A0A5K4EMR5_SCHMA Loading...

Prominin (Prom) protein, putative AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4EMR5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 881 aa.

						>A0A5K4EMR5_SCHMA|A0A5K4EMR5
MMRVVFSTVLFLCVSLDIAVCNSEVDDDSSTRTTLQLRDSVEFSYSISNFFLDLIRGKKPPTAVFETLVNIQTSHHSRLAYRSVEPVVTTYLGYGICLVFGLLFAIFMPLVGIVFFCARCCGKCGGRVQFVDSKHDPCKRVVYTICLVLIVTFQLAAVVLAFINHHLFHEALVSRDPRIGAFSQANLSLIEFEEALKDMVQMAKNTSSTDLSKQKERFMRIIDDGLVSFEEDFTKLSQANNVSDAISGFQTSARAFLPGSEAIAQISYFNHSLHEVISELPTIRQRLTDTLNTGCPIDKIIECRELMELANDQLKVRVPPNVFQIEEVISISNQIQRHLPDVDYLNEFNKTINNLAVNVKRSISDDLDRAWNDLAQSPKTREKLASVFEHIMVNVSTTLKFIRDRISLEINEEINDHYLRAVEYVLYGGVALLCIPILIFLILYLGLCFGTCGDRPYEEAGLCNRGVGANFLLAGVGFMFLFSTILMASCIVPFLFGGTLQTEVCRYLTGRYPDGPRKMDQYVFESLKSIFYAVEGSLSDSSKSRTFHVDKNELDAIRPTLDIIRFNLSDAILTRCENEPFVEAISTGEFVSPVLSEAIDGILQGLIESFKKIDLESPFRRTIQSCLAAFERLKFLSVVDIREAIKQVNTPLTFIDNLDEFVSRLKALNMNSLTSHIQALVDGPVKLDATRGNIYTLFMRFNSIPDQMNHAVINLNKYNQTLSTSVQSSMNRGVNKLRPLLTKELQLAVIATWHDIPCQSLRLAAKRGVDSVCYTFLMPFNAFWTGLGFTLLLFIPAIIFAVKLAGLYRKTEKYSRDYEEPDYISYHGFYMRPPTDYQDNSQKPRNKSRKHKVKCQSNGSSARNSHSRYQQLSVYPYDAYE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	42.8	Very low	207 Å²	207	129.8 Å²	129.8	100%	1.02	65%	0.651	S	S	*	*				0	-54.9	0	-86.2	-176.5	-172.3	0	0	113.5	R3 V4 V5	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.17Å; M1-V4 PolarHBondContact O-N 3.38Å; M1-V5 PolarHBondContact O-N 3.18Å
2	M	39.2	Very low	42.8	Very low	168 Å²	168	128.1 Å²	128.1	83%	0.828	65%	0.645	S	S	*	*	H	α-helix	trans	-56.4	-35.7	-175.6	-87.2	-174.3	-176.8	0	0	116	V4 V5 F6	M2-V4 VanDerWaalsContact C-N 3.34Å; M2-V4 PolarHBondContact O-N 3.09Å; M2-V5 PolarHBondContact O-N 3.23Å; M2-F6 PolarHBondContact O-N 3.11Å
3	R	38.1	Very low	42.4	Very low	230 Å²	230	124.1 Å²	124.1	87%	0.868	64%	0.635	S	S	*	*	H	α-helix	trans	-67.8	-31	176.3	-83.6	-174.4	175.4	-179.6	-1.7	113.8	M1 S7	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.17Å; R3-S7 PolarHBondContact O-N 3.43Å
4	V	49.2	Very low	42.2	Very low	99 Å²	99	120.9 Å²	120.9	60%	0.6	62%	0.624	S	S	*	*	H	α-helix	trans	-74.6	-41.7	178.6	-178.9	0	0	0	0	109.5	M1 M2 F6 S7 T8	M1-V4 PolarHBondContact O-N 3.38Å; M2-V4 VanDerWaalsContact C-N 3.34Å; M2-V4 PolarHBondContact O-N 3.09Å; V4-F6 PolarHBondContact O-N 3.2Å; V4-S7 PolarHBondContact O-N 3.23Å; V4-T8 HydrophobicContact CG1-CG2 4.44Å; V4-T8 PolarHBondContact O-N 3.04Å; V4-T8 PolarHBondContact O-OG1 2.92Å
5	V	48.1	Very low	42	Very low	84 Å²	84	116.8 Å²	116.8	51%	0.509	61%	0.61	S	S	.	*	H	α-helix	trans	-62.4	-43.2	179.2	180	0	0	0	0	111.8	M1 M2 T8 V9	M1-V5 PolarHBondContact O-N 3.18Å; M2-V5 PolarHBondContact O-N 3.23Å; V5-T8 WeakPolarHBondContact CA-OG1 3.17Å; V5-T8 PolarHBondContact O-N 3.48Å; V5-T8 PolarHBondContact O-OG1 3.13Å; V5-V9 HydrophobicContact CG1-CG2 4.39Å; V5-V9 VanDerWaalsContact O-CG2 3.28Å; V5-V9 WeakPolarHBondContact O-CG2 3.38Å; V5-V9 PolarHBondContact O-N 3.33Å
6	F	39	Very low	41.5	Very low	163 Å²	163	116.9 Å²	116.9	72%	0.715	61%	0.611	S	S	*	*	H	α-helix	trans	-65.9	-40.1	177.9	-106.5	-84.4	0	0	0	112.7	M2 V4 L10	M2-F6 PolarHBondContact O-N 3.11Å; V4-F6 PolarHBondContact O-N 3.2Å; F6-L10 WeakPolarHBondContact O-CB 3.32Å; F6-L10 PolarHBondContact O-N 3.15Å
7	S	43	Very low	41.2	Very low	67 Å²	67	117.4 Å²	117.4	47%	0.469	61%	0.614	S	S	.	*	H	α-helix	trans	-69.3	-36.7	178.5	-157.5	0	0	0	0	111.9	R3 V4 F11	R3-S7 PolarHBondContact O-N 3.43Å; V4-S7 PolarHBondContact O-N 3.23Å; S7-F11 WeakPolarHBondContact O-CB 3.38Å; S7-F11 PolarHBondContact O-N 3.48Å
8	T	48.3	Very low	40.8	Very low	69 Å²	69	117.9 Å²	117.9	42%	0.423	62%	0.616	S	S	.	*	H	α-helix	trans	-71.9	-36	177.1	46.9	0	0	0	0	112.7	V4 V5 L12	V4-T8 HydrophobicContact CG1-CG2 4.44Å; V4-T8 PolarHBondContact O-N 3.04Å; V4-T8 PolarHBondContact O-OG1 2.92Å; V5-T8 WeakPolarHBondContact CA-OG1 3.17Å; V5-T8 PolarHBondContact O-N 3.48Å; V5-T8 PolarHBondContact O-OG1 3.13Å; T8-L12 VanDerWaalsContact O-CB 3.26Å; T8-L12 WeakPolarHBondContact O-CB 3.45Å; T8-L12 WeakPolarHBondContact O-CD1 3.4Å; T8-L12 WeakPolarHBondContact O-CG 3.28Å; T8-L12 PolarHBondContact O-N 2.96Å
9	V	45.5	Very low	40.4	Very low	80 Å²	80	116 Å²	116	49%	0.485	62%	0.619	S	S	.	*	H	α-helix	trans	-69.3	-40.7	176.1	173.7	0	0	0	0	110.6	V5 L12 C13	V5-V9 HydrophobicContact CG1-CG2 4.39Å; V5-V9 VanDerWaalsContact O-CG2 3.28Å; V5-V9 WeakPolarHBondContact O-CG2 3.38Å; V5-V9 PolarHBondContact O-N 3.33Å; V9-L12 PolarHBondContact O-N 2.97Å; V9-C13 PolarHBondContact O-N 3.45Å; V9-C13 PolarHBondContact O-SG 3.34Å; V9-C13 VanDerWaalsContact O-SG 3.42Å
10	L	37.6	Very low	40	Very low	122 Å²	122	115.5 Å²	115.5	64%	0.639	62%	0.62	S	S	*	*	H	α-helix	trans	-65.8	-41.9	176.1	-148	83.4	0	0	0	111.6	F6 C13 V14	F6-L10 WeakPolarHBondContact O-CB 3.32Å; F6-L10 PolarHBondContact O-N 3.15Å; L10-C13 PolarHBondContact O-N 3.08Å; L10-V14 VanDerWaalsContact O-CG2 3.31Å; L10-V14 WeakPolarHBondContact O-CG2 3.31Å; L10-V14 PolarHBondContact O-N 3.07Å
11	F	38.6	Very low	39.7	Very low	139 Å²	139	115.3 Å²	115.3	61%	0.61	63%	0.627	S	S	*	*	H	α-helix	trans	-66.6	-37	174.5	-103.4	-87.3	0	0	0	112.5	S7 V14 S15	S7-F11 WeakPolarHBondContact O-CB 3.38Å; S7-F11 PolarHBondContact O-N 3.48Å; F11-V14 PolarHBondContact O-N 3.18Å; F11-S15 WeakPolarHBondContact O-CB 3.26Å; F11-S15 PolarHBondContact O-N 3.42Å; F11-S15 PolarHBondContact O-OG 2.95Å
12	L	41.8	Very low	39.1	Very low	109 Å²	109	113.4 Å²	113.4	57%	0.571	62%	0.62	S	S	*	*	H	α-helix	trans	-66.9	-40.8	175.7	-86.1	156.7	0	0	0	111.2	T8 V9 S15 L16	T8-L12 VanDerWaalsContact O-CB 3.26Å; T8-L12 WeakPolarHBondContact O-CB 3.45Å; T8-L12 WeakPolarHBondContact O-CD1 3.4Å; T8-L12 WeakPolarHBondContact O-CG 3.28Å; T8-L12 PolarHBondContact O-N 2.96Å; V9-L12 PolarHBondContact O-N 2.97Å; L12-S15 PolarHBondContact O-N 2.98Å; L12-L16 VanDerWaalsContact O-CB 3.3Å; L12-L16 WeakPolarHBondContact O-CB 3.17Å; L12-L16 PolarHBondContact O-N 3.3Å
13	C	37.7	Very low	38.9	Very low	76 Å²	76	108.8 Å²	108.8	51%	0.514	61%	0.605	S	S	.	*	H	α-helix	trans	-63.5	-45.8	174.2	-71.2	0	0	0	0	111.8	V9 L10 S15 D17	V9-C13 PolarHBondContact O-N 3.45Å; V9-C13 PolarHBondContact O-SG 3.34Å; V9-C13 VanDerWaalsContact O-SG 3.42Å; L10-C13 PolarHBondContact O-N 3.08Å; C13-S15 PolarHBondContact O-N 2.97Å; C13-D17 PolarHBondContact O-N 3.2Å
14	V	39.9	Very low	38.9	Very low	80 Å²	80	107.4 Å²	107.4	49%	0.485	61%	0.608	S	S	.	*	H	α-helix	trans	-70	-34.1	-179.9	176.7	0	0	0	0	112	L10 F11 I18	L10-V14 VanDerWaalsContact O-CG2 3.31Å; L10-V14 WeakPolarHBondContact O-CG2 3.31Å; L10-V14 PolarHBondContact O-N 3.07Å; F11-V14 PolarHBondContact O-N 3.18Å; V14-I18 HydrophobicContact CG1-CD1 3.77Å; V14-I18 WeakPolarHBondContact O-CD1 3.29Å; V14-I18 VanDerWaalsContact O-CG1 3.24Å; V14-I18 WeakPolarHBondContact O-CG1 3.43Å; V14-I18 PolarHBondContact O-N 2.86Å
15	S	39.6	Very low	38.4	Very low	59 Å²	59	108.9 Å²	108.9	41%	0.413	62%	0.617	S	S	.	*	H	α-helix	trans	-80.7	-27.8	-179.9	-48.9	0	0	0	0	112.8	F11 L12 C13 A19	F11-S15 WeakPolarHBondContact O-CB 3.26Å; F11-S15 PolarHBondContact O-N 3.42Å; F11-S15 PolarHBondContact O-OG 2.95Å; L12-S15 PolarHBondContact O-N 2.98Å; C13-S15 PolarHBondContact O-N 2.97Å; S15-A19 VanDerWaalsContact O-CB 3.3Å; S15-A19 WeakPolarHBondContact O-CB 3.14Å; S15-A19 PolarHBondContact O-N 3.49Å; S15-A19 VanDerWaalsContact O-N 3.07Å
16	L	34.3	Very low	38.4	Very low	119 Å²	119	109.9 Å²	109.9	62%	0.623	62%	0.619	S	S	*	*	H	α-helix	trans	-71	-34.2	174.4	-133.6	78.3	0	0	0	111.3	L12 V20	L12-L16 VanDerWaalsContact O-CB 3.3Å; L12-L16 WeakPolarHBondContact O-CB 3.17Å; L12-L16 PolarHBondContact O-N 3.3Å; L16-V20 WeakPolarHBondContact O-CG2 3.39Å
17	D	35.4	Very low	39.3	Very low	125 Å²	125	107.6 Å²	107.6	67%	0.668	62%	0.615	S	S	*	*	H	α-helix	trans	-74.6	-32.8	175.5	-72.7	-32.3	0	0	0	112.1	C13	C13-D17 PolarHBondContact O-N 3.2Å
18	I	34.9	Very low	40.4	Very low	126 Å²	126	109.5 Å²	109.5	65%	0.646	62%	0.62	S	S	*	*	H	α-helix	trans	-78.2	-28	178.7	-63.5	168.7	0	0	0	112.3	V14 V20	V14-I18 HydrophobicContact CG1-CD1 3.77Å; V14-I18 WeakPolarHBondContact O-CD1 3.29Å; V14-I18 VanDerWaalsContact O-CG1 3.24Å; V14-I18 WeakPolarHBondContact O-CG1 3.43Å; V14-I18 PolarHBondContact O-N 2.86Å; I18-V20 PolarHBondContact O-N 3.03Å
19	A	32.9	Very low	41.7	Very low	82 Å²	82	108.9 Å²	108.9	68%	0.678	62%	0.618	S	S	*	*	H	α-helix	trans	-81.4	-9.9	-177.9	0	0	0	0	0	114.8	S15	S15-A19 VanDerWaalsContact O-CB 3.3Å; S15-A19 WeakPolarHBondContact O-CB 3.14Å; S15-A19 PolarHBondContact O-N 3.49Å; S15-A19 VanDerWaalsContact O-N 3.07Å
20	V	32.9	Very low	43.4	Very low	105 Å²	105	107.4 Å²	107.4	64%	0.636	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-9.4	-178.6	177.3	0	0	0	0	113	L16 I18 N22	L16-V20 WeakPolarHBondContact O-CG2 3.39Å; I18-V20 PolarHBondContact O-N 3.03Å; V20-N22 PolarHBondContact O-N 3.12Å
21	C	34	Very low	45.7	Very low	113 Å²	113	101.8 Å²	101.8	76%	0.764	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	13.5	-176.8	-82.7	0	0	0	0	116.6
