-P1099 HydrophobicContact CD1-CB 3.92Å; W1072-P1099 HydrophobicContact CD2-CB 4.11Å; W1072-P1099 HydrophobicContact CD2-CG 4.14Å; W1072-P1099 VanDerWaalsContact CE2-CG 3.48Å; W1072-P1099 HydrophobicContact CG-CB 4.12Å; W1072-P1099 HydrophobicContact CH2-CG 4.26Å; W1072-P1099 HydrophobicContact CZ2-CB 4.4Å; W1072-P1099 HydrophobicContact CZ2-CG 3.57Å; F1095-P1099 WeakPolarHBondContact O-CD 3.35Å; P1099-S1103 WeakPolarHBondContact O-CB 3.41Å; P1099-S1103 PolarHBondContact O-N 2.81Å; P1099-S1103 PolarHBondContact O-OG 3Å
1100	I	85.5	Confident	76.6	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-66.6	-46.7	174.9	-56.4	176.9	0	0	0	109.8	V1073 A1076 V1097 C1098 S1103 N1104 I1124 L1125	V1073-I1100 HydrophobicContact CG2-CD1 4.36Å; V1073-I1100 HydrophobicContact CG2-CG1 4.33Å; A1076-I1100 HydrophobicContact CB-CD1 4.3Å; V1097-I1100 PolarHBondContact O-N 3.41Å; V1097-I1100 VanDerWaalsContact O-N 3.17Å; C1098-I1100 VanDerWaalsContact C-N 3.34Å; C1098-I1100 PolarHBondContact O-N 3.29Å; I1100-S1103 PolarHBondContact O-N 2.87Å; I1100-S1103 PolarHBondContact O-OG 3.42Å; I1100-N1104 PolarHBondContact O-N 3.3Å; I1100-I1124 HydrophobicContact CD1-CD1 4.43Å; I1100-I1124 HydrophobicContact CD1-CG2 4.03Å; I1100-L1125 HydrophobicContact CB-CD2 4.41Å; I1100-L1125 HydrophobicContact CG2-CD1 3.86Å; I1100-L1125 HydrophobicContact CG2-CD2 4.14Å; I1100-L1125 HydrophobicContact CG2-CG 4.04Å
1101	L	82.4	Confident	75.6	Confident	25 Å²	25	28.9 Å²	28.9	13%	0.131	16%	0.157	C	C	.	.	H	α-helix	trans	-63.9	-44.6	179.1	-171.9	67.9	0	0	0	111.3	V1097 C1098 S1103 N1104 L1162 Y1165	V1097-L1101 HydrophobicContact CG1-CB 4.41Å; V1097-L1101 WeakPolarHBondContact O-CB 3.49Å; V1097-L1101 PolarHBondContact O-N 3.06Å; C1098-L1101 PolarHBondContact O-N 2.84Å; L1101-S1103 PolarHBondContact O-N 3.32Å; L1101-N1104 PolarHBondContact O-N 3.06Å; L1101-L1162 HydrophobicContact CD2-CD2 4.23Å; L1101-Y1165 HydrophobicContact CD1-CD2 3.93Å; L1101-Y1165 HydrophobicContact CD1-CE2 4.21Å; L1101-Y1165 HydrophobicContact CD2-CD2 4.27Å; L1101-Y1165 HydrophobicContact CD2-CG 4.16Å
1102	L	79.1	Confident	74.5	Confident	4 Å²	4	30 Å²	30	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-57	-40.6	175.2	-172.8	66.7	0	0	0	111.1	I1045 L1048 C1098 T1105 T1155 D1157 C1160	I1045-L1102 HydrophobicContact CG1-CD2 4.41Å; I1045-L1102 HydrophobicContact CG2-CD2 4.26Å; L1048-L1102 HydrophobicContact CB-CD2 4.28Å; L1048-L1102 HydrophobicContact CD1-CD2 4.28Å; C1098-L1102 WeakPolarHBondContact O-CB 3.19Å; C1098-L1102 PolarHBondContact O-N 3.44Å; L1102-T1105 PolarHBondContact O-OG1 2.89Å; L1102-T1155 HydrophobicContact CD2-CG2 4.48Å; L1102-D1157 HydrophobicContact CD1-CB 3.78Å; L1102-C1160 HydrophobicContact CB-CB 4.39Å; L1102-C1160 HydrophobicContact CD1-CB 3.8Å
1103	S	74.4	Confident	73.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-72.5	-33.5	178.2	76.6	0	0	0	0	114.3	L1069 P1099 I1100 L1101 T1105 L1106	L1069-S1103 WeakPolarHBondContact CD1-OG 3.36Å; L1069-S1103 VanDerWaalsContact CD2-OG 3.25Å; L1069-S1103 WeakPolarHBondContact CD2-OG 3.25Å; P1099-S1103 WeakPolarHBondContact O-CB 3.41Å; P1099-S1103 PolarHBondContact O-N 2.81Å; P1099-S1103 PolarHBondContact O-OG 3Å; I1100-S1103 PolarHBondContact O-N 2.87Å; I1100-S1103 PolarHBondContact O-OG 3.42Å; L1101-S1103 PolarHBondContact O-N 3.32Å; S1103-T1105 PolarHBondContact O-N 3.35Å; S1103-T1105 VanDerWaalsContact O-N 3.15Å; S1103-L1106 WeakPolarHBondContact O-CA 3.29Å; S1103-L1106 VanDerWaalsContact O-CB 3.25Å; S1103-L1106 WeakPolarHBondContact O-CB 3.47Å; S1103-L1106 PolarHBondContact O-N 3.19Å
1104	N	66.6	Low	72.5	Confident	50 Å²	50	35.3 Å²	35.3	27%	0.267	20%	0.195	S	C	.	.	H	α-helix	trans	-65.7	-18.1	179.5	-78.5	-8.9	0	0	0	113.1	I1100 L1101 L1106 T1110 L1125	I1100-N1104 PolarHBondContact O-N 3.3Å; L1101-N1104 PolarHBondContact O-N 3.06Å; N1104-L1106 PolarHBondContact O-N 3.49Å; N1104-T1110 WeakPolarHBondContact OD1-CG2 3.37Å; N1104-L1125 WeakPolarHBondContact ND2-CD1 3.38Å
1105	T	61.5	Low	71.8	Confident	51 Å²	51	39 Å²	39	31%	0.313	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.2	172.8	69.9	0	0	0	0	111.5	L1102 S1103 K1107 S1159	L1102-T1105 PolarHBondContact O-OG1 2.89Å; S1103-T1105 PolarHBondContact O-N 3.35Å; S1103-T1105 VanDerWaalsContact O-N 3.15Å; T1105-K1107 PolarHBondContact O-N 3.08Å; T1105-S1159 WeakPolarHBondContact CG2-OG 3.42Å
1106	L	56.8	Low	71.2	Confident	43 Å²	43	43.3 Å²	43.3	23%	0.225	24%	0.244	C	C	.	.	S	Bend	trans	-88.1	86.4	169.3	-57	164.5	0	0	0	108.5	S1103 N1104 D1108 L1109	S1103-L1106 WeakPolarHBondContact O-CA 3.29Å; S1103-L1106 VanDerWaalsContact O-CB 3.25Å; S1103-L1106 WeakPolarHBondContact O-CB 3.47Å; S1103-L1106 PolarHBondContact O-N 3.19Å; N1104-L1106 PolarHBondContact O-N 3.49Å; L1106-D1108 PolarHBondContact O-N 2.85Å; L1106-L1109 HydrophobicContact CB-CB 4.29Å; L1106-L1109 HydrophobicContact CD1-CD1 4.44Å; L1106-L1109 PolarHBondContact O-N 3.29Å
1107	K	57.3	Low	70.7	Confident	178 Å²	178	43.7 Å²	43.7	77%	0.774	25%	0.247	S	C	*	.	H	α-helix	trans	-47.7	-31.2	-177.4	-75.2	-179.1	177.1	176.5	0	114	T1105 T1110	T1105-K1107 PolarHBondContact O-N 3.08Å; K1107-T1110 PolarHBondContact O-OG1 3Å
1108	D	56.2	Low	70.1	Confident	116 Å²	116	48.3 Å²	48.3	62%	0.62	26%	0.264	S	S	*	.	H	α-helix	trans	-74.2	-19.5	-178.2	-60.5	-34.1	0	0	0	114.1	L1106 S1111	L1106-D1108 PolarHBondContact O-N 2.85Å; D1108-S1111 PolarHBondContact O-OG 3.49Å
1109	L	54.4	Low	69.9	Low	1 Å²	1	54.7 Å²	54.7	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-83.7	-40	-176	-122.2	84.4	0	0	0	113.5	Q1065 L1069 L1106 S1111 A1112 L1113	Q1065-L1109 HydrophobicContact CB-CD1 3.43Å; Q1065-L1109 VanDerWaalsContact CB-CD1 3.43Å; Q1065-L1109 HydrophobicContact CB-CD2 3.92Å; Q1065-L1109 HydrophobicContact CB-CG 4.14Å; Q1065-L1109 HydrophobicContact CG-CD1 4.29Å; L1069-L1109 HydrophobicContact CB-CD2 3.83Å; L1069-L1109 HydrophobicContact CD2-CD2 3.71Å; L1069-L1109 HydrophobicContact CG-CD2 4.4Å; L1106-L1109 HydrophobicContact CB-CB 4.29Å; L1106-L1109 HydrophobicContact CD1-CD1 4.44Å; L1106-L1109 PolarHBondContact O-N 3.29Å; L1109-S1111 VanDerWaalsContact C-N 3.26Å; L1109-S1111 PolarHBondContact O-N 3.34Å; L1109-A1112 WeakPolarHBondContact O-CB 3.5Å; L1109-A1112 PolarHBondContact O-N 2.97Å; L1109-A1112 VanDerWaalsContact O-N 3.07Å; L1109-L1113 PolarHBondContact O-N 2.92Å