22	N	31.6	Very low	48	Very low	166 Å²	166	102.8 Å²	102.8	89%	0.888	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.6	26.6	-172.5	-127.1	29.3	0	0	0	116.3	V20	V20-N22 PolarHBondContact O-N 3.12Å
23	S	34.5	Very low	50.4	Low	71 Å²	71	101.5 Å²	101.5	50%	0.497	58%	0.579	S	S	.	*			trans	-128	108.7	172.9	56.9	0	0	0	0	112.1	V25	S23-V25 PolarHBondContact O-N 2.99Å
24	E	37.3	Very low	52.9	Low	202 Å²	202	98.6 Å²	98.6	94%	0.944	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	16.8	171.4	-73.1	176.2	139.4	0	0	114.6
25	V	39.7	Very low	55.4	Low	130 Å²	130	97 Å²	97	79%	0.788	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-5.6	-170.6	-176.8	0	0	0	0	113.3	S23	S23-V25 PolarHBondContact O-N 2.99Å
26	D	48.2	Very low	57.9	Low	104 Å²	104	99.9 Å²	99.9	56%	0.556	55%	0.554	S	S	*	*	S	Bend	trans	-114.3	7.4	-178.2	-101.2	-39.7	0	0	0	115.8	D28 S29 S30	D26-D28 VanDerWaalsContact C-N 3.35Å; D26-D28 PolarHBondContact O-N 3.42Å; D26-S29 PolarHBondContact O-N 3.06Å; D26-S29 PolarHBondContact O-OG 2.81Å; D26-S29 PolarHBondContact OD1-OG 3.48Å; D26-S30 PolarHBondContact O-N 2.92Å; D26-S30 VanDerWaalsContact O-N 3.12Å; D26-S30 PolarHBondContact O-OG 3.42Å
27	D	58.4	Low	60.8	Low	116 Å²	116	96.8 Å²	96.8	62%	0.62	54%	0.538	S	S	*	.	H	α-helix	trans	-70.2	-29.7	-172.1	-142.8	17.7	0	0	0	113.4	S30 T31	D27-S30 PolarHBondContact O-OG 3.21Å; D27-T31 VanDerWaalsContact O-CB 3.23Å; D27-T31 WeakPolarHBondContact O-CB 3.47Å; D27-T31 PolarHBondContact O-N 3.07Å; D27-T31 VanDerWaalsContact O-N 3.07Å; D27-T31 PolarHBondContact O-OG1 2.9Å
28	D	65.7	Low	63.5	Low	107 Å²	107	91.6 Å²	91.6	57%	0.572	51%	0.509	S	S	*	.	H	α-helix	trans	-76.9	-29.2	176.9	-110.2	-8.5	0	0	0	112.4	D26 R32 R178	D26-D28 VanDerWaalsContact C-N 3.35Å; D26-D28 PolarHBondContact O-N 3.42Å; D28-R32 WeakPolarHBondContact O-CB 3.17Å; D28-R32 PolarHBondContact O-N 3.43Å; D28-R32 VanDerWaalsContact O-N 3.12Å; D28-R178 IonicContact OD1-NH2 2.63Å; D28-R178 PolarHBondContact OD1-NH2 2.64Å
29	S	76	Confident	66.3	Low	55 Å²	55	90.3 Å²	90.3	39%	0.385	50%	0.503	S	S	.	.	H	α-helix	trans	-76	-42.9	178.4	79.3	0	0	0	0	110.6	D26 R32 T33	D26-S29 PolarHBondContact O-N 3.06Å; D26-S29 PolarHBondContact O-OG 2.81Å; D26-S29 PolarHBondContact OD1-OG 3.48Å; S29-R32 PolarHBondContact O-N 3.23Å; S29-T33 WeakPolarHBondContact O-CG2 3.3Å; S29-T33 PolarHBondContact O-N 2.95Å; S29-T33 VanDerWaalsContact O-N 3.08Å; S29-T33 PolarHBondContact O-OG1 3.01Å
30	S	80.8	Confident	69.2	Low	49 Å²	49	89.6 Å²	89.6	34%	0.343	49%	0.494	S	S	.	.	H	α-helix	trans	-62.8	-41.2	173.1	67.9	0	0	0	0	111.7	D26 D27 T33 T34	D26-S30 PolarHBondContact O-N 2.92Å; D26-S30 VanDerWaalsContact O-N 3.12Å; D26-S30 PolarHBondContact O-OG 3.42Å; D27-S30 PolarHBondContact O-OG 3.21Å; S30-T33 WeakPolarHBondContact CA-OG1 3.2Å; S30-T33 PolarHBondContact O-N 3.33Å; S30-T33 PolarHBondContact O-OG1 2.83Å; S30-T34 WeakPolarHBondContact O-CB 3.3Å; S30-T34 PolarHBondContact O-N 3.17Å; S30-T34 PolarHBondContact O-OG1 3.21Å
31	T	85.5	Confident	72.1	Confident	5 Å²	5	84.7 Å²	84.7	3%	0.031	46%	0.464	C	S	.	.	H	α-helix	trans	-64	-47.7	177.5	-66.8	0	0	0	0	111.5	D27 T33 T34 L35 D176 I179	D27-T31 VanDerWaalsContact O-CB 3.23Å; D27-T31 WeakPolarHBondContact O-CB 3.47Å; D27-T31 PolarHBondContact O-N 3.07Å; D27-T31 VanDerWaalsContact O-N 3.07Å; D27-T31 PolarHBondContact O-OG1 2.9Å; T31-T33 PolarHBondContact O-N 2.75Å; T31-T34 PolarHBondContact O-N 3.16Å; T31-L35 HydrophobicContact CG2-CD1 4.07Å; T31-L35 WeakPolarHBondContact O-CG 3.1Å; T31-L35 PolarHBondContact O-N 2.86Å; T31-D176 WeakPolarHBondContact CG2-OD2 3.08Å; T31-I179 HydrophobicContact CG2-CD1 3.67Å; T31-I179 HydrophobicContact CG2-CG1 4.4Å
32	R	88	Confident	75	Confident	160 Å²	160	83.8 Å²	83.8	60%	0.604	45%	0.449	S	S	*	.	H	α-helix	trans	-61.8	-42.5	179.7	-173.1	-179	-59.5	161.2	5.9	112.2	D28 S29 L35 Q36	D28-R32 WeakPolarHBondContact O-CB 3.17Å; D28-R32 PolarHBondContact O-N 3.43Å; D28-R32 VanDerWaalsContact O-N 3.12Å; S29-R32 PolarHBondContact O-N 3.23Å; R32-L35 PolarHBondContact O-N 3.48Å; R32-Q36 WeakPolarHBondContact O-CB 3.28Å; R32-Q36 VanDerWaalsContact O-CG 3.31Å; R32-Q36 WeakPolarHBondContact O-CG 3.44Å; R32-Q36 PolarHBondContact O-N 2.9Å
33	T	90.4	Very high	78	Confident	81 Å²	81	81 Å²	81	50%	0.497	43%	0.429	S	S	.	.	H	α-helix	trans	-65.7	-39.2	179	49.1	0	0	0	0	111.7	S29 S30 T31 Q36 L37	S29-T33 WeakPolarHBondContact O-CG2 3.3Å; S29-T33 PolarHBondContact O-N 2.95Å; S29-T33 VanDerWaalsContact O-N 3.08Å; S29-T33 PolarHBondContact O-OG1 3.01Å; S30-T33 WeakPolarHBondContact CA-OG1 3.2Å; S30-T33 PolarHBondContact O-N 3.33Å; S30-T33 PolarHBondContact O-OG1 2.83Å; T31-T33 PolarHBondContact O-N 2.75Å; T33-Q36 PolarHBondContact O-N 2.91Å; T33-L37 WeakPolarHBondContact O-CB 3.24Å; T33-L37 PolarHBondContact O-N 2.95Å
34	T	90.7	Very high	80.8	Confident	16 Å²	16	78 Å²	78	10%	0.098	41%	0.408	C	S	.	.	H	α-helix	trans	-66	-41.2	176	-57.2	0	0	0	0	112.3	S30 T31 L37 R38 L167 E170 I179	S30-T34 WeakPolarHBondContact O-CB 3.3Å; S30-T34 PolarHBondContact O-N 3.17Å; S30-T34 PolarHBondContact O-OG1 3.21Å; T31-T34 PolarHBondContact O-N 3.16Å; T34-L37 PolarHBondContact O-N 3.23Å; T34-R38 PolarHBondContact O-N 3.26Å; T34-L167 HydrophobicContact CG2-CD2 3.97Å; T34-E170 HydrophobicContact CG2-CB 4.16Å; T34-E170 HydrophobicContact CG2-CG 4.12Å; T34-I179 HydrophobicContact CG2-CD1 3.82Å; T34-I179 HydrophobicContact CG2-CG1 4.25Å; T34-I179 HydrophobicContact CG2-CG2 3.9Å
35	L	92	Very high	83.6	Confident	46 Å²	46	68.6 Å²	68.6	24%	0.241	36%	0.363	C	S	.	.	H	α-helix	trans	-63.5	-46.2	174.4	-70.9	172.3	0	0	0	111.6	T31 R32 L37 R38 D39 R178 I179	T31-L35 HydrophobicContact CG2-CD1 4.07Å; T31-L35 WeakPolarHBondContact O-CG 3.1Å; T31-L35 PolarHBondContact O-N 2.86Å; R32-L35 PolarHBondContact O-N 3.48Å; L35-L37 VanDerWaalsContact C-N 3.27Å; L35-L37 PolarHBondContact O-N 3.49Å; L35-R38 WeakPolarHBondContact O-CB 3.45Å; L35-R38 PolarHBondContact O-N 3.4Å; L35-R38 VanDerWaalsContact O-N 3.16Å; L35-D39 VanDerWaalsContact O-CG 3.29Å; L35-D39 PolarHBondContact O-N 3.29Å; L35-R178 HydrophobicContact CD1-CB 4.35Å; L35-R178 HydrophobicContact CD2-CB 4.34Å; L35-I179 HydrophobicContact CD2-CG1 4Å; L35-I179 HydrophobicContact CG-CD1 4.48Å; L35-I179 HydrophobicContact CG-CG1 4.17Å
36	Q	93.6	Very high	86.2	Confident	119 Å²	119	65.8 Å²	65.8	56%	0.556	35%	0.35	S	S	*	.	H	α-helix	trans	-59.7	-38.8	174.8	-74.4	177.4	-19.3	0	0	112.3	R32 T33 D39 S40	R32-Q36 WeakPolarHBondContact O-CB 3.28Å; R32-Q36 VanDerWaalsContact O-CG 3.31Å; R32-Q36 WeakPolarHBondContact O-CG 3.44Å; R32-Q36 PolarHBondContact O-N 2.9Å; T33-Q36 PolarHBondContact O-N 2.91Å; Q36-D39 PolarHBondContact O-N 3.07Å; Q36-S40 WeakPolarHBondContact O-CB 3.37Å; Q36-S40 PolarHBondContact O-N 3.27Å
37	L	93.6	Very high	88.4	Confident	55 Å²	55	64.4 Å²	64.4	29%	0.288	34%	0.341	S	S	.	.	H	α-helix	trans	-64.9	-44.3	175.8	-175.1	62.9	0	0	0	111.2	T33 T34 L35 D39 S40 V41 I163 L167	T33-L37 WeakPolarHBondContact O-CB 3.24Å; T33-L37 PolarHBondContact O-N 2.95Å; T34-L37 PolarHBondContact O-N 3.23Å; L35-L37 VanDerWaalsContact C-N 3.27Å; L35-L37 PolarHBondContact O-N 3.49Å; L37-D39 PolarHBondContact O-N 2.92Å; L37-S40 PolarHBondContact O-N 2.99Å; L37-S40 PolarHBondContact O-OG 3.15Å; L37-V41 PolarHBondContact O-N 3.21Å; L37-I163 HydrophobicContact CD1-CD1 4.44Å; L37-I163 HydrophobicContact CD1-CG1 4.46Å; L37-I163 HydrophobicContact CD1-CG2 3.68Å; L37-I163 HydrophobicContact CD2-CG2 3.98Å; L37-I163 HydrophobicContact CG-CG2 3.68Å; L37-L167 HydrophobicContact CB-CD2 4.43Å; L37-L167 HydrophobicContact CD2-CD2 4.24Å; L37-L167 HydrophobicContact CG-CD2 4.3Å
38	R	93.3	Very high	90.2	Very high	15 Å²	15	58.9 Å²	58.9	6%	0.057	31%	0.312	C	S	.	.	H	α-helix	trans	-57.6	-47.1	174.3	174.5	-179.9	-86.7	-177.1	-1.8	111.5	T34 L35 S40 V41 E42 Y45 L167 T775	T34-R38 PolarHBondContact O-N 3.26Å; L35-R38 WeakPolarHBondContact O-CB 3.45Å; L35-R38 PolarHBondContact O-N 3.4Å; L35-R38 VanDerWaalsContact O-N 3.16Å; R38-S40 VanDerWaalsContact C-N 3.29Å; R38-S40 PolarHBondContact O-N 2.99Å; R38-V41 WeakPolarHBondContact O-CG2 3.01Å; R38-V41 PolarHBondContact O-N 3.27Å; R38-E42 PolarHBondContact O-N 3.44Å; R38-Y45 HydrophobicContact CG-CE2 4.16Å; R38-L167 HydrophobicContact CB-CD1 4.2Å; R38-L167 HydrophobicContact CB-CD2 4.09Å; R38-T775 PolarHBondContact NH2-O 3.43Å
39	D	92.9	Very high	91.5	Very high	99 Å²	99	54.8 Å²	54.8	53%	0.529	29%	0.29	S	S	.	.	H	α-helix	trans	-61.8	-39.7	179	-65.5	-14.8	0	0	0	111.2	L35 Q36 L37 V41 E42	L35-D39 VanDerWaalsContact O-CG 3.29Å; L35-D39 PolarHBondContact O-N 3.29Å; Q36-D39 PolarHBondContact O-N 3.07Å; L37-D39 PolarHBondContact O-N 2.92Å; D39-V41 PolarHBondContact O-N 3.36Å; D39-E42 WeakPolarHBondContact O-CB 3.49Å; D39-E42 PolarHBondContact O-N 3.08Å
40	S	94	Very high	92.3	Very high	68 Å²	68	59.2 Å²	59.2	48%	0.476	30%	0.303	S	S	.	.	H	α-helix	trans	-63.8	-22.5	179.4	79.7	0	0	0	0	114.4	Q36 L37 R38 F43	Q36-S40 WeakPolarHBondContact O-CB 3.37Å; Q36-S40 PolarHBondContact O-N 3.27Å; L37-S40 PolarHBondContact O-N 2.99Å; L37-S40 PolarHBondContact O-OG 3.15Å; R38-S40 VanDerWaalsContact C-N 3.29Å; R38-S40 PolarHBondContact O-N 2.99Å; S40-F43 WeakPolarHBondContact O-CE1 3.45Å
41	V	94.7	Very high	93	Very high	2 Å²	2	60 Å²	60	1%	0.012	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	9.2	179.9	-58.7	0	0	0	0	113.6	L37 R38 D39 F43 S44 L160 I163 L167	L37-V41 PolarHBondContact O-N 3.21Å; R38-V41 WeakPolarHBondContact O-CG2 3.01Å; R38-V41 PolarHBondContact O-N 3.27Å; D39-V41 PolarHBondContact O-N 3.36Å; V41-F43 PolarHBondContact O-N 2.88Å; V41-F43 VanDerWaalsContact O-N 3.13Å; V41-S44 WeakPolarHBondContact O-CA 3.28Å; V41-S44 VanDerWaalsContact O-CB 3.26Å; V41-S44 WeakPolarHBondContact O-CB 3.4Å; V41-S44 PolarHBondContact O-N 3.23Å; V41-S44 PolarHBondContact O-OG 3.07Å; V41-L160 HydrophobicContact CB-CD2 4.47Å; V41-L160 HydrophobicContact CG1-CD2 3.92Å; V41-I163 HydrophobicContact CG1-CB 4.23Å; V41-I163 HydrophobicContact CG1-CD1 4.16Å; V41-I163 HydrophobicContact CG1-CG2 3.6Å; V41-I163 HydrophobicContact CG2-CG2 4.23Å; V41-L167 HydrophobicContact CG2-CD1 3.46Å; V41-L167 VanDerWaalsContact CG2-CD1 3.46Å
42	E	93.3	Very high	93.4	Very high	94 Å²	94	59.8 Å²	59.8	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-57.7	-32.5	-177.6	-172.5	178.4	-154.7	0	0	112.9	R38 D39 S44 Y45 S46	R38-E42 PolarHBondContact O-N 3.44Å; D39-E42 WeakPolarHBondContact O-CB 3.49Å; D39-E42 PolarHBondContact O-N 3.08Å; E42-S44 PolarHBondContact O-N 3.45Å; E42-Y45 HydrophobicContact CB-CD2 4.45Å; E42-Y45 HydrophobicContact CG-CD2 4.25Å; E42-Y45 WeakPolarHBondContact O-CB 3.47Å; E42-Y45 PolarHBondContact O-N 3.33Å; E42-S46 PolarHBondContact O-N 3.34Å
43	F	94.8	Very high	93.4	Very high	108 Å²	108	54.8 Å²	54.8	47%	0.474	28%	0.284	S	S	.	.	H	α-helix	trans	-59.2	-29.4	174.4	76.7	-89.4	0	0	0	112.5	S40 V41 S46 I47 L160	S40-F43 WeakPolarHBondContact O-CE1 3.45Å; V41-F43 PolarHBondContact O-N 2.88Å; V41-F43 VanDerWaalsContact O-N 3.13Å; F43-S46 WeakPolarHBondContact O-CB 3.41Å; F43-S46 PolarHBondContact O-N 2.94Å; F43-I47 HydrophobicContact CD2-CD1 3.91Å; F43-I47 HydrophobicContact CE2-CD1 4.27Å; F43-I47 WeakPolarHBondContact O-CG1 3.23Å; F43-I47 PolarHBondContact O-N 2.71Å; F43-L160 HydrophobicContact CE1-CD2 4.11Å; F43-L160 HydrophobicContact CE2-CD1 3.82Å; F43-L160 HydrophobicContact CE2-CD2 4.48Å; F43-L160 HydrophobicContact CZ-CD1 3.67Å; F43-L160 HydrophobicContact CZ-CD2 3.6Å; F43-L160 HydrophobicContact CZ-CG 4.28Å
44	S	94.9	Very high	93.4	Very high	8 Å²	8	56.5 Å²	56.5	6%	0.056	29%	0.29	C	S	.	.	H	α-helix	trans	-70.2	-32.5	176.9	75.8	0	0	0	0	112.2	V41 E42 I47 S48 N164	V41-S44 WeakPolarHBondContact O-CA 3.28Å; V41-S44 VanDerWaalsContact O-CB 3.26Å; V41-S44 WeakPolarHBondContact O-CB 3.4Å; V41-S44 PolarHBondContact O-N 3.23Å; V41-S44 PolarHBondContact O-OG 3.07Å; E42-S44 PolarHBondContact O-N 3.45Å; S44-I47 PolarHBondContact O-N 2.89Å; S44-S48 WeakPolarHBondContact O-CB 3.49Å; S44-S48 PolarHBondContact O-N 2.85Å; S44-S48 PolarHBondContact O-OG 3.12Å; S44-N164 PolarHBondContact OG-ND2 3.26Å; S44-N164 VanDerWaalsContact OG-ND2 3.07Å
45	Y	95.2	Very high	93.3	Very high	3 Å²	3	56.7 Å²	56.7	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-65.8	-41.4	170.4	-52.7	-31.8	0	0	0	111	R38 E42 I47 S48 N49 N164 M778 P779 A782	R38-Y45 HydrophobicContact CG-CE2 4.16Å; E42-Y45 HydrophobicContact CB-CD2 4.45Å; E42-Y45 HydrophobicContact CG-CD2 4.25Å; E42-Y45 WeakPolarHBondContact O-CB 3.47Å; E42-Y45 PolarHBondContact O-N 3.33Å; Y45-I47 PolarHBondContact O-N 3.01Å; Y45-S48 PolarHBondContact O-N 3.34Å; Y45-N49 WeakPolarHBondContact O-CB 3.29Å; Y45-N49 VanDerWaalsContact O-CG 3.31Å; Y45-N49 PolarHBondContact O-N 3.43Å; Y45-N49 PolarHBondContact O-ND2 3.36Å; Y45-N164 WeakPolarHBondContact CE1-OD1 3.28Å; Y45-M778 HydrophobicContact CD1-CB 3.66Å; Y45-M778 HydrophobicContact CD2-CB 4.13Å; Y45-M778 HydrophobicContact CD2-CE 3.31Å; Y45-M778 HydrophobicContact CD2-SD 3.92Å; Y45-M778 HydrophobicContact CE1-CB 3.95Å; Y45-M778 HydrophobicContact CE2-CB 4.39Å; Y45-M778 HydrophobicContact CE2-CE 3.57Å; Y45-M778 HydrophobicContact CG-CB 3.77Å; Y45-M778 HydrophobicContact CG-CE 3.93Å; Y45-M778 HydrophobicContact CG-CG 4.41Å; Y45-M778 HydrophobicContact CG-SD 4Å; Y45-P779 HydrophobicContact CE1-CB 4.26Å; Y45-A782 HydrophobicContact CD1-CB 3.73Å; Y45-A782 HydrophobicContact CE1-CB 3.96Å
46	S	94.3	Very high	93	Very high	72 Å²	72	54.9 Å²	54.9	50%	0.503	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-43	176.5	-63.9	0	0	0	0	112.1	E42 F43 N49 F50	E42-S46 PolarHBondContact O-N 3.34Å; F43-S46 WeakPolarHBondContact O-CB 3.41Å; F43-S46 PolarHBondContact O-N 2.94Å; S46-N49 PolarHBondContact O-N 3.05Å; S46-F50 VanDerWaalsContact O-CB 3.25Å; S46-F50 WeakPolarHBondContact O-CB 3.45Å; S46-F50 PolarHBondContact O-N 3.5Å
47	I	94.5	Very high	92.2	Very high	74 Å²	74	50.5 Å²	50.5	38%	0.379	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-45.8	174.8	-68.4	167.1	0	0	0	110.8	F43 S44 Y45 F50 F51 T785 F789	F43-I47 HydrophobicContact CD2-CD1 3.91Å; F43-I47 HydrophobicContact CE2-CD1 4.27Å; F43-I47 WeakPolarHBondContact O-CG1 3.23Å; F43-I47 PolarHBondContact O-N 2.71Å; S44-I47 PolarHBondContact O-N 2.89Å; Y45-I47 PolarHBondContact O-N 3.01Å; I47-F50 PolarHBondContact O-N 2.98Å; I47-F51 PolarHBondContact O-N 3.32Å; I47-T785 HydrophobicContact CG2-CG2 4.23Å; I47-F789 HydrophobicContact CG2-CE2 3.85Å; I47-F789 HydrophobicContact CG2-CZ 4.32Å
48	S	95.2	Very high	91.1	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-48.5	-179.8	-52.9	0	0	0	0	111.1	S44 Y45 F50 F51 L52 A782 T785	S44-S48 WeakPolarHBondContact O-CB 3.49Å; S44-S48 PolarHBondContact O-N 2.85Å; S44-S48 PolarHBondContact O-OG 3.12Å; Y45-S48 PolarHBondContact O-N 3.34Å; S48-F50 PolarHBondContact O-N 2.89Å; S48-F51 PolarHBondContact O-N 3.28Å; S48-L52 WeakPolarHBondContact O-CB 3.3Å; S48-L52 VanDerWaalsContact O-CG 3.26Å; S48-L52 WeakPolarHBondContact O-CG 3.36Å; S48-L52 PolarHBondContact O-N 3.14Å; S48-A782 WeakPolarHBondContact OG-CA 3.15Å; S48-T785 WeakPolarHBondContact OG-CB 3.25Å; S48-T785 PolarHBondContact OG-OG1 3.03Å
49	N	94.2	Very high	89.9	Confident	21 Å²	21	61 Å²	61	11%	0.112	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-43.3	177.3	-73.6	-35.4	0	0	0	111.8	Y45 S46 F51 L52 D53 Q501	Y45-N49 WeakPolarHBondContact O-CB 3.29Å; Y45-N49 VanDerWaalsContact O-CG 3.31Å; Y45-N49 PolarHBondContact O-N 3.43Å; Y45-N49 PolarHBondContact O-ND2 3.36Å; S46-N49 PolarHBondContact O-N 3.05Å; N49-F51 VanDerWaalsContact C-N 3.33Å; N49-F51 PolarHBondContact O-N 3.35Å; N49-L52 PolarHBondContact O-N 3.16Å; N49-D53 WeakPolarHBondContact O-CB 3.45Å; N49-D53 PolarHBondContact O-N 3.28Å; N49-Q501 PolarHBondContact OD1-NE2 3.44Å
50	F	93.4	Very high	88.5	Confident	148 Å²	148	58.6 Å²	58.6	65%	0.649	30%	0.301	S	S	*	.	H	α-helix	trans	-59	-44.9	176.7	176	-97.5	0	0	0	111.9	S46 I47 S48 L54	S46-F50 VanDerWaalsContact O-CB 3.25Å; S46-F50 WeakPolarHBondContact O-CB 3.45Å; S46-F50 PolarHBondContact O-N 3.5Å; I47-F50 PolarHBondContact O-N 2.98Å; S48-F50 PolarHBondContact O-N 2.89Å; F50-L54 VanDerWaalsContact O-CB 3.31Å; F50-L54 WeakPolarHBondContact O-CB 3.35Å; F50-L54 PolarHBondContact O-N 2.88Å
51	F	94	Very high	86.9	Confident	64 Å²	64	56.5 Å²	56.5	28%	0.281	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-45.4	176.2	175.7	-102.4	0	0	0	111.8	I47 S48 N49 D53 L54 I55 F494 W784	I47-F51 PolarHBondContact O-N 3.32Å; S48-F51 PolarHBondContact O-N 3.28Å; N49-F51 VanDerWaalsContact C-N 3.33Å; N49-F51 PolarHBondContact O-N 3.35Å; F51-D53 PolarHBondContact O-N 2.87Å; F51-L54 WeakPolarHBondContact O-CB 3.05Å; F51-L54 PolarHBondContact O-N 3.25Å; F51-I55 HydrophobicContact CD2-CG2 4.39Å; F51-I55 HydrophobicContact CE1-CD1 4.2Å; F51-I55 HydrophobicContact CE1-CG2 4.21Å; F51-I55 HydrophobicContact CE2-CG2 3.95Å; F51-I55 HydrophobicContact CZ-CG2 3.86Å; F51-I55 WeakPolarHBondContact O-CG2 3.35Å; F51-I55 PolarHBondContact O-N 2.64Å; F51-F494 HydrophobicContact CE1-CD2 4.49Å; F51-F494 AromaticContact CE1-CE2 3.85Å; F51-F494 HydrophobicContact CE1-CE2 3.85Å; F51-W784 AromaticContact CD1-CH2 3.84Å; F51-W784 HydrophobicContact CD1-CH2 3.84Å; F51-W784 HydrophobicContact CD1-CZ3 4.21Å; F51-W784 AromaticContact CE1-CH2 3.95Å; F51-W784 HydrophobicContact CE1-CH2 3.95Å; F51-W784 HydrophobicContact CE1-CZ3 4.03Å
52	L	93.6	Very high	85.1	Confident	1 Å²	1	58 Å²	58	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-41.2	178.6	-71.3	175.1	0	0	0	112.6	S48 N49 L54 I55 R56 Y94 F494 Q501 T502 W784	S48-L52 WeakPolarHBondContact O-CB 3.3Å; S48-L52 VanDerWaalsContact O-CG 3.26Å; S48-L52 WeakPolarHBondContact O-CG 3.36Å; S48-L52 PolarHBondContact O-N 3.14Å; N49-L52 PolarHBondContact O-N 3.16Å; L52-L54 VanDerWaalsContact C-N 3.34Å; L52-I55 HydrophobicContact CD2-CD1 3.88Å; L52-I55 WeakPolarHBondContact O-CG1 3.19Å; L52-I55 PolarHBondContact O-N 2.85Å; L52-R56 WeakPolarHBondContact O-CB 3.46Å; L52-R56 PolarHBondContact O-N 2.95Å; L52-Y94 HydrophobicContact CD2-CE1 4.4Å; L52-F494 HydrophobicContact CD2-CD2 4.41Å; L52-F494 HydrophobicContact CD2-CE2 4.08Å; L52-Q501 HydrophobicContact CD1-CB 3.87Å; L52-Q501 HydrophobicContact CD1-CG 3.79Å; L52-T502 HydrophobicContact CB-CG2 3.76Å; L52-W784 HydrophobicContact CD1-CZ2 4.28Å; L52-W784 HydrophobicContact CD2-CH2 3.97Å; L52-W784 HydrophobicContact CD2-CZ2 3.89Å; L52-W784 HydrophobicContact CG-CH2 4.37Å; L52-W784 HydrophobicContact CG-CZ2 4.26Å