1110	T	57.6	Low	69.9	Low	40 Å²	40	57.1 Å²	57.1	25%	0.245	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-31.7	-178	26.7	0	0	0	0	113.1	N1104 K1107 A1112 R1118	N1104-T1110 WeakPolarHBondContact OD1-CG2 3.37Å; K1107-T1110 PolarHBondContact O-OG1 3Å; T1110-A1112 VanDerWaalsContact C-N 3.34Å; T1110-R1118 VanDerWaalsContact O-CZ 3.25Å; T1110-R1118 PolarHBondContact O-NE 2.83Å; T1110-R1118 PolarHBondContact O-NH2 3.4Å; T1110-R1118 VanDerWaalsContact O-NH2 3.12Å
1111	S	63.7	Low	69.9	Low	81 Å²	81	57.2 Å²	57.2	57%	0.566	30%	0.304	S	S	*	.	H	α-helix	trans	-74.4	-24.8	175	54.7	0	0	0	0	112.6	D1108 L1109 R1118	D1108-S1111 PolarHBondContact O-OG 3.49Å; L1109-S1111 VanDerWaalsContact C-N 3.26Å; L1109-S1111 PolarHBondContact O-N 3.34Å; S1111-R1118 PolarHBondContact O-NH2 3.34Å
1112	A	58.3	Low	70	Confident	38 Å²	38	60.9 Å²	60.9	31%	0.314	32%	0.323	S	S	.	.	H	α-helix	trans	-80.3	-27.2	178.1	0	0	0	0	0	113.4	H1066 L1109 T1110 N1114	H1066-A1112 PolarHBondContact CD2-O 3.43Å; H1066-A1112 VanDerWaalsContact CD2-O 3.23Å; H1066-A1112 PolarHBondContact NE2-O 3.23Å; H1066-A1112 VanDerWaalsContact NE2-O 3.11Å; L1109-A1112 WeakPolarHBondContact O-CB 3.5Å; L1109-A1112 PolarHBondContact O-N 2.97Å; L1109-A1112 VanDerWaalsContact O-N 3.07Å; T1110-A1112 VanDerWaalsContact C-N 3.34Å; A1112-N1114 PolarHBondContact O-N 2.86Å
1113	L	64.1	Low	70.4	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.016	34%	0.339	C	S	.	.	S	Bend	trans	-57.3	133.5	177.4	-74.4	176.1	0	0	0	112	H1066 L1069 L1109 R1118	H1066-L1113 WeakPolarHBondContact NE2-CA 3.31Å; L1069-L1113 HydrophobicContact CB-CD2 4.44Å; L1069-L1113 HydrophobicContact CD2-CD1 3.69Å; L1069-L1113 HydrophobicContact CD2-CD2 4.12Å; L1069-L1113 HydrophobicContact CD2-CG 4.04Å; L1069-L1113 HydrophobicContact CG-CD1 4.24Å; L1069-L1113 HydrophobicContact CG-CD2 4.12Å; L1109-L1113 PolarHBondContact O-N 2.92Å; L1113-R1118 HydrophobicContact CB-CB 4.35Å; L1113-R1118 PolarHBondContact O-NH2 2.94Å
1114	N	71.4	Confident	71	Confident	110 Å²	110	64.4 Å²	64.4	59%	0.588	34%	0.339	S	S	*	.			trans	-50.4	151.1	168.5	-73.8	-3.8	0	0	0	111.2	A1112 D1116 S1117 R1118	A1112-N1114 PolarHBondContact O-N 2.86Å; N1114-D1116 PolarHBondContact O-N 3.4Å; N1114-S1117 PolarHBondContact O-N 3.31Å; N1114-R1118 PolarHBondContact O-N 2.87Å
1115	S	74.8	Confident	72	Confident	78 Å²	78	62.8 Å²	62.8	55%	0.545	33%	0.33	S	S	.	.	H	α-helix	trans	-52.4	-35.7	-173.5	56.7	0	0	0	0	113.5	K1119	S1115-K1119 WeakPolarHBondContact O-CG 3.49Å; S1115-K1119 PolarHBondContact O-N 3Å; S1115-K1119 VanDerWaalsContact O-N 3.16Å
1116	D	77.8	Confident	73.2	Confident	91 Å²	91	66.1 Å²	66.1	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-78.4	-46.4	-176.1	-60.4	-20.7	0	0	0	111.8	N1114 R1118 K1119 H1120	N1114-D1116 PolarHBondContact O-N 3.4Å; D1116-R1118 PolarHBondContact O-N 3.17Å; D1116-K1119 WeakPolarHBondContact O-CB 3.44Å; D1116-K1119 PolarHBondContact O-N 3.02Å; D1116-K1119 VanDerWaalsContact O-N 3.1Å; D1116-H1120 VanDerWaalsContact O-CG 3.3Å; D1116-H1120 PolarHBondContact O-N 3.43Å
1117	S	79.7	Confident	74.8	Confident	8 Å²	8	67.3 Å²	67.3	6%	0.056	35%	0.346	C	S	.	.	H	α-helix	trans	-59.3	-37.2	173.8	-55.4	0	0	0	0	111.6	S1070 V1073 N1114 H1120 S1121	S1070-S1117 PolarHBondContact OG-OG 3.47Å; V1073-S1117 WeakPolarHBondContact CG1-O 3.5Å; N1114-S1117 PolarHBondContact O-N 3.31Å; S1117-H1120 PolarHBondContact O-N 3.47Å; S1117-S1121 WeakPolarHBondContact O-CB 3.37Å; S1117-S1121 PolarHBondContact O-N 3.4Å; S1117-S1121 PolarHBondContact O-OG 2.9Å
1118	R	77.7	Confident	76.3	Confident	96 Å²	96	58.9 Å²	58.9	36%	0.362	31%	0.309	S	S	.	.	H	α-helix	trans	-65.6	-41.5	175.2	-167.9	-177.2	-59.3	160.5	12.4	112.5	T1110 S1111 L1113 N1114 D1116 S1121 I1122	T1110-R1118 VanDerWaalsContact O-CZ 3.25Å; T1110-R1118 PolarHBondContact O-NE 2.83Å; T1110-R1118 PolarHBondContact O-NH2 3.4Å; T1110-R1118 VanDerWaalsContact O-NH2 3.12Å; S1111-R1118 PolarHBondContact O-NH2 3.34Å; L1113-R1118 HydrophobicContact CB-CB 4.35Å; L1113-R1118 PolarHBondContact O-NH2 2.94Å; N1114-R1118 PolarHBondContact O-N 2.87Å; D1116-R1118 PolarHBondContact O-N 3.17Å; R1118-S1121 PolarHBondContact O-OG 2.81Å; R1118-I1122 HydrophobicContact CG-CD1 4.1Å; R1118-I1122 VanDerWaalsContact O-CG1 3.3Å; R1118-I1122 WeakPolarHBondContact O-CG1 3.37Å; R1118-I1122 PolarHBondContact O-N 2.92Å; R1118-I1122 VanDerWaalsContact O-N 3.13Å
1119	K	82.8	Confident	77.9	Confident	135 Å²	135	58 Å²	58	59%	0.587	30%	0.299	S	S	*	.	H	α-helix	trans	-62.9	-45.4	174.5	-75.2	171.5	-175.5	171.2	0	110.9	S1115 D1116 H1123	S1115-K1119 WeakPolarHBondContact O-CG 3.49Å; S1115-K1119 PolarHBondContact O-N 3Å; S1115-K1119 VanDerWaalsContact O-N 3.16Å; D1116-K1119 WeakPolarHBondContact O-CB 3.44Å; D1116-K1119 PolarHBondContact O-N 3.02Å; D1116-K1119 VanDerWaalsContact O-N 3.1Å; K1119-H1123 VanDerWaalsContact O-CB 3.23Å; K1119-H1123 WeakPolarHBondContact O-CB 3.04Å; K1119-H1123 PolarHBondContact O-N 3.46Å
1120	H	85.8	Confident	79.4	Confident	50 Å²	50	62.7 Å²	62.7	23%	0.231	32%	0.321	C	S	.	.	H	α-helix	trans	-60.9	-45.5	177.7	-65.9	163.2	0	0	0	111.6	V1073 Y1077 D1116 S1117 H1123 I1124	V1073-H1120 HydrophobicContact CG1-CB 3.81Å; Y1077-H1120 AromaticContact CD1-CE1 3.86Å; Y1077-H1120 AromaticContact CD1-ND1 3.88Å; Y1077-H1120 HydrophobicContact CD2-CB 3.76Å; Y1077-H1120 AromaticContact CD2-CD2 3.77Å; Y1077-H1120 AromaticContact CD2-CG 3.69Å; Y1077-H1120 AromaticContact CE1-CD2 3.9Å; Y1077-H1120 AromaticContact CE1-CE1 3.81Å; Y1077-H1120 AromaticContact CE1-NE2 3.61Å; Y1077-H1120 HydrophobicContact CE2-CB 4.31Å; Y1077-H1120 AromaticContact CE2-CD2 3.49Å; Y1077-H1120 VanDerWaalsContact CE2-CD2 3.49Å; Y1077-H1120 WeakPolarHBondContact CE2-CD2 3.22Å; Y1077-H1120 AromaticContact CE2-CG 3.92Å; Y1077-H1120 HydrophobicContact CG-CB 4.04Å; Y1077-H1120 AromaticContact CG-CG 3.77Å; Y1077-H1120 AromaticContact CG-ND1 3.91Å; Y1077-H1120 AromaticContact CZ-CD2 3.55Å; Y1077-H1120 AromaticContact CZ-NE2 3.6Å; D1116-H1120 VanDerWaalsContact O-CG 3.3Å; D1116-H1120 PolarHBondContact O-N 3.43Å; S1117-H1120 PolarHBondContact O-N 3.47Å; H1120-H1123 PolarHBondContact O-N 3.28Å; H1120-I1124 WeakPolarHBondContact O-CB 3.27Å; H1120-I1124 WeakPolarHBondContact O-CD1 3.49Å; H1120-I1124 WeakPolarHBondContact O-CG1 3.39Å; H1120-I1124 PolarHBondContact O-N 3.08Å