53	D	88.9	Confident	83.5	Confident	55 Å²	55	54.2 Å²	54.2	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-67.9	-35.3	175.9	-75.9	-30.4	0	0	0	112	N49 F51 G57 R506	N49-D53 WeakPolarHBondContact O-CB 3.45Å; N49-D53 PolarHBondContact O-N 3.28Å; F51-D53 PolarHBondContact O-N 2.87Å; D53-G57 WeakPolarHBondContact O-CA 3.3Å; D53-G57 PolarHBondContact O-N 3.49Å; D53-R506 WeakPolarHBondContact OD1-CD 3.27Å; D53-R506 IonicContact OD1-NH1 2.77Å
54	L	89.9	Confident	81.8	Confident	118 Å²	118	50.9 Å²	50.9	62%	0.618	27%	0.268	S	S	*	.	H	α-helix	trans	-64.6	-47.4	174.9	-178.9	67.2	0	0	0	111.8	F50 F51 L52	F50-L54 VanDerWaalsContact O-CB 3.31Å; F50-L54 WeakPolarHBondContact O-CB 3.35Å; F50-L54 PolarHBondContact O-N 2.88Å; F51-L54 WeakPolarHBondContact O-CB 3.05Å; F51-L54 PolarHBondContact O-N 3.25Å; L52-L54 VanDerWaalsContact C-N 3.34Å
55	I	89.1	Confident	80	Confident	20 Å²	20	53 Å²	53	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-71.8	-33	-178	63.5	173.8	0	0	0	112.6	F51 L52 G93 Y94 F494	F51-I55 HydrophobicContact CD2-CG2 4.39Å; F51-I55 HydrophobicContact CE1-CD1 4.2Å; F51-I55 HydrophobicContact CE1-CG2 4.21Å; F51-I55 HydrophobicContact CE2-CG2 3.95Å; F51-I55 HydrophobicContact CZ-CG2 3.86Å; F51-I55 WeakPolarHBondContact O-CG2 3.35Å; F51-I55 PolarHBondContact O-N 2.64Å; L52-I55 HydrophobicContact CD2-CD1 3.88Å; L52-I55 WeakPolarHBondContact O-CG1 3.19Å; L52-I55 PolarHBondContact O-N 2.85Å; I55-G93 VanDerWaalsContact O-CA 3.29Å; I55-G93 WeakPolarHBondContact O-CA 3.11Å; I55-Y94 HydrophobicContact CD1-CD1 3.79Å; I55-Y94 HydrophobicContact CD1-CD2 4.1Å; I55-Y94 HydrophobicContact CD1-CE1 3.55Å; I55-Y94 HydrophobicContact CD1-CE2 3.91Å; I55-Y94 HydrophobicContact CD1-CG 4.06Å; I55-Y94 HydrophobicContact CG1-CD2 4.34Å; I55-Y94 HydrophobicContact CG1-CE2 4.1Å; I55-F494 HydrophobicContact CD1-CE2 3.48Å; I55-F494 VanDerWaalsContact CD1-CE2 3.48Å; I55-F494 HydrophobicContact CD1-CZ 3.56Å
56	R	86	Confident	78.2	Confident	7 Å²	7	58.1 Å²	58.1	3%	0.026	30%	0.3	C	S	.	.	H	α-helix	trans	-77.5	-36.9	178.3	-177.3	56.9	173.1	168.5	-10.3	111.5	L52 T90 Y91 Y94 T502 E503	L52-R56 WeakPolarHBondContact O-CB 3.46Å; L52-R56 PolarHBondContact O-N 2.95Å; R56-T90 PolarHBondContact NH1-O 3.39Å; R56-Y91 VanDerWaalsContact CZ-CE1 3.44Å; R56-Y91 VanDerWaalsContact NH1-CZ 3.27Å; R56-Y91 VanDerWaalsContact NH2-CZ 3.27Å; R56-Y91 PolarHBondContact NH2-OH 3.41Å; R56-Y94 HydrophobicContact CB-CE2 4.23Å; R56-T502 HydrophobicContact CB-CG2 3.95Å; R56-T502 HydrophobicContact CG-CG2 4.41Å; R56-E503 VanDerWaalsContact CD-OE1 3.3Å; R56-E503 WeakPolarHBondContact CD-OE1 3.46Å; R56-E503 IonicContact CZ-OE1 3.33Å; R56-E503 IonicContact CZ-OE2 3.89Å; R56-E503 IonicContact NE-OE1 3.2Å; R56-E503 PolarHBondContact NE-OE1 2.75Å; R56-E503 IonicContact NE-OE2 2.75Å; R56-E503 PolarHBondContact NE-OE2 2.81Å; R56-E503 IonicContact NH2-OE1 2.9Å; R56-E503 PolarHBondContact NH2-OE1 3.12Å; R56-E503 IonicContact NH2-OE2 3.41Å; R56-E503 PolarHBondContact NH2-OE2 3.06Å
57	G	77.3	Confident	76.5	Confident	28 Å²	28	54.9 Å²	54.9	29%	0.289	28%	0.277	S	S	.	.			trans	70.9	-168.9	-171.9	0	0	0	0	0	113.1	D53 R506	D53-G57 WeakPolarHBondContact O-CA 3.3Å; D53-G57 PolarHBondContact O-N 3.49Å; G57-R506 PolarHBondContact O-NH1 2.94Å
58	K	70.5	Confident	74.8	Confident	187 Å²	187	56.1 Å²	56.1	81%	0.813	28%	0.284	S	S	*	.	S	Bend	trans	-96.1	-2.8	-170	-63.8	-174.6	178.3	-177.1	0	115.1	Y512	K58-Y512 PolarHBondContact O-OH 2.94Å
59	K	67.1	Low	73	Confident	103 Å²	103	57 Å²	57	45%	0.448	29%	0.289	S	S	.	.			trans	-70.6	144.2	-175.3	-73.2	-175.3	177.7	-178.8	0	111.7	T89 T90	K59-T89 PolarHBondContact NZ-OG1 3.26Å; K59-T89 VanDerWaalsContact NZ-OG1 3.08Å; K59-T90 HydrophobicContact CB-CG2 4.04Å
60	P	63.2	Low	71.3	Confident	49 Å²	49	60.2 Å²	60.2	32%	0.318	31%	0.307	S	S	.	.			trans	-75	150.9	177.6	31.8	-35.3	0	0	0	112.3	T62 Y522	P60-T62 VanDerWaalsContact C-N 3.27Å; P60-T62 PolarHBondContact O-N 2.85Å; P60-Y522 HydrophobicContact CB-CE1 4.13Å; P60-Y522 HydrophobicContact CB-CE2 4.42Å; P60-Y522 WeakPolarHBondContact CB-OH 3.47Å
61	P	59.9	Low	69.7	Low	24 Å²	24	55.9 Å²	55.9	16%	0.156	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.2	-177.6	27.3	-36.8	0	0	0	115	A63 V64 Y507 Y522	P61-A63 PolarHBondContact O-N 3.06Å; P61-A63 VanDerWaalsContact O-N 3.08Å; P61-V64 WeakPolarHBondContact O-CB 3.47Å; P61-V64 WeakPolarHBondContact O-CG2 3.24Å; P61-V64 PolarHBondContact O-N 3.49Å; P61-Y507 WeakPolarHBondContact CD-OH 3.18Å; P61-Y507 HydrophobicContact CG-CE2 4.47Å; P61-Y522 HydrophobicContact CG-CD2 3.33Å; P61-Y522 HydrophobicContact CG-CE2 3.53Å; P61-Y522 HydrophobicContact CG-CG 4.09Å
62	T	57.4	Low	68	Low	33 Å²	33	60.3 Å²	60.3	20%	0.202	31%	0.311	C	S	.	.	H	α-helix	trans	-53	-34.7	-179.5	56.2	0	0	0	0	112.9	P60 V64 F65 E66 Y522	P60-T62 VanDerWaalsContact C-N 3.27Å; P60-T62 PolarHBondContact O-N 2.85Å; T62-V64 PolarHBondContact O-N 3.06Å; T62-V64 VanDerWaalsContact O-N 3.11Å; T62-F65 PolarHBondContact O-N 3.48Å; T62-F65 VanDerWaalsContact O-N 3.09Å; T62-E66 WeakPolarHBondContact O-CB 3.34Å; T62-E66 WeakPolarHBondContact O-CG 3.42Å; T62-E66 PolarHBondContact O-N 3.33Å; T62-Y522 HydrophobicContact CG2-CD1 3.05Å; T62-Y522 HydrophobicContact CG2-CE1 3.41Å; T62-Y522 VanDerWaalsContact CG2-CE1 3.41Å; T62-Y522 HydrophobicContact CG2-CG 3.85Å
63	A	59.2	Low	66.2	Low	14 Å²	14	63.2 Å²	63.2	12%	0.116	33%	0.329	C	S	.	.	H	α-helix	trans	-47	-40	173.4	0	0	0	0	0	113.4	P61 T67 P86	P61-A63 PolarHBondContact O-N 3.06Å; P61-A63 VanDerWaalsContact O-N 3.08Å; A63-T67 WeakPolarHBondContact O-CB 3.28Å; A63-T67 PolarHBondContact O-N 3.28Å; A63-T67 PolarHBondContact O-OG1 2.82Å; A63-P86 HydrophobicContact CB-CB 3.41Å; A63-P86 VanDerWaalsContact CB-CB 3.41Å
64	V	59.3	Low	64.5	Low	38 Å²	38	63.4 Å²	63.4	23%	0.23	33%	0.334	C	S	.	.	H	α-helix	trans	-71	-45.8	-177.5	-173.6	0	0	0	0	110.7	P61 T62 T67 L68 V87 Y91	P61-V64 WeakPolarHBondContact O-CB 3.47Å; P61-V64 WeakPolarHBondContact O-CG2 3.24Å; P61-V64 PolarHBondContact O-N 3.49Å; T62-V64 PolarHBondContact O-N 3.06Å; T62-V64 VanDerWaalsContact O-N 3.11Å; V64-T67 WeakPolarHBondContact O-CB 3.33Å; V64-T67 PolarHBondContact O-N 3.41Å; V64-L68 PolarHBondContact O-N 3.23Å; V64-V87 HydrophobicContact CG1-CG1 4.12Å; V64-V87 HydrophobicContact CG2-CG1 4.38Å; V64-Y91 HydrophobicContact CB-CE2 4.34Å; V64-Y91 HydrophobicContact CG1-CE2 4.08Å; V64-Y91 HydrophobicContact CG2-CD2 4.11Å; V64-Y91 HydrophobicContact CG2-CE2 3.32Å
65	F	58.7	Low	62.8	Low	53 Å²	53	65.2 Å²	65.2	23%	0.232	34%	0.34	C	S	.	.	H	α-helix	trans	-77.5	-45.5	-172.8	-160.8	-85	0	0	0	112.2	T62 T67 L68 V69 S526 S529 I530	T62-F65 PolarHBondContact O-N 3.48Å; T62-F65 VanDerWaalsContact O-N 3.09Å; F65-T67 PolarHBondContact O-N 3.16Å; F65-T67 VanDerWaalsContact O-N 3.17Å; F65-L68 PolarHBondContact O-N 3.34Å; F65-V69 HydrophobicContact CD1-CG2 3.65Å; F65-V69 HydrophobicContact CE1-CG2 3.2Å; F65-V69 HydrophobicContact CZ-CG2 3.93Å; F65-V69 WeakPolarHBondContact O-CG2 3.2Å; F65-V69 PolarHBondContact O-N 3.48Å; F65-S526 VanDerWaalsContact CD1-OG 3.24Å; F65-S526 WeakPolarHBondContact CD1-OG 3.41Å; F65-S526 VanDerWaalsContact CE1-C 3.43Å; F65-S526 WeakPolarHBondContact CE1-O 3.19Å; F65-S526 WeakPolarHBondContact CG-OG 3.42Å; F65-S529 WeakPolarHBondContact CE1-OG 3.37Å; F65-I530 HydrophobicContact CE1-CD1 4.27Å; F65-I530 HydrophobicContact CE1-CG1 4.05Å; F65-I530 HydrophobicContact CE2-CD1 4.45Å; F65-I530 HydrophobicContact CZ-CD1 3.51Å; F65-I530 HydrophobicContact CZ-CG1 3.71Å
66	E	56.2	Low	61	Low	110 Å²	110	71.9 Å²	71.9	51%	0.514	37%	0.37	S	S	.	.	H	α-helix	trans	-53.2	-38.4	172.7	-72.8	173.2	-161.5	0	0	110.6	T62 N70	T62-E66 WeakPolarHBondContact O-CB 3.34Å; T62-E66 WeakPolarHBondContact O-CG 3.42Å; T62-E66 PolarHBondContact O-N 3.33Å; E66-N70 VanDerWaalsContact O-CB 3.22Å; E66-N70 WeakPolarHBondContact O-CB 3.41Å; E66-N70 PolarHBondContact O-N 2.77Å; E66-N70 PolarHBondContact O-ND2 3.03Å
67	T	59.8	Low	59.2	Low	5 Å²	5	77.4 Å²	77.4	3%	0.031	41%	0.409	C	S	.	.	H	α-helix	trans	-65.1	-52	173.7	-57.8	0	0	0	0	112	A63 V64 F65 V69 N70 I71 S83 V87	A63-T67 WeakPolarHBondContact O-CB 3.28Å; A63-T67 PolarHBondContact O-N 3.28Å; A63-T67 PolarHBondContact O-OG1 2.82Å; V64-T67 WeakPolarHBondContact O-CB 3.33Å; V64-T67 PolarHBondContact O-N 3.41Å; F65-T67 PolarHBondContact O-N 3.16Å; F65-T67 VanDerWaalsContact O-N 3.17Å; T67-V69 PolarHBondContact O-N 3.27Å; T67-N70 PolarHBondContact O-N 2.86Å; T67-I71 HydrophobicContact CG2-CD1 3.59Å; T67-I71 HydrophobicContact CG2-CG1 4.18Å; T67-I71 WeakPolarHBondContact O-CB 3.46Å; T67-I71 WeakPolarHBondContact O-CG1 3.35Å; T67-I71 PolarHBondContact O-N 2.93Å; T67-S83 WeakPolarHBondContact CB-O 3.39Å; T67-S83 WeakPolarHBondContact CG2-O 3.47Å; T67-S83 PolarHBondContact OG1-O 2.74Å; T67-V87 HydrophobicContact CG2-CG2 3.47Å; T67-V87 VanDerWaalsContact CG2-CG2 3.47Å; T67-V87 WeakPolarHBondContact OG1-CG2 3.46Å
68	L	58.2	Low	58	Low	100 Å²	100	86.9 Å²	86.9	52%	0.524	44%	0.437	S	S	.	.	H	α-helix	trans	-57	-41.5	-177.6	-162.6	83.3	0	0	0	111.4	V64 F65 I71 Q72	V64-L68 PolarHBondContact O-N 3.23Å; F65-L68 PolarHBondContact O-N 3.34Å; L68-I71 WeakPolarHBondContact O-CB 3.3Å; L68-I71 PolarHBondContact O-N 3.02Å; L68-Q72 WeakPolarHBondContact O-CB 3.45Å; L68-Q72 PolarHBondContact O-N 3.19Å
69	V	57.6	Low	57.1	Low	18 Å²	18	82.7 Å²	82.7	11%	0.109	42%	0.422	C	S	.	.	H	α-helix	trans	-71.8	-42.6	178.5	176.2	0	0	0	0	112	F65 T67 I71 Q72 T73 S529	F65-V69 HydrophobicContact CD1-CG2 3.65Å; F65-V69 HydrophobicContact CE1-CG2 3.2Å; F65-V69 HydrophobicContact CZ-CG2 3.93Å; F65-V69 WeakPolarHBondContact O-CG2 3.2Å; F65-V69 PolarHBondContact O-N 3.48Å; T67-V69 PolarHBondContact O-N 3.27Å; V69-I71 PolarHBondContact O-N 2.91Å; V69-Q72 PolarHBondContact O-N 3.3Å; V69-T73 HydrophobicContact CG1-CG2 4.14Å; V69-T73 WeakPolarHBondContact O-CB 3.08Å; V69-T73 WeakPolarHBondContact O-CG2 3.47Å; V69-T73 PolarHBondContact O-N 2.93Å; V69-T73 PolarHBondContact O-OG1 3.28Å; V69-S529 WeakPolarHBondContact CG2-OG 3.29Å
70	N	58.6	Low	56.7	Low	90 Å²	90	80.6 Å²	80.6	48%	0.481	42%	0.424	S	S	.	.	H	α-helix	trans	-58.9	-36.3	173.4	-78.1	-29.3	0	0	0	111.4	E66 T67 T73 S74	E66-N70 VanDerWaalsContact O-CB 3.22Å; E66-N70 WeakPolarHBondContact O-CB 3.41Å; E66-N70 PolarHBondContact O-N 2.77Å; E66-N70 PolarHBondContact O-ND2 3.03Å; T67-N70 PolarHBondContact O-N 2.86Å; N70-T73 PolarHBondContact O-OG1 3.34Å; N70-S74 WeakPolarHBondContact O-CB 3.44Å; N70-S74 PolarHBondContact O-N 3.5Å; N70-S74 VanDerWaalsContact O-N 3.09Å; N70-S74 PolarHBondContact O-OG 3Å
71	I	60.1	Low	56.6	Low	57 Å²	57	85.9 Å²	85.9	29%	0.292	44%	0.439	S	S	.	.	H	α-helix	trans	-67.4	-47.3	174.8	-67.7	170.9	0	0	0	110.9	T67 L68 V69 T73 S74 L79	T67-I71 HydrophobicContact CG2-CD1 3.59Å; T67-I71 HydrophobicContact CG2-CG1 4.18Å; T67-I71 WeakPolarHBondContact O-CB 3.46Å; T67-I71 WeakPolarHBondContact O-CG1 3.35Å; T67-I71 PolarHBondContact O-N 2.93Å; L68-I71 WeakPolarHBondContact O-CB 3.3Å; L68-I71 PolarHBondContact O-N 3.02Å; V69-I71 PolarHBondContact O-N 2.91Å; I71-T73 PolarHBondContact O-N 2.83Å; I71-S74 PolarHBondContact O-OG 3.38Å; I71-S74 VanDerWaalsContact O-OG 3.14Å; I71-L79 HydrophobicContact CB-CD1 4.04Å; I71-L79 HydrophobicContact CD1-CD1 4.05Å; I71-L79 HydrophobicContact CD1-CD2 3.92Å; I71-L79 HydrophobicContact CD1-CG 4.15Å; I71-L79 HydrophobicContact CG1-CD1 3.55Å; I71-L79 HydrophobicContact CG1-CD2 4.3Å; I71-L79 HydrophobicContact CG1-CG 3.97Å; I71-L79 HydrophobicContact CG2-CD1 3.6Å
72	Q	57.3	Low	56.6	Low	157 Å²	157	94.7 Å²	94.7	73%	0.734	47%	0.469	S	S	*	.	H	α-helix	trans	-67.4	-36.9	-176.9	-165	117.7	-26.3	0	0	112.6	L68 V69	L68-Q72 WeakPolarHBondContact O-CB 3.45Å; L68-Q72 PolarHBondContact O-N 3.19Å; V69-Q72 PolarHBondContact O-N 3.3Å
73	T	54.7	Low	56.8	Low	61 Å²	61	94.3 Å²	94.3	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-82.7	-23.9	-179.1	52.2	0	0	0	0	113.5	V69 N70 I71 H75 A533	V69-T73 HydrophobicContact CG1-CG2 4.14Å; V69-T73 WeakPolarHBondContact O-CB 3.08Å; V69-T73 WeakPolarHBondContact O-CG2 3.47Å; V69-T73 PolarHBondContact O-N 2.93Å; V69-T73 PolarHBondContact O-OG1 3.28Å; N70-T73 PolarHBondContact O-OG1 3.34Å; I71-T73 PolarHBondContact O-N 2.83Å; T73-H75 VanDerWaalsContact C-N 3.34Å; T73-H75 PolarHBondContact O-N 3.29Å; T73-A533 HydrophobicContact CG2-CB 3.33Å
74	S	54.7	Low	57.2	Low	59 Å²	59	95.6 Å²	95.6	41%	0.413	47%	0.474	S	S	.	.			trans	-73.5	88.2	177.4	53.9	0	0	0	0	110.9	N70 I71 H76	N70-S74 WeakPolarHBondContact O-CB 3.44Å; N70-S74 PolarHBondContact O-N 3.5Å; N70-S74 VanDerWaalsContact O-N 3.09Å; N70-S74 PolarHBondContact O-OG 3Å; I71-S74 PolarHBondContact O-OG 3.38Å; I71-S74 VanDerWaalsContact O-OG 3.14Å; S74-H76 PolarHBondContact O-N 3.11Å
75	H	54.6	Low	57.7	Low	157 Å²	157	97.9 Å²	97.9	73%	0.727	48%	0.482	S	S	*	.			trans	-58.4	-8.7	170.5	-90.9	-74.4	0	0	0	114	T73	T73-H75 VanDerWaalsContact C-N 3.34Å; T73-H75 PolarHBondContact O-N 3.29Å
76	H	49.5	Very low	58.1	Low	159 Å²	159	97.3 Å²	97.3	74%	0.736	48%	0.484	S	S	*	.	S	Bend	trans	-113.8	82.3	-171.1	-68.4	-20.1	0	0	0	113.1	S74 R78	S74-H76 PolarHBondContact O-N 3.11Å; H76-R78 VanDerWaalsContact C-N 3.28Å; H76-R78 PolarHBondContact O-N 3.14Å
77	S	48.3	Very low	58.6	Low	123 Å²	123	93.6 Å²	93.6	86%	0.86	47%	0.469	S	S	*	.	S	Bend	trans	48.3	9.3	133.3	63.6	0	0	0	0	122.3
78	R	52.3	Low	59.2	Low	227 Å²	227	96.6 Å²	96.6	86%	0.857	49%	0.487	S	S	*	.			trans	-155.8	110.8	163.8	-113.4	172.1	-176.5	165.2	1.1	109.7	H76 A80	H76-R78 VanDerWaalsContact C-N 3.28Å; H76-R78 PolarHBondContact O-N 3.14Å; R78-A80 VanDerWaalsContact C-N 3.28Å; R78-A80 PolarHBondContact O-N 3.31Å
79	L	51.5	Low	60	Low	99 Å²	99	94.2 Å²	94.2	52%	0.518	48%	0.477	S	S	.	.			trans	-56.1	97.4	160.7	-124.4	73.5	0	0	0	107.1	I71 Y81 V84	I71-L79 HydrophobicContact CB-CD1 4.04Å; I71-L79 HydrophobicContact CD1-CD1 4.05Å; I71-L79 HydrophobicContact CD1-CD2 3.92Å; I71-L79 HydrophobicContact CD1-CG 4.15Å; I71-L79 HydrophobicContact CG1-CD1 3.55Å; I71-L79 HydrophobicContact CG1-CD2 4.3Å; I71-L79 HydrophobicContact CG1-CG 3.97Å; I71-L79 HydrophobicContact CG2-CD1 3.6Å; L79-Y81 PolarHBondContact O-N 2.9Å; L79-V84 HydrophobicContact CD2-CG2 3.63Å; L79-V84 HydrophobicContact CG-CG2 4.13Å
80	A	58.8	Low	60.8	Low	59 Å²	59	93.5 Å²	93.5	49%	0.488	47%	0.472	S	S	.	.			trans	-65.3	132.5	172.6	0	0	0	0	0	106.9	R78 R82 S83	R78-A80 VanDerWaalsContact C-N 3.28Å; R78-A80 PolarHBondContact O-N 3.31Å; A80-R82 PolarHBondContact O-N 2.93Å; A80-S83 WeakPolarHBondContact O-CB 3.11Å; A80-S83 PolarHBondContact O-N 3.44Å; A80-S83 PolarHBondContact O-OG 3.09Å
81	Y	61.1	Low	61.9	Low	160 Å²	160	92.3 Å²	92.3	63%	0.627	46%	0.461	S	S	*	.	H	α-helix	trans	-47.2	-36.2	177.7	170	-95.4	0	0	0	112.8	L79 S83 V84 E85	L79-Y81 PolarHBondContact O-N 2.9Å; Y81-S83 PolarHBondContact O-N 3.37Å; Y81-S83 VanDerWaalsContact O-N 3.13Å; Y81-V84 PolarHBondContact O-N 2.93Å; Y81-E85 HydrophobicContact CE1-CB 4.06Å; Y81-E85 HydrophobicContact CE1-CG 4.27Å; Y81-E85 PolarHBondContact O-N 3.17Å
82	R	60.9	Low	63.1	Low	210 Å²	210	94 Å²	94	79%	0.792	47%	0.47	S	S	*	.	H	α-helix	trans	-55.6	-27.3	175.6	-170.4	179.3	-88.3	176.8	-7.4	113.7	A80	A80-R82 PolarHBondContact O-N 2.93Å
83	S	62.3	Low	64.6	Low	25 Å²	25	87.2 Å²	87.2	18%	0.175	44%	0.443	C	S	.	.	H	α-helix	trans	-72	-37.7	173.5	64.7	0	0	0	0	112.1	T67 A80 Y81 P86	T67-S83 WeakPolarHBondContact CB-O 3.39Å; T67-S83 WeakPolarHBondContact CG2-O 3.47Å; T67-S83 PolarHBondContact OG1-O 2.74Å; A80-S83 WeakPolarHBondContact O-CB 3.11Å; A80-S83 PolarHBondContact O-N 3.44Å; A80-S83 PolarHBondContact O-OG 3.09Å; Y81-S83 PolarHBondContact O-N 3.37Å; Y81-S83 VanDerWaalsContact O-N 3.13Å; S83-P86 WeakPolarHBondContact O-CD 3.32Å
84	V	66.8	Low	66.3	Low	40 Å²	40	84.7 Å²	84.7	24%	0.242	43%	0.427	C	S	.	.	H	α-helix	trans	-94.2	-18.7	-173	-154.2	0	0	0	0	113.3	L79 Y81 P86 V87 V88	L79-V84 HydrophobicContact CD2-CG2 3.63Å; L79-V84 HydrophobicContact CG-CG2 4.13Å; Y81-V84 PolarHBondContact O-N 2.93Å; V84-P86 VanDerWaalsContact C-N 3.34Å; V84-V87 HydrophobicContact CG1-CB 4.45Å; V84-V87 WeakPolarHBondContact O-CB 3.23Å; V84-V87 PolarHBondContact O-N 3.39Å; V84-V88 HydrophobicContact CG1-CG2 4Å; V84-V88 WeakPolarHBondContact O-CG2 3.23Å; V84-V88 PolarHBondContact O-N 3.15Å
85	E	70	Confident	68	Low	86 Å²	86	83.5 Å²	83.5	40%	0.402	42%	0.424	S	S	.	.	H	α-helix	trans	-48.2	-44.6	177.9	178.5	-179.1	-179.9	0	0	113.9	Y81 V87 V88 T89	Y81-E85 HydrophobicContact CE1-CB 4.06Å; Y81-E85 HydrophobicContact CE1-CG 4.27Å; Y81-E85 PolarHBondContact O-N 3.17Å; E85-V87 PolarHBondContact O-N 3Å; E85-V88 PolarHBondContact O-N 3.29Å; E85-T89 HydrophobicContact CG-CG2 4.04Å; E85-T89 WeakPolarHBondContact O-CB 3.38Å; E85-T89 WeakPolarHBondContact O-CG2 3.32Å; E85-T89 PolarHBondContact O-N 3.19Å; E85-T89 PolarHBondContact O-OG1 3.01Å
86	P	66.1	Low	69.8	Low	42 Å²	42	79.9 Å²	79.9	27%	0.273	41%	0.409	S	S	.	.	H	α-helix	trans	-61.3	-43	177.7	-21.4	34.4	0	0	0	111.8	A63 S83 V84 T89 T90	A63-P86 HydrophobicContact CB-CB 3.41Å; A63-P86 VanDerWaalsContact CB-CB 3.41Å; S83-P86 WeakPolarHBondContact O-CD 3.32Å; V84-P86 VanDerWaalsContact C-N 3.34Å; P86-T89 PolarHBondContact O-OG1 3.29Å; P86-T89 VanDerWaalsContact O-OG1 3.09Å; P86-T90 WeakPolarHBondContact O-CB 3.01Å; P86-T90 PolarHBondContact O-N 2.94Å; P86-T90 PolarHBondContact O-OG1 3.45Å