1121	S	84.8	Confident	80.8	Confident	4 Å²	4	61.7 Å²	61.7	3%	0.028	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-45.6	-179.8	69.9	0	0	0	0	112.5	S1117 R1118 H1123 I1124 L1125	S1117-S1121 WeakPolarHBondContact O-CB 3.37Å; S1117-S1121 PolarHBondContact O-N 3.4Å; S1117-S1121 PolarHBondContact O-OG 2.9Å; R1118-S1121 PolarHBondContact O-OG 2.81Å; S1121-H1123 VanDerWaalsContact C-N 3.3Å; S1121-H1123 PolarHBondContact O-N 2.72Å; S1121-I1124 PolarHBondContact O-N 3.03Å; S1121-L1125 WeakPolarHBondContact O-CB 3.29Å; S1121-L1125 VanDerWaalsContact O-CG 3.23Å; S1121-L1125 WeakPolarHBondContact O-CG 3.46Å; S1121-L1125 PolarHBondContact O-N 3.48Å
1122	I	84.3	Confident	81.8	Confident	102 Å²	102	57.9 Å²	57.9	52%	0.523	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-42.8	175.8	-66.9	168.2	0	0	0	110.5	R1118 K1126	R1118-I1122 HydrophobicContact CG-CD1 4.1Å; R1118-I1122 VanDerWaalsContact O-CG1 3.3Å; R1118-I1122 WeakPolarHBondContact O-CG1 3.37Å; R1118-I1122 PolarHBondContact O-N 2.92Å; R1118-I1122 VanDerWaalsContact O-N 3.13Å; I1122-K1126 WeakPolarHBondContact O-CB 3.45Å; I1122-K1126 PolarHBondContact O-N 3.07Å
1123	H	87.6	Confident	83.1	Confident	78 Å²	78	59 Å²	59	36%	0.361	30%	0.299	S	S	.	.	H	α-helix	trans	-63.3	-50	179.5	-171.3	61.5	0	0	0	111.6	F1080 K1119 H1120 S1121 L1125 K1126 M1127	F1080-H1123 AromaticContact CE1-CD2 3.52Å; F1080-H1123 AromaticContact CE1-NE2 3.58Å; F1080-H1123 AromaticContact CZ-CD2 3.62Å; F1080-H1123 AromaticContact CZ-NE2 3.39Å; F1080-H1123 WeakPolarHBondContact CZ-NE2 3.37Å; K1119-H1123 VanDerWaalsContact O-CB 3.23Å; K1119-H1123 WeakPolarHBondContact O-CB 3.04Å; K1119-H1123 PolarHBondContact O-N 3.46Å; H1120-H1123 PolarHBondContact O-N 3.28Å; S1121-H1123 VanDerWaalsContact C-N 3.3Å; S1121-H1123 PolarHBondContact O-N 2.72Å; H1123-L1125 PolarHBondContact O-N 3.01Å; H1123-K1126 PolarHBondContact O-N 2.98Å; H1123-M1127 WeakPolarHBondContact O-CB 3.4Å; H1123-M1127 VanDerWaalsContact O-CG 3.23Å; H1123-M1127 WeakPolarHBondContact O-CG 3.16Å; H1123-M1127 PolarHBondContact O-N 2.99Å
1124	I	87.9	Confident	84	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-56	-51.2	177	-71.4	164.5	0	0	0	110.9	A1076 Y1077 F1080 I1100 H1120 S1121 K1126 M1127 Y1128	A1076-I1124 HydrophobicContact CB-CD1 3.98Å; Y1077-I1124 HydrophobicContact CD2-CD1 4.13Å; Y1077-I1124 HydrophobicContact CD2-CG1 4.2Å; F1080-I1124 HydrophobicContact CB-CG1 4.41Å; F1080-I1124 HydrophobicContact CG-CG1 4.33Å; I1100-I1124 HydrophobicContact CD1-CD1 4.43Å; I1100-I1124 HydrophobicContact CD1-CG2 4.03Å; H1120-I1124 WeakPolarHBondContact O-CB 3.27Å; H1120-I1124 WeakPolarHBondContact O-CD1 3.49Å; H1120-I1124 WeakPolarHBondContact O-CG1 3.39Å; H1120-I1124 PolarHBondContact O-N 3.08Å; S1121-I1124 PolarHBondContact O-N 3.03Å; I1124-K1126 PolarHBondContact O-N 3.5Å; I1124-M1127 PolarHBondContact O-N 2.97Å; I1124-Y1128 HydrophobicContact CG2-CD2 3.58Å; I1124-Y1128 HydrophobicContact CG2-CE2 3.77Å; I1124-Y1128 WeakPolarHBondContact O-CB 3.49Å; I1124-Y1128 WeakPolarHBondContact O-CD2 3.3Å; I1124-Y1128 PolarHBondContact O-N 3.14Å
1125	L	86.9	Confident	84.6	Confident	16 Å²	16	58.5 Å²	58.5	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-57.3	-51	179.8	-76.2	176.8	0	0	0	111.3	V1097 I1100 N1104 S1121 H1123 K1129 Y1165	V1097-L1125 HydrophobicContact CB-CD2 4.43Å; V1097-L1125 HydrophobicContact CG1-CD2 3.69Å; V1097-L1125 HydrophobicContact CG2-CD2 4.34Å; I1100-L1125 HydrophobicContact CB-CD2 4.41Å; I1100-L1125 HydrophobicContact CG2-CD1 3.86Å; I1100-L1125 HydrophobicContact CG2-CD2 4.14Å; I1100-L1125 HydrophobicContact CG2-CG 4.04Å; N1104-L1125 WeakPolarHBondContact ND2-CD1 3.38Å; S1121-L1125 WeakPolarHBondContact O-CB 3.29Å; S1121-L1125 VanDerWaalsContact O-CG 3.23Å; S1121-L1125 WeakPolarHBondContact O-CG 3.46Å; S1121-L1125 PolarHBondContact O-N 3.48Å; H1123-L1125 PolarHBondContact O-N 3.01Å; L1125-K1129 VanDerWaalsContact O-CB 3.22Å; L1125-K1129 WeakPolarHBondContact O-CB 3.46Å; L1125-K1129 PolarHBondContact O-N 3.29Å; L1125-Y1165 VanDerWaalsContact C-OH 3.24Å; L1125-Y1165 WeakPolarHBondContact CA-OH 3.3Å; L1125-Y1165 VanDerWaalsContact CB-OH 3.3Å; L1125-Y1165 WeakPolarHBondContact CB-OH 3.42Å; L1125-Y1165 PolarHBondContact O-OH 3.04Å
1126	K	88	Confident	84.9	Confident	120 Å²	120	61.4 Å²	61.4	52%	0.522	32%	0.319	S	S	.	.	H	α-helix	trans	-60.2	-51.8	-179.9	-177.5	-178.3	174	-174.7	0	111.7	I1122 H1123 I1124 K1129 E1130	I1122-K1126 WeakPolarHBondContact O-CB 3.45Å; I1122-K1126 PolarHBondContact O-N 3.07Å; H1123-K1126 PolarHBondContact O-N 2.98Å; I1124-K1126 PolarHBondContact O-N 3.5Å; K1126-K1129 PolarHBondContact O-N 3.01Å; K1126-E1130 WeakPolarHBondContact CE-OE1 3.37Å; K1126-E1130 WeakPolarHBondContact CG-OE1 3.33Å; K1126-E1130 IonicContact NZ-OE1 3.96Å; K1126-E1130 WeakPolarHBondContact O-CG 3.4Å; K1126-E1130 PolarHBondContact O-N 2.99Å
1127	M	88.9	Confident	85.2	Confident	69 Å²	69	59.7 Å²	59.7	34%	0.34	31%	0.314	S	S	.	.	H	α-helix	trans	-65.2	-45	-174.3	-67.8	-59.4	-59.9	0	0	112	F1080 Y1089 H1123 I1124 K1129 E1130 A1131	F1080-M1127 HydrophobicContact CE2-CB 3.73Å; F1080-M1127 HydrophobicContact CE2-CG 4.06Å; F1080-M1127 HydrophobicContact CZ-CB 4.23Å; F1080-M1127 HydrophobicContact CZ-CG 4.04Å; Y1089-M1127 WeakPolarHBondContact OH-CB 3.43Å; H1123-M1127 WeakPolarHBondContact O-CB 3.4Å; H1123-M1127 VanDerWaalsContact O-CG 3.23Å; H1123-M1127 WeakPolarHBondContact O-CG 3.16Å; H1123-M1127 PolarHBondContact O-N 2.99Å; I1124-M1127 PolarHBondContact O-N 2.97Å; M1127-K1129 VanDerWaalsContact C-N 3.34Å; M1127-K1129 PolarHBondContact O-N 2.94Å; M1127-E1130 PolarHBondContact O-N 3.46Å; M1127-A1131 VanDerWaalsContact O-CB 3.31Å; M1127-A1131 WeakPolarHBondContact O-CB 3.12Å; M1127-A1131 PolarHBondContact O-N 3.28Å