87	V	68.5	Low	71.9	Confident	31 Å²	31	74 Å²	74	19%	0.188	39%	0.385	C	S	.	.	H	α-helix	trans	-64.9	-50.2	179	-167.3	0	0	0	0	111.2	V64 T67 V84 E85 T89 T90 Y91	V64-V87 HydrophobicContact CG1-CG1 4.12Å; V64-V87 HydrophobicContact CG2-CG1 4.38Å; T67-V87 HydrophobicContact CG2-CG2 3.47Å; T67-V87 VanDerWaalsContact CG2-CG2 3.47Å; T67-V87 WeakPolarHBondContact OG1-CG2 3.46Å; V84-V87 HydrophobicContact CG1-CB 4.45Å; V84-V87 WeakPolarHBondContact O-CB 3.23Å; V84-V87 PolarHBondContact O-N 3.39Å; E85-V87 PolarHBondContact O-N 3Å; V87-T89 VanDerWaalsContact C-N 3.3Å; V87-T89 PolarHBondContact O-N 2.88Å; V87-T90 PolarHBondContact O-N 3.41Å; V87-T90 VanDerWaalsContact O-N 3.13Å; V87-Y91 HydrophobicContact CG1-CD2 4.04Å; V87-Y91 HydrophobicContact CG1-CE2 4.43Å; V87-Y91 PolarHBondContact O-N 2.89Å
88	V	71.5	Confident	74.1	Confident	69 Å²	69	70.5 Å²	70.5	42%	0.418	36%	0.357	S	S	.	.	H	α-helix	trans	-60.6	-44	-178.4	173.6	0	0	0	0	109.9	V84 E85 T90 L92	V84-V88 HydrophobicContact CG1-CG2 4Å; V84-V88 WeakPolarHBondContact O-CG2 3.23Å; V84-V88 PolarHBondContact O-N 3.15Å; E85-V88 PolarHBondContact O-N 3.29Å; V88-T90 VanDerWaalsContact C-N 3.28Å; V88-T90 PolarHBondContact O-N 3.07Å; V88-L92 HydrophobicContact CG1-CD1 4.46Å; V88-L92 VanDerWaalsContact O-CA 3.31Å; V88-L92 WeakPolarHBondContact O-CA 3.2Å; V88-L92 VanDerWaalsContact O-CB 3.29Å; V88-L92 WeakPolarHBondContact O-CB 3.49Å; V88-L92 PolarHBondContact O-N 3.48Å
89	T	74.2	Confident	76.2	Confident	50 Å²	50	63.6 Å²	63.6	31%	0.307	34%	0.339	S	S	.	.	H	α-helix	trans	-71.1	-24	-179.5	63.3	0	0	0	0	112.9	K59 E85 P86 V87	K59-T89 PolarHBondContact NZ-OG1 3.26Å; K59-T89 VanDerWaalsContact NZ-OG1 3.08Å; E85-T89 HydrophobicContact CG-CG2 4.04Å; E85-T89 WeakPolarHBondContact O-CB 3.38Å; E85-T89 WeakPolarHBondContact O-CG2 3.32Å; E85-T89 PolarHBondContact O-N 3.19Å; E85-T89 PolarHBondContact O-OG1 3.01Å; P86-T89 PolarHBondContact O-OG1 3.29Å; P86-T89 VanDerWaalsContact O-OG1 3.09Å; V87-T89 VanDerWaalsContact C-N 3.3Å; V87-T89 PolarHBondContact O-N 2.88Å
90	T	75.2	Confident	78.2	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.012	34%	0.344	C	S	.	.	H	α-helix	trans	-85.7	-35.6	-179.9	-46.5	0	0	0	0	111.3	R56 K59 P86 V87 V88	R56-T90 PolarHBondContact NH1-O 3.39Å; K59-T90 HydrophobicContact CB-CG2 4.04Å; P86-T90 WeakPolarHBondContact O-CB 3.01Å; P86-T90 PolarHBondContact O-N 2.94Å; P86-T90 PolarHBondContact O-OG1 3.45Å; V87-T90 PolarHBondContact O-N 3.41Å; V87-T90 VanDerWaalsContact O-N 3.13Å; V88-T90 VanDerWaalsContact C-N 3.28Å; V88-T90 PolarHBondContact O-N 3.07Å
91	Y	81.8	Confident	80	Confident	65 Å²	65	63.1 Å²	63.1	26%	0.255	32%	0.324	S	S	.	.	S	Bend	trans	-98.9	13.4	175.8	-69.1	-76.5	0	0	0	114	R56 V64 V87 G93 Y94 G95 E503	R56-Y91 VanDerWaalsContact CZ-CE1 3.44Å; R56-Y91 VanDerWaalsContact NH1-CZ 3.27Å; R56-Y91 VanDerWaalsContact NH2-CZ 3.27Å; R56-Y91 PolarHBondContact NH2-OH 3.41Å; V64-Y91 HydrophobicContact CB-CE2 4.34Å; V64-Y91 HydrophobicContact CG1-CE2 4.08Å; V64-Y91 HydrophobicContact CG2-CD2 4.11Å; V64-Y91 HydrophobicContact CG2-CE2 3.32Å; V87-Y91 HydrophobicContact CG1-CD2 4.04Å; V87-Y91 HydrophobicContact CG1-CE2 4.43Å; V87-Y91 PolarHBondContact O-N 2.89Å; Y91-G93 VanDerWaalsContact C-N 3.27Å; Y91-G93 PolarHBondContact O-N 2.93Å; Y91-Y94 AromaticContact CD1-CD2 3.95Å; Y91-Y94 HydrophobicContact CD1-CD2 3.95Å; Y91-Y94 PolarHBondContact O-N 3.28Å; Y91-Y94 VanDerWaalsContact O-N 3.13Å; Y91-G95 PolarHBondContact O-N 3.05Å; Y91-E503 HydrophobicContact CE1-CG 4.45Å
92	L	84.5	Confident	81.7	Confident	92 Å²	92	59.5 Å²	59.5	48%	0.482	32%	0.316	S	S	.	.	H	α-helix	trans	-55.5	-43.5	-174.7	-170.4	66.5	0	0	0	111.9	V88 G95 I96	V88-L92 HydrophobicContact CG1-CD1 4.46Å; V88-L92 VanDerWaalsContact O-CA 3.31Å; V88-L92 WeakPolarHBondContact O-CA 3.2Å; V88-L92 VanDerWaalsContact O-CB 3.29Å; V88-L92 WeakPolarHBondContact O-CB 3.49Å; V88-L92 PolarHBondContact O-N 3.48Å; L92-G95 PolarHBondContact O-N 2.93Å; L92-I96 HydrophobicContact CD1-CD1 4.46Å; L92-I96 HydrophobicContact CD2-CD1 4.37Å; L92-I96 HydrophobicContact CG-CD1 3.86Å; L92-I96 HydrophobicContact CG-CG1 4.42Å; L92-I96 WeakPolarHBondContact O-CB 3.46Å; L92-I96 VanDerWaalsContact O-CG1 3.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.44Å; L92-I96 PolarHBondContact O-N 3.44Å
93	G	89.1	Confident	83.4	Confident	15 Å²	15	53 Å²	53	16%	0.155	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-42.7	179.2	0	0	0	0	0	113.1	I55 Y91 G95 I96 C97	I55-G93 VanDerWaalsContact O-CA 3.29Å; I55-G93 WeakPolarHBondContact O-CA 3.11Å; Y91-G93 VanDerWaalsContact C-N 3.27Å; Y91-G93 PolarHBondContact O-N 2.93Å; G93-G95 VanDerWaalsContact C-N 3.34Å; G93-G95 PolarHBondContact O-N 3.16Å; G93-I96 PolarHBondContact O-N 3.39Å; G93-C97 WeakPolarHBondContact O-CB 3.34Å; G93-C97 PolarHBondContact O-N 2.84Å; G93-C97 PolarHBondContact O-SG 3.01Å; G93-C97 VanDerWaalsContact O-SG 3.32Å
94	Y	91.1	Very high	85	Confident	8 Å²	8	53 Å²	53	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-60.1	-44.5	172.7	-81	-81.1	0	0	0	111.9	L52 I55 R56 Y91 C97 L98 F494 G498 T499 T502	L52-Y94 HydrophobicContact CD2-CE1 4.4Å; I55-Y94 HydrophobicContact CD1-CD1 3.79Å; I55-Y94 HydrophobicContact CD1-CD2 4.1Å; I55-Y94 HydrophobicContact CD1-CE1 3.55Å; I55-Y94 HydrophobicContact CD1-CE2 3.91Å; I55-Y94 HydrophobicContact CD1-CG 4.06Å; I55-Y94 HydrophobicContact CG1-CD2 4.34Å; I55-Y94 HydrophobicContact CG1-CE2 4.1Å; R56-Y94 HydrophobicContact CB-CE2 4.23Å; Y91-Y94 AromaticContact CD1-CD2 3.95Å; Y91-Y94 HydrophobicContact CD1-CD2 3.95Å; Y91-Y94 PolarHBondContact O-N 3.28Å; Y91-Y94 VanDerWaalsContact O-N 3.13Å; Y94-C97 PolarHBondContact O-N 3.3Å; Y94-L98 WeakPolarHBondContact O-CB 3.34Å; Y94-L98 PolarHBondContact O-N 3.44Å; Y94-F494 AromaticContact CD1-CE1 3.83Å; Y94-F494 HydrophobicContact CD1-CE1 3.83Å; Y94-F494 HydrophobicContact CD1-CE2 4.03Å; Y94-F494 AromaticContact CD1-CZ 3.42Å; Y94-F494 HydrophobicContact CD1-CZ 3.42Å; Y94-F494 VanDerWaalsContact CD1-CZ 3.42Å; Y94-F494 HydrophobicContact CE1-CE1 4.39Å; Y94-F494 AromaticContact CE1-CE2 3.85Å; Y94-F494 HydrophobicContact CE1-CE2 3.85Å; Y94-F494 AromaticContact CE1-CZ 3.74Å; Y94-F494 HydrophobicContact CE1-CZ 3.74Å; Y94-F494 HydrophobicContact CG-CZ 4.38Å; Y94-G498 PolarHBondContact OH-O 3.32Å; Y94-T499 HydrophobicContact CD1-CG2 4.38Å; Y94-T499 HydrophobicContact CE1-CG2 4.06Å; Y94-T499 PolarHBondContact OH-N 2.97Å; Y94-T502 HydrophobicContact CE2-CG2 4.44Å; Y94-T502 WeakPolarHBondContact OH-CG2 3.33Å; Y94-T502 PolarHBondContact OH-OG1 2.84Å
95	G	89.6	Confident	86.3	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176.8	0	0	0	0	0	112.3	Y91 L92 G93 L98 V99	Y91-G95 PolarHBondContact O-N 3.05Å; L92-G95 PolarHBondContact O-N 2.93Å; G93-G95 VanDerWaalsContact C-N 3.34Å; G93-G95 PolarHBondContact O-N 3.16Å; G95-L98 PolarHBondContact O-N 2.68Å; G95-V99 VanDerWaalsContact O-CG2 3.3Å; G95-V99 WeakPolarHBondContact O-CG2 3.46Å; G95-V99 PolarHBondContact O-N 3.38Å
96	I	92.2	Very high	87.5	Confident	81 Å²	81	52.1 Å²	52.1	42%	0.415	29%	0.29	S	S	.	.	H	α-helix	trans	-60.7	-49.4	175.6	-71.7	168.3	0	0	0	110.4	L92 G93 L98 V99 F100	L92-I96 HydrophobicContact CD1-CD1 4.46Å; L92-I96 HydrophobicContact CD2-CD1 4.37Å; L92-I96 HydrophobicContact CG-CD1 3.86Å; L92-I96 HydrophobicContact CG-CG1 4.42Å; L92-I96 WeakPolarHBondContact O-CB 3.46Å; L92-I96 VanDerWaalsContact O-CG1 3.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.44Å; L92-I96 PolarHBondContact O-N 3.44Å; G93-I96 PolarHBondContact O-N 3.39Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 2.88Å; I96-V99 PolarHBondContact O-N 3.42Å; I96-F100 HydrophobicContact CG2-CD2 3.51Å; I96-F100 HydrophobicContact CG2-CE2 3.49Å; I96-F100 VanDerWaalsContact CG2-CE2 3.49Å; I96-F100 VanDerWaalsContact O-CD2 3.23Å; I96-F100 WeakPolarHBondContact O-CD2 3.4Å; I96-F100 PolarHBondContact O-N 3.37Å
97	C	93.9	Very high	88.9	Confident	35 Å²	35	55.5 Å²	55.5	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-41.3	178.1	-70.9	0	0	0	0	112.3	G93 Y94 F100 G101 F494	G93-C97 WeakPolarHBondContact O-CB 3.34Å; G93-C97 PolarHBondContact O-N 2.84Å; G93-C97 PolarHBondContact O-SG 3.01Å; G93-C97 VanDerWaalsContact O-SG 3.32Å; Y94-C97 PolarHBondContact O-N 3.3Å; C97-F100 PolarHBondContact O-N 2.92Å; C97-G101 PolarHBondContact O-N 3.05Å; C97-F494 HydrophobicContact CB-CE1 3.79Å; C97-F494 HydrophobicContact CB-CZ 3.68Å
98	L	94.6	Very high	90.1	Very high	51 Å²	51	54.7 Å²	54.7	27%	0.267	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-46	176.3	-178.9	61.6	0	0	0	111.5	Y94 G95 I96 G101 L102 I491 L495	Y94-L98 WeakPolarHBondContact O-CB 3.34Å; Y94-L98 PolarHBondContact O-N 3.44Å; G95-L98 PolarHBondContact O-N 2.68Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 2.88Å; L98-G101 PolarHBondContact O-N 3.49Å; L98-L102 HydrophobicContact CD1-CD1 4.23Å; L98-L102 HydrophobicContact CD1-CG 4.28Å; L98-L102 HydrophobicContact CG-CD1 4.11Å; L98-L102 WeakPolarHBondContact O-CB 3.14Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.02Å; L98-L102 PolarHBondContact O-N 3.18Å; L98-I491 HydrophobicContact CD1-CG2 3.56Å; L98-L495 HydrophobicContact CD1-CD1 4.03Å
99	V	95.7	Very high	91.1	Very high	81 Å²	81	53.3 Å²	53.3	49%	0.491	29%	0.287	S	S	.	.	H	α-helix	trans	-61.8	-47.5	176.9	170.3	0	0	0	0	110.4	G95 I96 G101 L102 L103	G95-V99 VanDerWaalsContact O-CG2 3.3Å; G95-V99 WeakPolarHBondContact O-CG2 3.46Å; G95-V99 PolarHBondContact O-N 3.38Å; I96-V99 PolarHBondContact O-N 3.42Å; V99-G101 VanDerWaalsContact C-N 3.33Å; V99-G101 PolarHBondContact O-N 3.44Å; V99-L102 PolarHBondContact O-N 3.48Å; V99-L103 HydrophobicContact CG1-CD1 3.76Å; V99-L103 HydrophobicContact CG1-CG 4.1Å; V99-L103 WeakPolarHBondContact O-CB 3.34Å; V99-L103 WeakPolarHBondContact O-CG 3.46Å; V99-L103 PolarHBondContact O-N 3.26Å
100	F	95	Very high	92	Very high	141 Å²	141	55.2 Å²	55.2	62%	0.618	30%	0.295	S	S	*	.	H	α-helix	trans	-61	-40.7	176.3	-83.7	-66.1	0	0	0	112.6	I96 C97 F104	I96-F100 HydrophobicContact CG2-CD2 3.51Å; I96-F100 HydrophobicContact CG2-CE2 3.49Å; I96-F100 VanDerWaalsContact CG2-CE2 3.49Å; I96-F100 VanDerWaalsContact O-CD2 3.23Å; I96-F100 WeakPolarHBondContact O-CD2 3.4Å; I96-F100 PolarHBondContact O-N 3.37Å; C97-F100 PolarHBondContact O-N 2.92Å; F100-F104 VanDerWaalsContact O-CB 3.26Å; F100-F104 WeakPolarHBondContact O-CB 3.43Å; F100-F104 PolarHBondContact O-N 2.92Å
101	G	95.5	Very high	92.8	Very high	7 Å²	7	58.8 Å²	58.8	7%	0.072	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-45.8	175.5	0	0	0	0	0	112.5	C97 L98 V99 F104 A105 M487	C97-G101 PolarHBondContact O-N 3.05Å; L98-G101 PolarHBondContact O-N 3.49Å; V99-G101 VanDerWaalsContact C-N 3.33Å; V99-G101 PolarHBondContact O-N 3.44Å; G101-F104 PolarHBondContact O-N 3.48Å; G101-A105 WeakPolarHBondContact O-CB 3.18Å; G101-A105 PolarHBondContact O-N 3.18Å; G101-M487 VanDerWaalsContact O-CG 3.31Å; G101-M487 WeakPolarHBondContact O-CG 3.34Å
102	L	97.1	Very high	93.3	Very high	85 Å²	85	55.8 Å²	55.8	45%	0.445	31%	0.306	S	S	.	.	H	α-helix	trans	-66.9	-43.2	177.3	-70.1	174.2	0	0	0	112.1	L98 V99 F104 A105 I106 I491	L98-L102 HydrophobicContact CD1-CD1 4.23Å; L98-L102 HydrophobicContact CD1-CG 4.28Å; L98-L102 HydrophobicContact CG-CD1 4.11Å; L98-L102 WeakPolarHBondContact O-CB 3.14Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.02Å; L98-L102 PolarHBondContact O-N 3.18Å; V99-L102 PolarHBondContact O-N 3.48Å; L102-F104 VanDerWaalsContact C-N 3.31Å; L102-F104 PolarHBondContact O-N 3.43Å; L102-A105 PolarHBondContact O-N 3.29Å; L102-I106 WeakPolarHBondContact O-CB 3.44Å; L102-I106 VanDerWaalsContact O-CG1 3.31Å; L102-I106 WeakPolarHBondContact O-CG1 3.48Å; L102-I106 PolarHBondContact O-N 3.02Å; L102-I491 HydrophobicContact CD2-CD1 4.26Å
103	L	96.4	Very high	93.6	Very high	72 Å²	72	56.3 Å²	56.3	38%	0.377	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-40.6	175.1	-69.6	179.9	0	0	0	110.9	V99 I106 F107	V99-L103 HydrophobicContact CG1-CD1 3.76Å; V99-L103 HydrophobicContact CG1-CG 4.1Å; V99-L103 WeakPolarHBondContact O-CB 3.34Å; V99-L103 WeakPolarHBondContact O-CG 3.46Å; V99-L103 PolarHBondContact O-N 3.26Å; L103-I106 PolarHBondContact O-N 3.42Å; L103-F107 HydrophobicContact CB-CD2 3.98Å; L103-F107 HydrophobicContact CB-CE2 4.16Å; L103-F107 HydrophobicContact CD2-CD2 4.32Å; L103-F107 HydrophobicContact CD2-CE2 3.75Å; L103-F107 HydrophobicContact CG-CE2 4.38Å; L103-F107 WeakPolarHBondContact O-CB 3.36Å; L103-F107 WeakPolarHBondContact O-CD2 3.4Å; L103-F107 WeakPolarHBondContact O-CG 3.48Å; L103-F107 PolarHBondContact O-N 3.37Å
104	F	96.1	Very high	93.6	Very high	25 Å²	25	60.4 Å²	60.4	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-61.8	-48.2	173.4	-179	-83.3	0	0	0	111.3	F100 G101 L102 I106 M108 M487 L791 I795	F100-F104 VanDerWaalsContact O-CB 3.26Å; F100-F104 WeakPolarHBondContact O-CB 3.43Å; F100-F104 PolarHBondContact O-N 2.92Å; G101-F104 PolarHBondContact O-N 3.48Å; L102-F104 VanDerWaalsContact C-N 3.31Å; L102-F104 PolarHBondContact O-N 3.43Å; F104-I106 PolarHBondContact O-N 3.47Å; F104-M108 HydrophobicContact CD1-CG 3.88Å; F104-M108 HydrophobicContact CD2-CG 3.85Å; F104-M108 HydrophobicContact CD2-SD 4.41Å; F104-M108 HydrophobicContact CE1-CE 4.36Å; F104-M108 HydrophobicContact CE1-CG 3.79Å; F104-M108 HydrophobicContact CE2-CE 4.08Å; F104-M108 HydrophobicContact CE2-CG 3.76Å; F104-M108 HydrophobicContact CE2-SD 3.91Å; F104-M108 HydrophobicContact CG-CG 3.93Å; F104-M108 HydrophobicContact CZ-CE 3.7Å; F104-M108 HydrophobicContact CZ-CG 3.74Å; F104-M108 HydrophobicContact CZ-SD 4.08Å; F104-M108 VanDerWaalsContact O-CB 3.22Å; F104-M108 WeakPolarHBondContact O-CB 3.09Å; F104-M108 WeakPolarHBondContact O-CG 3.35Å; F104-M108 PolarHBondContact O-N 2.93Å; F104-M487 HydrophobicContact CB-CE 3.93Å; F104-M487 HydrophobicContact CD1-CB 3.99Å; F104-M487 HydrophobicContact CD1-CE 3.24Å; F104-M487 HydrophobicContact CD1-CG 3.96Å; F104-M487 HydrophobicContact CD1-SD 4.45Å; F104-M487 HydrophobicContact CD2-CE 4.23Å; F104-M487 HydrophobicContact CE1-CB 4.31Å; F104-M487 HydrophobicContact CE1-CE 3.67Å; F104-M487 HydrophobicContact CG-CE 3.55Å; F104-M487 HydrophobicContact CZ-CE 4.31Å; F104-L791 HydrophobicContact CE1-CB 4.31Å; F104-L791 HydrophobicContact CE1-CD2 4.14Å; F104-L791 HydrophobicContact CZ-CB 4.09Å; F104-L791 HydrophobicContact CZ-CD2 4.34Å; F104-L791 WeakPolarHBondContact CZ-O 3.46Å; F104-I795 HydrophobicContact CD2-CD1 4.21Å; F104-I795 HydrophobicContact CE2-CD1 4.09Å; F104-I795 HydrophobicContact CE2-CG1 4.03Å
105	A	95	Very high	93.5	Very high	11 Å²	11	61.3 Å²	61.3	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-61.6	-30.9	-179.1	0	0	0	0	0	113.2	G101 L102 P109 T484 M487	G101-A105 WeakPolarHBondContact O-CB 3.18Å; G101-A105 PolarHBondContact O-N 3.18Å; L102-A105 PolarHBondContact O-N 3.29Å; A105-P109 WeakPolarHBondContact O-CD 3.47Å; A105-P109 WeakPolarHBondContact O-CG 3.31Å; A105-T484 HydrophobicContact CB-CG2 4.27Å; A105-T484 PolarHBondContact O-OG1 2.83Å; A105-M487 HydrophobicContact CB-CB 4.24Å; A105-M487 HydrophobicContact CB-CG 4.07Å
106	I	95	Very high	93.2	Very high	97 Å²	97	64.2 Å²	64.2	50%	0.497	34%	0.337	S	S	.	.	H	α-helix	trans	-88.1	-47.8	178.1	-65.4	167.1	0	0	0	111.6	L102 L103 F104 P109 L110	L102-I106 WeakPolarHBondContact O-CB 3.44Å; L102-I106 VanDerWaalsContact O-CG1 3.31Å; L102-I106 WeakPolarHBondContact O-CG1 3.48Å; L102-I106 PolarHBondContact O-N 3.02Å; L103-I106 PolarHBondContact O-N 3.42Å; F104-I106 PolarHBondContact O-N 3.47Å; I106-P109 WeakPolarHBondContact O-CD 3.44Å; I106-P109 VanDerWaalsContact O-CG 3.31Å; I106-P109 WeakPolarHBondContact O-CG 3.35Å; I106-L110 HydrophobicContact CG2-CD1 3.79Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.47Å; I106-L110 PolarHBondContact O-N 3.45Å
107	F	94.7	Very high	92.9	Very high	113 Å²	113	63.8 Å²	63.8	50%	0.496	34%	0.341	S	S	.	.	H	α-helix	trans	-73.9	-35	-174.3	-76.1	-54.9	0	0	0	113.1	L103 L110 V111	L103-F107 HydrophobicContact CB-CD2 3.98Å; L103-F107 HydrophobicContact CB-CE2 4.16Å; L103-F107 HydrophobicContact CD2-CD2 4.32Å; L103-F107 HydrophobicContact CD2-CE2 3.75Å; L103-F107 HydrophobicContact CG-CE2 4.38Å; L103-F107 WeakPolarHBondContact O-CB 3.36Å; L103-F107 WeakPolarHBondContact O-CD2 3.4Å; L103-F107 WeakPolarHBondContact O-CG 3.48Å; L103-F107 PolarHBondContact O-N 3.37Å; F107-L110 HydrophobicContact CD1-CD1 4.48Å; F107-L110 PolarHBondContact O-N 2.74Å; F107-V111 VanDerWaalsContact O-CB 3.28Å; F107-V111 WeakPolarHBondContact O-CB 3.27Å; F107-V111 WeakPolarHBondContact O-CG2 3.37Å; F107-V111 PolarHBondContact O-N 3Å
108	M	94.3	Very high	92.4	Very high	15 Å²	15	63 Å²	63	7%	0.074	34%	0.337	C	S	.	.	H	α-helix	trans	-56.2	-51.4	179.6	-75.1	-75.7	-76.5	0	0	112.9	F104 G112 F480 S483 F794 I795 I798	F104-M108 HydrophobicContact CD1-CG 3.88Å; F104-M108 HydrophobicContact CD2-CG 3.85Å; F104-M108 HydrophobicContact CD2-SD 4.41Å; F104-M108 HydrophobicContact CE1-CE 4.36Å; F104-M108 HydrophobicContact CE1-CG 3.79Å; F104-M108 HydrophobicContact CE2-CE 4.08Å; F104-M108 HydrophobicContact CE2-CG 3.76Å; F104-M108 HydrophobicContact CE2-SD 3.91Å; F104-M108 HydrophobicContact CG-CG 3.93Å; F104-M108 HydrophobicContact CZ-CE 3.7Å; F104-M108 HydrophobicContact CZ-CG 3.74Å; F104-M108 HydrophobicContact CZ-SD 4.08Å; F104-M108 VanDerWaalsContact O-CB 3.22Å; F104-M108 WeakPolarHBondContact O-CB 3.09Å; F104-M108 WeakPolarHBondContact O-CG 3.35Å; F104-M108 PolarHBondContact O-N 2.93Å; M108-G112 PolarHBondContact O-N 3.33Å; M108-F480 HydrophobicContact CB-CD1 4.5Å; M108-F480 HydrophobicContact CE-CD1 4.17Å; M108-F480 HydrophobicContact CE-CE1 4.39Å; M108-F480 WeakPolarHBondContact O-CD1 3.13Å; M108-F480 HydrophobicContact SD-CD1 4.35Å; M108-F480 HydrophobicContact SD-CE1 4.22Å; M108-S483 WeakPolarHBondContact CB-OG 3.22Å; M108-F794 HydrophobicContact CE-CB 4.11Å; M108-F794 HydrophobicContact CE-CD2 4.37Å; M108-I795 HydrophobicContact SD-CG1 4.45Å; M108-I798 HydrophobicContact CE-CD1 3.68Å; M108-I798 HydrophobicContact SD-CD1 4.43Å