1128	Y	90.1	Very high	85.4	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-66.4	-36.5	176.8	-80.8	-53.4	0	0	0	112.2	F1080 Y1089 A1093 L1096 V1097 I1124 A1131 V1132	F1080-Y1128 HydrophobicContact CB-CE2 4.34Å; F1080-Y1128 HydrophobicContact CD2-CE2 4.1Å; Y1089-Y1128 AromaticContact CD1-CD1 3.96Å; Y1089-Y1128 HydrophobicContact CD1-CD1 3.96Å; Y1089-Y1128 AromaticContact CD1-CE1 3.75Å; Y1089-Y1128 HydrophobicContact CD1-CE1 3.75Å; Y1089-Y1128 AromaticContact CD2-CE1 3.79Å; Y1089-Y1128 HydrophobicContact CD2-CE1 3.79Å; Y1089-Y1128 AromaticContact CE1-CD1 3.31Å; Y1089-Y1128 HydrophobicContact CE1-CD1 3.31Å; Y1089-Y1128 AromaticContact CE1-CE1 3.38Å; Y1089-Y1128 HydrophobicContact CE1-CE1 3.38Å; Y1089-Y1128 HydrophobicContact CE1-CG 4.34Å; Y1089-Y1128 HydrophobicContact CE2-CD1 4.14Å; Y1089-Y1128 AromaticContact CE2-CE1 3.44Å; Y1089-Y1128 HydrophobicContact CE2-CE1 3.44Å; Y1089-Y1128 VanDerWaalsContact CE2-CE1 3.44Å; Y1089-Y1128 AromaticContact CE2-CZ 3.8Å; Y1089-Y1128 AromaticContact CG-CE1 3.9Å; Y1089-Y1128 HydrophobicContact CG-CE1 3.9Å; Y1089-Y1128 AromaticContact CZ-CD1 3.38Å; Y1089-Y1128 AromaticContact CZ-CE1 3.17Å; Y1089-Y1128 AromaticContact CZ-CZ 3.85Å; Y1089-Y1128 WeakPolarHBondContact O-CE1 3.45Å; Y1089-Y1128 WeakPolarHBondContact OH-CD1 3.22Å; Y1089-Y1128 WeakPolarHBondContact OH-CE1 3.29Å; A1093-Y1128 HydrophobicContact CB-CD1 3.36Å; A1093-Y1128 HydrophobicContact CB-CE1 3.98Å; A1093-Y1128 HydrophobicContact CB-CG 3.78Å; L1096-Y1128 HydrophobicContact CB-CE2 4.28Å; L1096-Y1128 HydrophobicContact CD1-CE2 3.9Å; L1096-Y1128 VanDerWaalsContact CD1-OH 3.32Å; L1096-Y1128 WeakPolarHBondContact CD1-OH 3.23Å; V1097-Y1128 HydrophobicContact CG2-CD2 3.92Å; V1097-Y1128 HydrophobicContact CG2-CG 4.21Å; I1124-Y1128 HydrophobicContact CG2-CD2 3.58Å; I1124-Y1128 HydrophobicContact CG2-CE2 3.77Å; I1124-Y1128 WeakPolarHBondContact O-CB 3.49Å; I1124-Y1128 WeakPolarHBondContact O-CD2 3.3Å; I1124-Y1128 PolarHBondContact O-N 3.14Å; Y1128-A1131 PolarHBondContact O-N 2.86Å; Y1128-V1132 WeakPolarHBondContact O-CB 3.41Å; Y1128-V1132 VanDerWaalsContact O-CG2 3.29Å; Y1128-V1132 WeakPolarHBondContact O-CG2 3.39Å; Y1128-V1132 PolarHBondContact O-N 3.1Å
1129	K	88.3	Confident	85.6	Confident	97 Å²	97	71.3 Å²	71.3	42%	0.422	37%	0.368	S	S	.	.	H	α-helix	trans	-62	-47.9	175.7	-175.8	174.2	179	169.9	0	111.9	L1125 K1126 M1127 A1133 Y1165	L1125-K1129 VanDerWaalsContact O-CB 3.22Å; L1125-K1129 WeakPolarHBondContact O-CB 3.46Å; L1125-K1129 PolarHBondContact O-N 3.29Å; K1126-K1129 PolarHBondContact O-N 3.01Å; M1127-K1129 VanDerWaalsContact C-N 3.34Å; M1127-K1129 PolarHBondContact O-N 2.94Å; K1129-A1133 VanDerWaalsContact O-CB 3.24Å; K1129-A1133 WeakPolarHBondContact O-CB 2.95Å; K1129-A1133 PolarHBondContact O-N 3.29Å; K1129-Y1165 HydrophobicContact CB-CE1 3.88Å; K1129-Y1165 HydrophobicContact CD-CE1 4.25Å; K1129-Y1165 HydrophobicContact CD-CE2 4.25Å; K1129-Y1165 VanDerWaalsContact CE-O 3.23Å; K1129-Y1165 WeakPolarHBondContact CE-O 3.35Å; K1129-Y1165 HydrophobicContact CG-CE1 4.23Å
1130	E	87.8	Confident	85.5	Confident	101 Å²	101	67.5 Å²	67.5	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-44	177.9	-72	172.9	-177.2	0	0	111.2	K1126 M1127 A1133 S1134	K1126-E1130 WeakPolarHBondContact CE-OE1 3.37Å; K1126-E1130 WeakPolarHBondContact CG-OE1 3.33Å; K1126-E1130 IonicContact NZ-OE1 3.96Å; K1126-E1130 WeakPolarHBondContact O-CG 3.4Å; K1126-E1130 PolarHBondContact O-N 2.99Å; M1127-E1130 PolarHBondContact O-N 3.46Å; E1130-A1133 PolarHBondContact O-N 3.48Å; E1130-S1134 WeakPolarHBondContact O-CB 3.25Å; E1130-S1134 PolarHBondContact O-N 2.99Å
1131	A	85.7	Confident	85.4	Confident	19 Å²	19	68.3 Å²	68.3	16%	0.157	36%	0.357	C	S	.	.	H	α-helix	trans	-62.2	-50	178.7	0	0	0	0	0	112.2	Y1089 L1090 M1127 Y1128 A1133 S1134 V1135	Y1089-A1131 HydrophobicContact CD1-CB 3.96Å; Y1089-A1131 HydrophobicContact CE1-CB 3.5Å; L1090-A1131 VanDerWaalsContact CD2-C 3.48Å; L1090-A1131 HydrophobicContact CD2-CB 3.85Å; L1090-A1131 WeakPolarHBondContact CD2-O 3.18Å; M1127-A1131 VanDerWaalsContact O-CB 3.31Å; M1127-A1131 WeakPolarHBondContact O-CB 3.12Å; M1127-A1131 PolarHBondContact O-N 3.28Å; Y1128-A1131 PolarHBondContact O-N 2.86Å; A1131-A1133 VanDerWaalsContact C-N 3.33Å; A1131-A1133 PolarHBondContact O-N 2.88Å; A1131-S1134 PolarHBondContact O-N 2.88Å; A1131-S1134 VanDerWaalsContact O-N 3.11Å; A1131-S1134 PolarHBondContact O-OG 3.21Å; A1131-V1135 WeakPolarHBondContact O-CG2 3.43Å
1132	V	86	Confident	85.4	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-65	-37.4	179.6	175.8	0	0	0	0	111.5	L1090 A1093 Y1128 S1134 V1135 I1144 F1166 L1168	L1090-V1132 HydrophobicContact CD2-CG2 4.07Å; A1093-V1132 HydrophobicContact CB-CG2 3.82Å; Y1128-V1132 WeakPolarHBondContact O-CB 3.41Å; Y1128-V1132 VanDerWaalsContact O-CG2 3.29Å; Y1128-V1132 WeakPolarHBondContact O-CG2 3.39Å; Y1128-V1132 PolarHBondContact O-N 3.1Å; V1132-S1134 PolarHBondContact O-N 3.39Å; V1132-V1135 WeakPolarHBondContact O-CG2 3.12Å; V1132-V1135 PolarHBondContact O-N 2.82Å; V1132-I1144 HydrophobicContact CG1-CD1 4.32Å; V1132-I1144 HydrophobicContact CG1-CG2 4.07Å; V1132-I1144 HydrophobicContact CG2-CD1 4.45Å; V1132-F1166 HydrophobicContact CB-CB 4.45Å; V1132-F1166 HydrophobicContact CB-CD1 3.66Å; V1132-F1166 HydrophobicContact CB-CE1 4.12Å; V1132-F1166 HydrophobicContact CB-CG 4.17Å; V1132-F1166 HydrophobicContact CG1-CB 3.81Å; V1132-F1166 HydrophobicContact CG1-CD1 3.9Å; V1132-F1166 HydrophobicContact CG1-CG 3.87Å; V1132-F1166 HydrophobicContact CG2-CD1 3.9Å; V1132-F1166 HydrophobicContact CG2-CE1 3.84Å; V1132-F1166 HydrophobicContact CG2-CG 4.48Å; V1132-F1166 HydrophobicContact CG2-CZ 4.36Å; V1132-L1168 HydrophobicContact CG1-CD1 4.23Å; V1132-L1168 HydrophobicContact CG1-CD2 3.92Å; V1132-L1168 HydrophobicContact CG1-CG 4.29Å
1133	A	84	Confident	85.4	Confident	61 Å²	61	72.7 Å²	72.7	50%	0.504	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-29.9	175	0	0	0	0	0	112.7	K1129 E1130 A1131 V1135	K1129-A1133 VanDerWaalsContact O-CB 3.24Å; K1129-A1133 WeakPolarHBondContact O-CB 2.95Å; K1129-A1133 PolarHBondContact O-N 3.29Å; E1130-A1133 PolarHBondContact O-N 3.48Å; A1131-A1133 VanDerWaalsContact C-N 3.33Å; A1131-A1133 PolarHBondContact O-N 2.88Å; A1133-V1135 VanDerWaalsContact C-N 3.31Å; A1133-V1135 PolarHBondContact O-N 3.44Å
1134	S	84.4	Confident	85.3	Confident	86 Å²	86	69.1 Å²	69.1	60%	0.601	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.2	179.5	77	0	0	0	0	114.7	E1130 A1131 V1132 T1136	E1130-S1134 WeakPolarHBondContact O-CB 3.25Å; E1130-S1134 PolarHBondContact O-N 2.99Å; A1131-S1134 PolarHBondContact O-N 2.88Å; A1131-S1134 VanDerWaalsContact O-N 3.11Å; A1131-S1134 PolarHBondContact O-OG 3.21Å; V1132-S1134 PolarHBondContact O-N 3.39Å; S1134-T1136 PolarHBondContact O-N 3.46Å; S1134-T1136 VanDerWaalsContact O-N 3.13Å
1135	V	83.8	Confident	85.3	Confident	17 Å²	17	71.6 Å²	71.6	10%	0.103	38%	0.375	C	S	.	.			trans	-69.2	110.3	-177.8	-177.8	0	0	0	0	111.1	L1090 A1131 V1132 A1133 T1140 R1141 I1144	L1090-V1135 HydrophobicContact CD1-CG2 3.47Å; L1090-V1135 VanDerWaalsContact CD1-CG2 3.47Å; L1090-V1135 HydrophobicContact CD2-CG2 3.46Å; L1090-V1135 VanDerWaalsContact CD2-CG2 3.46Å; L1090-V1135 HydrophobicContact CG-CG2 4.05Å; A1131-V1135 WeakPolarHBondContact O-CG2 3.43Å; V1132-V1135 WeakPolarHBondContact O-CG2 3.12Å; V1132-V1135 PolarHBondContact O-N 2.82Å; A1133-V1135 VanDerWaalsContact C-N 3.31Å; A1133-V1135 PolarHBondContact O-N 3.44Å; V1135-T1140 HydrophobicContact CG1-CG2 4.08Å; V1135-R1141 HydrophobicContact CG1-CB 4.24Å; V1135-I1144 HydrophobicContact CG2-CD1 4.37Å
1136	T	80.9	Confident	85.3	Confident	139 Å²	139	75.3 Å²	75.3	85%	0.853	39%	0.392	S	S	*	.			trans	-89.2	-24.1	176.4	55.2	0	0	0	0	113.3	S1134 K1138	S1134-T1136 PolarHBondContact O-N 3.46Å; S1134-T1136 VanDerWaalsContact O-N 3.13Å; T1136-K1138 PolarHBondContact O-N 2.97Å
1137	C	83.4	Confident	85.3	Confident	56 Å²	56	70 Å²	70	38%	0.378	37%	0.369	S	S	.	.			trans	-69.1	117.6	178.4	-176.9	0	0	0	0	111	E1139 T1140 R1141	C1137-E1139 PolarHBondContact O-N 2.99Å; C1137-T1140 PolarHBondContact O-N 3.23Å; C1137-T1140 PolarHBondContact SG-OG1 3.22Å; C1137-R1141 WeakPolarHBondContact O-CB 3.25Å; C1137-R1141 PolarHBondContact O-N 3.14Å
1138	K	83.7	Confident	85.2	Confident	183 Å²	183	66.7 Å²	66.7	80%	0.796	35%	0.352	S	S	*	.	H	α-helix	trans	-60.4	-41.3	-178.9	-74.3	-174.7	177.7	-179.6	0	112.9	T1136 R1141 S1142	T1136-K1138 PolarHBondContact O-N 2.97Å; K1138-R1141 PolarHBondContact O-N 2.68Å; K1138-S1142 WeakPolarHBondContact O-CB 3.46Å; K1138-S1142 PolarHBondContact O-N 3.23Å
1139	E	81.8	Confident	85	Confident	165 Å²	165	69.1 Å²	69.1	77%	0.771	37%	0.369	S	S	*	.	H	α-helix	trans	-65.2	-48.6	-178.6	-69.3	176.7	176.8	0	0	111.4	C1137 R1141 S1142 R1143	C1137-E1139 PolarHBondContact O-N 2.99Å; E1139-R1141 VanDerWaalsContact C-N 3.32Å; E1139-R1141 PolarHBondContact O-N 3.24Å; E1139-S1142 PolarHBondContact O-N 2.99Å; E1139-R1143 PolarHBondContact O-N 2.64Å
1140	T	81	Confident	84.8	Confident	54 Å²	54	67.5 Å²	67.5	33%	0.331	37%	0.365	S	S	.	.	H	α-helix	trans	-59.5	-45.2	176	-46.5	0	0	0	0	110.8	V1135 C1137 S1142 R1143 I1144	V1135-T1140 HydrophobicContact CG1-CG2 4.08Å; C1137-T1140 PolarHBondContact O-N 3.23Å; C1137-T1140 PolarHBondContact SG-OG1 3.22Å; T1140-S1142 PolarHBondContact O-N 3.15Å; T1140-R1143 PolarHBondContact O-N 2.93Å; T1140-I1144 HydrophobicContact CG2-CD1 4.26Å; T1140-I1144 WeakPolarHBondContact O-CG1 3.46Å; T1140-I1144 PolarHBondContact O-N 3.08Å
1141	R	83.3	Confident	84.7	Confident	67 Å²	67	62.7 Å²	62.7	25%	0.253	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-42.8	178.1	-169.4	178.6	175.6	96.9	0.6	112.3	V1135 C1137 K1138 E1139 R1143 I1144 L1145 G1167 L1168	V1135-R1141 HydrophobicContact CG1-CB 4.24Å; C1137-R1141 WeakPolarHBondContact O-CB 3.25Å; C1137-R1141 PolarHBondContact O-N 3.14Å; K1138-R1141 PolarHBondContact O-N 2.68Å; E1139-R1141 VanDerWaalsContact C-N 3.32Å; E1139-R1141 PolarHBondContact O-N 3.24Å; R1141-R1143 VanDerWaalsContact C-N 3.32Å; R1141-R1143 PolarHBondContact O-N 2.93Å; R1141-I1144 PolarHBondContact O-N 3.35Å; R1141-L1145 WeakPolarHBondContact O-CB 3.47Å; R1141-L1145 PolarHBondContact O-N 3.42Å; R1141-G1167 PolarHBondContact NH2-O 3.11Å; R1141-L1168 HydrophobicContact CG-CD2 3.74Å
1142	S	85.1	Confident	84.6	Confident	76 Å²	76	63.2 Å²	63.2	53%	0.531	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-39.4	175.7	-170.3	0	0	0	0	111.7	K1138 E1139 T1140 L1145 E1146	K1138-S1142 WeakPolarHBondContact O-CB 3.46Å; K1138-S1142 PolarHBondContact O-N 3.23Å; E1139-S1142 PolarHBondContact O-N 2.99Å; T1140-S1142 PolarHBondContact O-N 3.15Å; S1142-L1145 PolarHBondContact O-N 3.22Å; S1142-E1146 PolarHBondContact O-N 3.33Å
1143	R	84.3	Confident	84.4	Confident	122 Å²	122	70 Å²	70	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-66.9	-43.6	177.5	-172.9	57.7	171.5	172.8	-1.5	111.8	E1139 T1140 R1141 L1145 E1146 L1147	E1139-R1143 PolarHBondContact O-N 2.64Å; T1140-R1143 PolarHBondContact O-N 2.93Å; R1141-R1143 VanDerWaalsContact C-N 3.32Å; R1141-R1143 PolarHBondContact O-N 2.93Å; R1143-L1145 VanDerWaalsContact C-N 3.33Å; R1143-L1145 PolarHBondContact O-N 2.93Å; R1143-E1146 IonicContact CZ-OE2 3.47Å; R1143-E1146 VanDerWaalsContact NH1-CD 3.29Å; R1143-E1146 IonicContact NH1-OE1 3.35Å; R1143-E1146 PolarHBondContact NH1-OE1 3.04Å; R1143-E1146 IonicContact NH1-OE2 2.73Å; R1143-E1146 PolarHBondContact NH1-OE2 2.57Å; R1143-E1146 PolarHBondContact O-N 3.33Å; R1143-L1147 WeakPolarHBondContact O-CG 3.39Å; R1143-L1147 PolarHBondContact O-N 3.07Å; R1143-L1147 VanDerWaalsContact O-N 3.07Å
1144	I	85.6	Confident	84	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-44.2	175.1	-63.3	171	0	0	0	110.3	L1090 P1094 V1132 V1135 T1140 R1141 E1146 L1147 C1148 L1168	L1090-I1144 HydrophobicContact CB-CD1 4.1Å; P1094-I1144 HydrophobicContact CG-CG2 3.92Å; V1132-I1144 HydrophobicContact CG1-CD1 4.32Å; V1132-I1144 HydrophobicContact CG1-CG2 4.07Å; V1132-I1144 HydrophobicContact CG2-CD1 4.45Å; V1135-I1144 HydrophobicContact CG2-CD1 4.37Å; T1140-I1144 HydrophobicContact CG2-CD1 4.26Å; T1140-I1144 WeakPolarHBondContact O-CG1 3.46Å; T1140-I1144 PolarHBondContact O-N 3.08Å; R1141-I1144 PolarHBondContact O-N 3.35Å; I1144-E1146 VanDerWaalsContact C-N 3.34Å; I1144-E1146 PolarHBondContact O-N 3.35Å; I1144-L1147 PolarHBondContact O-N 3.43Å; I1144-C1148 PolarHBondContact O-N 3.02Å; I1144-C1148 PolarHBondContact O-SG 3.13Å; I1144-C1148 VanDerWaalsContact O-SG 3.32Å; I1144-L1168 HydrophobicContact CG2-CD1 3.75Å
1145	L	87.7	Confident	83.5	Confident	52 Å²	52	68.8 Å²	68.8	27%	0.272	35%	0.346	S	S	.	.	H	α-helix	trans	-57.2	-46.6	176.9	178.4	67.3	0	0	0	111.6	R1141 S1142 R1143 L1147 C1148 C1149 V1163 L1168	R1141-L1145 WeakPolarHBondContact O-CB 3.47Å; R1141-L1145 PolarHBondContact O-N 3.42Å; S1142-L1145 PolarHBondContact O-N 3.22Å; R1143-L1145 VanDerWaalsContact C-N 3.33Å; R1143-L1145 PolarHBondContact O-N 2.93Å; L1145-L1147 VanDerWaalsContact C-N 3.35Å; L1145-L1147 PolarHBondContact O-N 2.92Å; L1145-C1148 PolarHBondContact O-N 3.41Å; L1145-C1149 PolarHBondContact O-N 3.48Å; L1145-C1149 PolarHBondContact O-SG 3.28Å; L1145-V1163 HydrophobicContact CD1-CB 4.45Å; L1145-V1163 HydrophobicContact CD1-CG1 3.72Å; L1145-V1163 HydrophobicContact CD1-CG2 3.91Å; L1145-L1168 HydrophobicContact CD1-CB 3.95Å
1146	E	87.6	Confident	82.7	Confident	93 Å²	93	75.9 Å²	75.9	44%	0.435	38%	0.38	S	S	.	.	H	α-helix	trans	-58.6	-45.4	176.7	-170.9	-166.8	165.8	0	0	111.9	S1142 R1143 I1144 C1149 N1150	S1142-E1146 PolarHBondContact O-N 3.33Å; R1143-E1146 IonicContact CZ-OE2 3.47Å; R1143-E1146 VanDerWaalsContact NH1-CD 3.29Å; R1143-E1146 IonicContact NH1-OE1 3.35Å; R1143-E1146 PolarHBondContact NH1-OE1 3.04Å; R1143-E1146 IonicContact NH1-OE2 2.73Å; R1143-E1146 PolarHBondContact NH1-OE2 2.57Å; R1143-E1146 PolarHBondContact O-N 3.33Å; I1144-E1146 VanDerWaalsContact C-N 3.34Å; I1144-E1146 PolarHBondContact O-N 3.35Å; E1146-C1149 PolarHBondContact O-N 3.11Å; E1146-N1150 WeakPolarHBondContact O-CB 3.23Å; E1146-N1150 VanDerWaalsContact O-CG 3.25Å; E1146-N1150 PolarHBondContact O-N 3.04Å; E1146-N1150 PolarHBondContact O-ND2 2.66Å
1147	L	86.9	Confident	82.2	Confident	8 Å²	8	70.9 Å²	70.9	4%	0.042	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-44.3	177.2	-67.1	178.3	0	0	0	112	P1094 F1095 R1143 I1144 L1145 N1150 L1151	P1094-L1147 HydrophobicContact CB-CB 4.42Å; P1094-L1147 HydrophobicContact CG-CB 4.28Å; F1095-L1147 HydrophobicContact CE2-CD1 3.87Å; F1095-L1147 HydrophobicContact CZ-CB 4.39Å; F1095-L1147 HydrophobicContact CZ-CD1 4Å; F1095-L1147 HydrophobicContact CZ-CD2 3.8Å; F1095-L1147 HydrophobicContact CZ-CG 4.27Å; R1143-L1147 WeakPolarHBondContact O-CG 3.39Å; R1143-L1147 PolarHBondContact O-N 3.07Å; R1143-L1147 VanDerWaalsContact O-N 3.07Å; I1144-L1147 PolarHBondContact O-N 3.43Å; L1145-L1147 VanDerWaalsContact C-N 3.35Å; L1145-L1147 PolarHBondContact O-N 2.92Å; L1147-N1150 PolarHBondContact O-N 3.46Å; L1147-L1151 PolarHBondContact O-N 3.41Å
1148	C	87.5	Confident	81.4	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60.1	-48.6	175.2	-71.3	0	0	0	0	111.6	I1144 L1145 N1150 L1151 D1152 L1162 V1163	I1144-C1148 PolarHBondContact O-N 3.02Å; I1144-C1148 PolarHBondContact O-SG 3.13Å; I1144-C1148 VanDerWaalsContact O-SG 3.32Å; L1145-C1148 PolarHBondContact O-N 3.41Å; C1148-N1150 VanDerWaalsContact C-N 3.27Å; C1148-N1150 PolarHBondContact O-N 3.47Å; C1148-L1151 PolarHBondContact O-N 3.3Å; C1148-L1151 VanDerWaalsContact O-N 3.16Å; C1148-D1152 WeakPolarHBondContact O-CB 3.4Å; C1148-D1152 PolarHBondContact O-N 2.93Å; C1148-L1162 HydrophobicContact CB-CB 3.82Å; C1148-L1162 HydrophobicContact CB-CD1 4.42Å; C1148-V1163 HydrophobicContact CB-CG2 3.84Å
1149	C	86.1	Confident	80.6	Confident	51 Å²	51	68.6 Å²	68.6	35%	0.345	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-37.1	178	-70.3	0	0	0	0	112.5	L1145 E1146 K1153	L1145-C1149 PolarHBondContact O-N 3.48Å; L1145-C1149 PolarHBondContact O-SG 3.28Å; E1146-C1149 PolarHBondContact O-N 3.11Å; C1149-K1153 VanDerWaalsContact O-CG 3.29Å; C1149-K1153 WeakPolarHBondContact O-CG 3.24Å; C1149-K1153 PolarHBondContact O-N 3Å; C1149-K1153 VanDerWaalsContact O-N 3.15Å
1150	N	84.7	Confident	80.2	Confident	64 Å²	64	60.8 Å²	60.8	34%	0.342	32%	0.316	S	S	.	.	H	α-helix	trans	-69.6	-35.7	177.6	-73	-22.4	0	0	0	112.5	E1146 L1147 C1148	E1146-N1150 WeakPolarHBondContact O-CB 3.23Å; E1146-N1150 VanDerWaalsContact O-CG 3.25Å; E1146-N1150 PolarHBondContact O-N 3.04Å; E1146-N1150 PolarHBondContact O-ND2 2.66Å; L1147-N1150 PolarHBondContact O-N 3.46Å; C1148-N1150 VanDerWaalsContact C-N 3.27Å; C1148-N1150 PolarHBondContact O-N 3.47Å
1151	L	85.1	Confident	80.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-71.9	-45.9	174.8	-76.4	164.2	0	0	0	111.9	T1041 Y1042 I1045 P1094 F1095 C1098 L1147 C1148 K1153 K1154 T1155 L1162	T1041-L1151 HydrophobicContact CG2-CD2 3.72Å; Y1042-L1151 HydrophobicContact CD1-CD2 4.3Å; Y1042-L1151 HydrophobicContact CE1-CD2 3.63Å; I1045-L1151 HydrophobicContact CD1-CD2 4.29Å; P1094-L1151 HydrophobicContact CB-CD1 3.67Å; P1094-L1151 WeakPolarHBondContact O-CD1 3.41Å; F1095-L1151 HydrophobicContact CD1-CD1 3.8Å; F1095-L1151 HydrophobicContact CD1-CD2 4.21Å; F1095-L1151 HydrophobicContact CD1-CG 4.42Å; F1095-L1151 HydrophobicContact CE1-CD1 3.96Å; F1095-L1151 HydrophobicContact CE1-CD2 4.43Å; F1095-L1151 HydrophobicContact CE1-CG 4.36Å; C1098-L1151 HydrophobicContact CB-CD1 4.46Å; L1147-L1151 PolarHBondContact O-N 3.41Å; C1148-L1151 PolarHBondContact O-N 3.3Å; C1148-L1151 VanDerWaalsContact O-N 3.16Å; L1151-K1153 VanDerWaalsContact C-N 3.26Å; L1151-K1153 PolarHBondContact O-N 3.45Å; L1151-K1154 WeakPolarHBondContact O-CA 3.33Å; L1151-K1154 PolarHBondContact O-N 2.94Å; L1151-T1155 PolarHBondContact O-N 3.04Å; L1151-L1162 HydrophobicContact CB-CD1 3.68Å; L1151-L1162 HydrophobicContact CD1-CD1 3.82Å; L1151-L1162 HydrophobicContact CG-CD1 4.41Å
1152	D	83.4	Confident	80.5	Confident	29 Å²	29	58.5 Å²	58.5	16%	0.155	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-36.9	178.9	-71.9	-13.8	0	0	0	111.6	C1148 K1154 T1155 L1162	C1148-D1152 WeakPolarHBondContact O-CB 3.4Å; C1148-D1152 PolarHBondContact O-N 2.93Å; D1152-K1154 PolarHBondContact O-N 3.44Å; D1152-T1155 PolarHBondContact O-OG1 3.34Å; D1152-T1155 VanDerWaalsContact O-OG1 3.08Å; D1152-L1162 WeakPolarHBondContact OD1-CB 3.34Å; D1152-L1162 WeakPolarHBondContact OD1-CG 3.44Å; D1152-L1162 PolarHBondContact OD1-N 3Å; D1152-L1162 PolarHBondContact OD2-N 3.44Å
1153	K	81.5	Confident	80.5	Confident	143 Å²	143	56.3 Å²	56.3	62%	0.622	29%	0.29	S	S	*	.	H	α-helix	trans	-62.8	-29.3	173.2	-79.1	174	-177.7	176	0	113.5	C1149 L1151 M1156	C1149-K1153 VanDerWaalsContact O-CG 3.29Å; C1149-K1153 WeakPolarHBondContact O-CG 3.24Å; C1149-K1153 PolarHBondContact O-N 3Å; C1149-K1153 VanDerWaalsContact O-N 3.15Å; L1151-K1153 VanDerWaalsContact C-N 3.26Å; L1151-K1153 PolarHBondContact O-N 3.45Å; K1153-M1156 WeakPolarHBondContact O-CE 3.23Å
1154	K	76.6	Confident	80.6	Confident	113 Å²	113	53.9 Å²	53.9	49%	0.491	30%	0.296	S	S	.	.	H	α-helix	trans	-89.4	-31.8	-177	-85.7	-176.4	167.6	-168.9	0	113.3	Y1042 L1151 D1152 M1156	Y1042-K1154 HydrophobicContact CD1-CD 3.56Å; Y1042-K1154 HydrophobicContact CE1-CD 3.16Å; Y1042-K1154 HydrophobicContact CE1-CG 4.42Å; Y1042-K1154 HydrophobicContact CE2-CD 4.27Å; Y1042-K1154 HydrophobicContact CG-CD 4.28Å; L1151-K1154 WeakPolarHBondContact O-CA 3.33Å; L1151-K1154 PolarHBondContact O-N 2.94Å; D1152-K1154 PolarHBondContact O-N 3.44Å; K1154-M1156 VanDerWaalsContact C-N 3.28Å; K1154-M1156 PolarHBondContact O-N 3.4Å
1155	T	72.9	Confident	80.7	Confident	9 Å²	9	55.9 Å²	55.9	6%	0.055	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-31.2	176.4	53.9	0	0	0	0	112	I1045 C1098 L1102 L1151 D1152 D1157	I1045-T1155 HydrophobicContact CD1-CG2 3.9Å; I1045-T1155 HydrophobicContact CG1-CG2 4.35Å; I1045-T1155 HydrophobicContact CG2-CG2 4.3Å; C1098-T1155 VanDerWaalsContact SG-CG2 3.57Å; L1102-T1155 HydrophobicContact CD2-CG2 4.48Å; L1151-T1155 PolarHBondContact O-N 3.04Å; D1152-T1155 PolarHBondContact O-OG1 3.34Å; D1152-T1155 VanDerWaalsContact O-OG1 3.08Å; T1155-D1157 PolarHBondContact O-N 3.13Å
1156	M	67	Low	80.7	Confident	166 Å²	166	53.6 Å²	53.6	82%	0.818	29%	0.292	S	S	*	.			trans	55.4	8.9	-176.8	-64.2	-75.4	-169.4	0	0	114.4	K1153 K1154	K1153-M1156 WeakPolarHBondContact O-CE 3.23Å; K1154-M1156 VanDerWaalsContact C-N 3.28Å; K1154-M1156 PolarHBondContact O-N 3.4Å
1157	D	70.4	Confident	80.5	Confident	33 Å²	33	51.4 Å²	51.4	18%	0.176	29%	0.294	C	S	.	.			trans	-103.8	109	-178.7	-166.7	-30.7	0	0	0	108.9	K1052 L1102 T1155 S1159 C1160	K1052-D1157 IonicContact NZ-OD2 3.01Å; K1052-D1157 PolarHBondContact NZ-OD2 3Å; L1102-D1157 HydrophobicContact CD1-CB 3.78Å; T1155-D1157 PolarHBondContact O-N 3.13Å; D1157-S1159 VanDerWaalsContact CG-OG 3.25Å; D1157-S1159 PolarHBondContact O-N 3.03Å; D1157-S1159 WeakPolarHBondContact OD1-CB 3.23Å; D1157-S1159 PolarHBondContact OD1-N 3.48Å; D1157-S1159 VanDerWaalsContact OD1-N 3.08Å; D1157-S1159 PolarHBondContact OD1-OG 3.13Å; D1157-C1160 PolarHBondContact O-N 3.21Å
1158	P	66.8	Low	80.2	Confident	125 Å²	125	51.3 Å²	51.3	81%	0.812	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.9	-176.2	24.6	-32.7	0	0	0	113.3	C1160	P1158-C1160 VanDerWaalsContact C-N 3.35Å
1159	S	66.4	Low	79.2	Confident	66 Å²	66	63.1 Å²	63.1	46%	0.462	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-17.6	176	69	0	0	0	0	113.6	T1105 D1157	T1105-S1159 WeakPolarHBondContact CG2-OG 3.42Å; D1157-S1159 VanDerWaalsContact CG-OG 3.25Å; D1157-S1159 PolarHBondContact O-N 3.03Å; D1157-S1159 WeakPolarHBondContact OD1-CB 3.23Å; D1157-S1159 PolarHBondContact OD1-N 3.48Å; D1157-S1159 VanDerWaalsContact OD1-N 3.08Å; D1157-S1159 PolarHBondContact OD1-OG 3.13Å
1160	C	74.3	Confident	78.9	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.014	35%	0.345	C	S	.	.			trans	-105.6	88	173.5	-171.6	0	0	0	0	109.3	L1102 D1157 P1158	L1102-C1160 HydrophobicContact CB-CB 4.39Å; L1102-C1160 HydrophobicContact CD1-CB 3.8Å; D1157-C1160 PolarHBondContact O-N 3.21Å; P1158-C1160 VanDerWaalsContact C-N 3.35Å
1161	N	84.4	Confident	78.6	Confident	72 Å²	72	63.7 Å²	63.7	39%	0.385	35%	0.345	S	S	.	.			trans	-116.3	102.2	176.2	-174.6	-43	0	0	0	109.8	V1163 A1164 Y1165	N1161-V1163 VanDerWaalsContact C-N 3.34Å; N1161-V1163 WeakPolarHBondContact OD1-CB 3.22Å; N1161-V1163 PolarHBondContact OD1-N 2.88Å; N1161-V1163 VanDerWaalsContact OD1-N 3.14Å; N1161-A1164 HydrophobicContact CB-CB 4.07Å; N1161-A1164 PolarHBondContact O-N 3.13Å; N1161-A1164 WeakPolarHBondContact OD1-CB 3.42Å; N1161-A1164 PolarHBondContact OD1-N 3.01Å; N1161-Y1165 WeakPolarHBondContact O-CB 3.3Å; N1161-Y1165 PolarHBondContact O-N 3.46Å
1162	L	86.7	Confident	78.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-66	-37.2	-178.8	-69.1	170.4	0	0	0	112	P1094 V1097 C1098 L1101 C1148 L1151 D1152 A1164 Y1165 F1166	P1094-L1162 HydrophobicContact CB-CD1 4.49Å; V1097-L1162 HydrophobicContact CG1-CD2 3.98Å; C1098-L1162 HydrophobicContact CB-CD1 3.84Å; C1098-L1162 HydrophobicContact CB-CD2 4.09Å; C1098-L1162 HydrophobicContact CB-CG 4.38Å; L1101-L1162 HydrophobicContact CD2-CD2 4.23Å; C1148-L1162 HydrophobicContact CB-CB 3.82Å; C1148-L1162 HydrophobicContact CB-CD1 4.42Å; L1151-L1162 HydrophobicContact CB-CD1 3.68Å; L1151-L1162 HydrophobicContact CD1-CD1 3.82Å; L1151-L1162 HydrophobicContact CG-CD1 4.41Å; D1152-L1162 WeakPolarHBondContact OD1-CB 3.34Å; D1152-L1162 WeakPolarHBondContact OD1-CG 3.44Å; D1152-L1162 PolarHBondContact OD1-N 3Å; D1152-L1162 PolarHBondContact OD2-N 3.44Å; L1162-A1164 VanDerWaalsContact C-N 3.32Å; L1162-A1164 PolarHBondContact O-N 3.16Å; L1162-Y1165 PolarHBondContact O-N 2.93Å; L1162-F1166 HydrophobicContact CB-CD2 4.37Å; L1162-F1166 HydrophobicContact CB-CE2 4.47Å; L1162-F1166 HydrophobicContact CD2-CE2 4.1Å; L1162-F1166 VanDerWaalsContact O-CD2 3.3Å; L1162-F1166 WeakPolarHBondContact O-CD2 2.86Å; L1162-F1166 PolarHBondContact O-N 3.03Å
1163	V	85.8	Confident	77.9	Confident	30 Å²	30	69.5 Å²	69.5	18%	0.182	38%	0.376	C	S	.	.	H	α-helix	trans	-59.8	-45.8	179.2	179.3	0	0	0	0	110.5	L1145 C1148 N1161 G1167 L1168	L1145-V1163 HydrophobicContact CD1-CB 4.45Å; L1145-V1163 HydrophobicContact CD1-CG1 3.72Å; L1145-V1163 HydrophobicContact CD1-CG2 3.91Å; C1148-V1163 HydrophobicContact CB-CG2 3.84Å; N1161-V1163 VanDerWaalsContact C-N 3.34Å; N1161-V1163 WeakPolarHBondContact OD1-CB 3.22Å; N1161-V1163 PolarHBondContact OD1-N 2.88Å; N1161-V1163 VanDerWaalsContact OD1-N 3.14Å; V1163-G1167 PolarHBondContact O-N 3.12Å; V1163-G1167 VanDerWaalsContact O-N 3.13Å; V1163-L1168 HydrophobicContact CG1-CB 4.23Å; V1163-L1168 WeakPolarHBondContact CG1-O 3.42Å; V1163-L1168 PolarHBondContact O-N 2.76Å
1164	A	86.2	Confident	77.7	Confident	72 Å²	72	64.9 Å²	64.9	60%	0.595	36%	0.361	S	S	*	.	H	α-helix	trans	-67.8	-42.3	175.2	0	0	0	0	0	111.7	N1161 L1162 F1166 G1167	N1161-A1164 HydrophobicContact CB-CB 4.07Å; N1161-A1164 PolarHBondContact O-N 3.13Å; N1161-A1164 WeakPolarHBondContact OD1-CB 3.42Å; N1161-A1164 PolarHBondContact OD1-N 3.01Å; L1162-A1164 VanDerWaalsContact C-N 3.32Å; L1162-A1164 PolarHBondContact O-N 3.16Å; A1164-F1166 PolarHBondContact O-N 2.87Å; A1164-G1167 PolarHBondContact O-N 2.94Å
1165	Y	86	Confident	77.8	Confident	46 Å²	46	61.7 Å²	61.7	18%	0.18	35%	0.352	C	S	.	.	H	α-helix	trans	-59.2	-46.7	-179.8	177.8	-97.6	0	0	0	112.7	V1097 L1101 L1125 K1129 N1161 L1162 G1167	V1097-Y1165 HydrophobicContact CG1-CD1 4.1Å; V1097-Y1165 HydrophobicContact CG1-CE1 3.86Å; L1101-Y1165 HydrophobicContact CD1-CD2 3.93Å; L1101-Y1165 HydrophobicContact CD1-CE2 4.21Å; L1101-Y1165 HydrophobicContact CD2-CD2 4.27Å; L1101-Y1165 HydrophobicContact CD2-CG 4.16Å; L1125-Y1165 VanDerWaalsContact C-OH 3.24Å; L1125-Y1165 WeakPolarHBondContact CA-OH 3.3Å; L1125-Y1165 VanDerWaalsContact CB-OH 3.3Å; L1125-Y1165 WeakPolarHBondContact CB-OH 3.42Å; L1125-Y1165 PolarHBondContact O-OH 3.04Å; K1129-Y1165 HydrophobicContact CB-CE1 3.88Å; K1129-Y1165 HydrophobicContact CD-CE1 4.25Å; K1129-Y1165 HydrophobicContact CD-CE2 4.25Å; K1129-Y1165 VanDerWaalsContact CE-O 3.23Å; K1129-Y1165 WeakPolarHBondContact CE-O 3.35Å; K1129-Y1165 HydrophobicContact CG-CE1 4.23Å; N1161-Y1165 WeakPolarHBondContact O-CB 3.3Å; N1161-Y1165 PolarHBondContact O-N 3.46Å; L1162-Y1165 PolarHBondContact O-N 2.93Å; Y1165-G1167 VanDerWaalsContact C-N 3.33Å
1166	F	87.9	Confident	78.1	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.018	37%	0.373	C	S	.	.	H	α-helix	trans	-81.9	-7.7	178.8	-70	-57.4	0	0	0	113.9	A1093 V1097 V1132 L1162 A1164 L1168	A1093-F1166 HydrophobicContact CB-CZ 4.17Å; V1097-F1166 HydrophobicContact CB-CZ 4.08Å; V1097-F1166 HydrophobicContact CG1-CZ 4.13Å; V1097-F1166 HydrophobicContact CG2-CZ 3.98Å; V1132-F1166 HydrophobicContact CB-CB 4.45Å; V1132-F1166 HydrophobicContact CB-CD1 3.66Å; V1132-F1166 HydrophobicContact CB-CE1 4.12Å; V1132-F1166 HydrophobicContact CB-CG 4.17Å; V1132-F1166 HydrophobicContact CG1-CB 3.81Å; V1132-F1166 HydrophobicContact CG1-CD1 3.9Å; V1132-F1166 HydrophobicContact CG1-CG 3.87Å; V1132-F1166 HydrophobicContact CG2-CD1 3.9Å; V1132-F1166 HydrophobicContact CG2-CE1 3.84Å; V1132-F1166 HydrophobicContact CG2-CG 4.48Å; V1132-F1166 HydrophobicContact CG2-CZ 4.36Å; L1162-F1166 HydrophobicContact CB-CD2 4.37Å; L1162-F1166 HydrophobicContact CB-CE2 4.47Å; L1162-F1166 HydrophobicContact CD2-CE2 4.1Å; L1162-F1166 VanDerWaalsContact O-CD2 3.3Å; L1162-F1166 WeakPolarHBondContact O-CD2 2.86Å; L1162-F1166 PolarHBondContact O-N 3.03Å; A1164-F1166 PolarHBondContact O-N 2.87Å; F1166-L1168 VanDerWaalsContact C-N 3.31Å; F1166-L1168 HydrophobicContact CB-CD1 3.8Å; F1166-L1168 HydrophobicContact CB-CG 3.76Å; F1166-L1168 HydrophobicContact CD2-CD1 4.38Å; F1166-L1168 HydrophobicContact CG-CD1 4.47Å; F1166-L1168 PolarHBondContact O-N 3.41Å
1167	G	83.8	Confident	79	Confident	46 Å²	46	57.7 Å²	57.7	47%	0.474	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	34.1	-177.6	0	0	0	0	0	112.9	R1141 V1163 A1164 Y1165 K1169	R1141-G1167 PolarHBondContact NH2-O 3.11Å; V1163-G1167 PolarHBondContact O-N 3.12Å; V1163-G1167 VanDerWaalsContact O-N 3.13Å; A1164-G1167 PolarHBondContact O-N 2.94Å; Y1165-G1167 VanDerWaalsContact C-N 3.33Å; G1167-K1169 PolarHBondContact O-N 3.34Å; G1167-K1169 VanDerWaalsContact O-N 3.13Å
1168	L	80.5	Confident	79.7	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.037	35%	0.353	C	S	.	.			trans	-82.5	87	179.2	-65.3	168.6	0	0	0	108.9	V1132 R1141 I1144 L1145 V1163 F1166	V1132-L1168 HydrophobicContact CG1-CD1 4.23Å; V1132-L1168 HydrophobicContact CG1-CD2 3.92Å; V1132-L1168 HydrophobicContact CG1-CG 4.29Å; R1141-L1168 HydrophobicContact CG-CD2 3.74Å; I1144-L1168 HydrophobicContact CG2-CD1 3.75Å; L1145-L1168 HydrophobicContact CD1-CB 3.95Å; V1163-L1168 HydrophobicContact CG1-CB 4.23Å; V1163-L1168 WeakPolarHBondContact CG1-O 3.42Å; V1163-L1168 PolarHBondContact O-N 2.76Å; F1166-L1168 VanDerWaalsContact C-N 3.31Å; F1166-L1168 HydrophobicContact CB-CD1 3.8Å; F1166-L1168 HydrophobicContact CB-CG 3.76Å; F1166-L1168 HydrophobicContact CD2-CD1 4.38Å; F1166-L1168 HydrophobicContact CG-CD1 4.47Å; F1166-L1168 PolarHBondContact O-N 3.41Å
1169	K	67.7	Low	80.9	Confident	247 Å²	247	53.8 Å²	53.8	100%	1.074	31%	0.311	S	S	*	.			trans	-86.8	0	165.2	-69.9	-174.5	179.8	-179.4	0	111.6	G1167	G1167-K1169 PolarHBondContact O-N 3.34Å; G1167-K1169 VanDerWaalsContact O-N 3.13Å

Retrieved 1,169 of 1,169 residues in 1903.6 ms (Link to these results)

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