109	P	92.2	Very high	91.6	Very high	39 Å²	39	62.5 Å²	62.5	25%	0.253	33%	0.331	S	S	.	.	H	α-helix	trans	-67.9	-35.8	176.5	26.5	-35.9	0	0	0	113	A105 I106 G112 I113 T484	A105-P109 WeakPolarHBondContact O-CD 3.47Å; A105-P109 WeakPolarHBondContact O-CG 3.31Å; I106-P109 WeakPolarHBondContact O-CD 3.44Å; I106-P109 VanDerWaalsContact O-CG 3.31Å; I106-P109 WeakPolarHBondContact O-CG 3.35Å; P109-G112 CarbonylContact O-C 3.49Å; P109-G112 WeakPolarHBondContact O-CA 3.46Å; P109-G112 PolarHBondContact O-N 3Å; P109-I113 WeakPolarHBondContact O-CG1 3.18Å; P109-I113 PolarHBondContact O-N 3.31Å; P109-T484 WeakPolarHBondContact CG-OG1 3.16Å
110	L	93.5	Very high	90.8	Very high	91 Å²	91	64 Å²	64	48%	0.476	34%	0.344	S	S	.	.	H	α-helix	trans	-64.3	-46.1	176.9	-69.9	175.5	0	0	0	112.1	I106 F107 G112 I113 V114	I106-L110 HydrophobicContact CG2-CD1 3.79Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.47Å; I106-L110 PolarHBondContact O-N 3.45Å; F107-L110 HydrophobicContact CD1-CD1 4.48Å; F107-L110 PolarHBondContact O-N 2.74Å; L110-G112 VanDerWaalsContact C-N 3.26Å; L110-G112 PolarHBondContact O-N 3.48Å; L110-I113 PolarHBondContact O-N 3.11Å; L110-V114 WeakPolarHBondContact O-CG2 3.24Å; L110-V114 PolarHBondContact O-N 3.15Å
111	V	92.6	Very high	89.9	Confident	77 Å²	77	62 Å²	62	47%	0.467	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-39.5	173	171.9	0	0	0	0	109.6	F107 V114 F115 F480	F107-V111 VanDerWaalsContact O-CB 3.28Å; F107-V111 WeakPolarHBondContact O-CB 3.27Å; F107-V111 WeakPolarHBondContact O-CG2 3.37Å; F107-V111 PolarHBondContact O-N 3Å; V111-V114 PolarHBondContact O-N 2.85Å; V111-F115 WeakPolarHBondContact O-CB 3.09Å; V111-F115 PolarHBondContact O-N 3.01Å; V111-F480 HydrophobicContact CB-CE1 4.45Å; V111-F480 HydrophobicContact CG1-CE1 4.11Å; V111-F480 HydrophobicContact CG1-CZ 4.17Å
112	G	91.4	Very high	88.6	Confident	2 Å²	2	62.7 Å²	62.7	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-55.8	-52.1	172.1	0	0	0	0	0	112.5	M108 P109 L110 V114 F115 F116	M108-G112 PolarHBondContact O-N 3.33Å; P109-G112 CarbonylContact O-C 3.49Å; P109-G112 WeakPolarHBondContact O-CA 3.46Å; P109-G112 PolarHBondContact O-N 3Å; L110-G112 VanDerWaalsContact C-N 3.26Å; L110-G112 PolarHBondContact O-N 3.48Å; G112-V114 PolarHBondContact O-N 3.25Å; G112-F115 WeakPolarHBondContact O-CB 3.07Å; G112-F115 PolarHBondContact O-N 3.43Å; G112-F116 WeakPolarHBondContact O-CB 3.34Å; G112-F116 WeakPolarHBondContact O-CD2 3.39Å; G112-F116 PolarHBondContact O-N 2.87Å
113	I	90.7	Very high	87.3	Confident	103 Å²	103	65.7 Å²	65.7	53%	0.528	36%	0.363	S	S	.	.	H	α-helix	trans	-59.8	-49.1	178.8	-67.3	163.6	0	0	0	110.6	P109 L110 F115 F116 C117	P109-I113 WeakPolarHBondContact O-CG1 3.18Å; P109-I113 PolarHBondContact O-N 3.31Å; L110-I113 PolarHBondContact O-N 3.11Å; I113-F115 VanDerWaalsContact C-N 3.31Å; I113-F115 PolarHBondContact O-N 3.45Å; I113-F116 PolarHBondContact O-N 2.91Å; I113-C117 WeakPolarHBondContact O-CB 3.16Å; I113-C117 PolarHBondContact O-N 3.34Å; I113-C117 PolarHBondContact O-SG 3.25Å
114	V	89.9	Confident	85.9	Confident	101 Å²	101	65.6 Å²	65.6	61%	0.612	37%	0.367	S	S	*	.	H	α-helix	trans	-61.1	-42.5	178	173.2	0	0	0	0	110.9	L110 V111 G112 C117 A118	L110-V114 WeakPolarHBondContact O-CG2 3.24Å; L110-V114 PolarHBondContact O-N 3.15Å; V111-V114 PolarHBondContact O-N 2.85Å; G112-V114 PolarHBondContact O-N 3.25Å; V114-C117 PolarHBondContact O-N 3.36Å; V114-A118 WeakPolarHBondContact O-CB 3.24Å; V114-A118 PolarHBondContact O-N 3.24Å
115	F	87.4	Confident	84.3	Confident	27 Å²	27	66.4 Å²	66.4	12%	0.118	38%	0.382	C	S	.	.	H	α-helix	trans	-61.7	-46	177.4	177	-100.6	0	0	0	111.4	V111 G112 I113 R119 C124 L473 V476 F480 V802	V111-F115 WeakPolarHBondContact O-CB 3.09Å; V111-F115 PolarHBondContact O-N 3.01Å; G112-F115 WeakPolarHBondContact O-CB 3.07Å; G112-F115 PolarHBondContact O-N 3.43Å; I113-F115 VanDerWaalsContact C-N 3.31Å; I113-F115 PolarHBondContact O-N 3.45Å; F115-R119 WeakPolarHBondContact O-CB 3.4Å; F115-R119 PolarHBondContact O-N 2.8Å; F115-C124 HydrophobicContact CD2-CB 4.14Å; F115-C124 HydrophobicContact CE2-CB 4.14Å; F115-L473 HydrophobicContact CZ-CD2 4.31Å; F115-V476 HydrophobicContact CE1-CG1 4.2Å; F115-F480 HydrophobicContact CB-CE2 4.49Å; F115-F480 HydrophobicContact CD1-CE2 4.05Å; F115-F480 HydrophobicContact CG-CE2 4.37Å; F115-V802 HydrophobicContact CE1-CG2 4.26Å; F115-V802 HydrophobicContact CE2-CG1 3.75Å; F115-V802 HydrophobicContact CE2-CG2 3.91Å; F115-V802 HydrophobicContact CZ-CB 4.34Å; F115-V802 HydrophobicContact CZ-CG1 3.82Å; F115-V802 HydrophobicContact CZ-CG2 3.48Å; F115-V802 VanDerWaalsContact CZ-CG2 3.48Å
116	F	84.8	Confident	82.6	Confident	95 Å²	95	66.7 Å²	66.7	42%	0.417	39%	0.387	S	S	.	.	H	α-helix	trans	-64.6	-46.5	176.7	-82.3	-66.2	0	0	0	112.3	G112 I113 R119 C120 G477 F480	G112-F116 WeakPolarHBondContact O-CB 3.34Å; G112-F116 WeakPolarHBondContact O-CD2 3.39Å; G112-F116 PolarHBondContact O-N 2.87Å; I113-F116 PolarHBondContact O-N 2.91Å; F116-R119 PolarHBondContact O-N 2.88Å; F116-C120 PolarHBondContact O-N 2.91Å; F116-C120 PolarHBondContact O-SG 3.25Å; F116-G477 VanDerWaalsContact CZ-CA 3.49Å; F116-F480 HydrophobicContact CE2-CD2 4.48Å
117	C	86	Confident	81.3	Confident	72 Å²	72	72 Å²	72	49%	0.486	40%	0.401	S	S	.	.	H	α-helix	trans	-62.6	-47.2	176.6	-68.7	0	0	0	0	111.8	I113 V114 R119 C120 C121	I113-C117 WeakPolarHBondContact O-CB 3.16Å; I113-C117 PolarHBondContact O-N 3.34Å; I113-C117 PolarHBondContact O-SG 3.25Å; V114-C117 PolarHBondContact O-N 3.36Å; C117-R119 VanDerWaalsContact C-N 3.25Å; C117-R119 PolarHBondContact O-N 2.8Å; C117-C120 PolarHBondContact O-N 3.41Å; C117-C121 PolarHBondContact O-N 2.99Å; C117-C121 PolarHBondContact O-SG 2.84Å; C117-C121 VanDerWaalsContact O-SG 3.33Å
118	A	83.6	Confident	79.9	Confident	19 Å²	19	69.3 Å²	69.3	16%	0.157	39%	0.393	C	S	.	.	H	α-helix	trans	-59.9	-39.8	177.4	0	0	0	0	0	111	V114 C121 G122 K123 C124	V114-A118 WeakPolarHBondContact O-CB 3.24Å; V114-A118 PolarHBondContact O-N 3.24Å; A118-C121 CarbonylContact O-C 3.59Å; A118-C121 PolarHBondContact O-N 3.45Å; A118-G122 PolarHBondContact O-N 3.07Å; A118-K123 CarbonylContact C-O 3.57Å; A118-K123 HydrophobicContact CB-CB 4.16Å; A118-K123 CarbonylContact O-C 3.58Å; A118-K123 VanDerWaalsContact O-CA 3.28Å; A118-K123 WeakPolarHBondContact O-CA 3.08Å; A118-K123 WeakPolarHBondContact O-CB 3.14Å; A118-K123 PolarHBondContact O-N 3.48Å; A118-C124 HydrophobicContact CB-CB 4.1Å
119	R	77.2	Confident	78.7	Confident	40 Å²	40	74.8 Å²	74.8	15%	0.151	42%	0.418	C	S	.	.	H	α-helix	trans	-67	-40.7	176.7	-168.7	166.4	-177.7	72.4	11.5	113.2	F115 F116 C117 C121 G122 K123 C124 G125 L473 R809	F115-R119 WeakPolarHBondContact O-CB 3.4Å; F115-R119 PolarHBondContact O-N 2.8Å; F116-R119 PolarHBondContact O-N 2.88Å; C117-R119 VanDerWaalsContact C-N 3.25Å; C117-R119 PolarHBondContact O-N 2.8Å; R119-C121 PolarHBondContact O-N 2.91Å; R119-G122 PolarHBondContact O-N 2.81Å; R119-K123 VanDerWaalsContact CA-O 3.29Å; R119-K123 WeakPolarHBondContact CA-O 3.49Å; R119-C124 PolarHBondContact NH1-O 2.8Å; R119-C124 VanDerWaalsContact NH1-O 3.16Å; R119-G125 PolarHBondContact NH1-O 3.18Å; R119-G125 PolarHBondContact NH2-O 2.84Å; R119-L473 VanDerWaalsContact NH2-CD1 3.29Å; R119-R809 VanDerWaalsContact NH2-NH1 3.12Å
120	C	78.1	Confident	77.7	Confident	113 Å²	113	78 Å²	78	76%	0.764	43%	0.429	S	S	*	.	H	α-helix	trans	-61.1	-35.4	172.3	-65.1	0	0	0	0	111.7	F116 C117 G122	F116-C120 PolarHBondContact O-N 2.91Å; F116-C120 PolarHBondContact O-SG 3.25Å; C117-C120 PolarHBondContact O-N 3.41Å; C120-G122 PolarHBondContact O-N 3.38Å
121	C	77.2	Confident	76.8	Confident	99 Å²	99	75.8 Å²	75.8	67%	0.669	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	10.8	174.4	-62.8	0	0	0	0	114	C117 A118 R119 K123	C117-C121 PolarHBondContact O-N 2.99Å; C117-C121 PolarHBondContact O-SG 2.84Å; C117-C121 VanDerWaalsContact O-SG 3.33Å; A118-C121 CarbonylContact O-C 3.59Å; A118-C121 PolarHBondContact O-N 3.45Å; R119-C121 PolarHBondContact O-N 2.91Å; C121-K123 PolarHBondContact O-N 3.44Å
122	G	67.8	Low	76.1	Confident	20 Å²	20	72.2 Å²	72.2	21%	0.206	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	3.1	-178.9	0	0	0	0	0	115.4	A118 R119 C120 R127	A118-G122 PolarHBondContact O-N 3.07Å; R119-G122 PolarHBondContact O-N 2.81Å; C120-G122 PolarHBondContact O-N 3.38Å; G122-R127 WeakPolarHBondContact O-CG 3.38Å; G122-R127 PolarHBondContact O-N 2.98Å
123	K	70	Confident	75.6	Confident	149 Å²	149	74.9 Å²	74.9	65%	0.648	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	175.6	172.3	-62.8	-178.3	179.7	176.3	0	110.5	A118 R119 C121 G125 G126	A118-K123 CarbonylContact C-O 3.57Å; A118-K123 HydrophobicContact CB-CB 4.16Å; A118-K123 CarbonylContact O-C 3.58Å; A118-K123 VanDerWaalsContact O-CA 3.28Å; A118-K123 WeakPolarHBondContact O-CA 3.08Å; A118-K123 WeakPolarHBondContact O-CB 3.14Å; A118-K123 PolarHBondContact O-N 3.48Å; R119-K123 VanDerWaalsContact CA-O 3.29Å; R119-K123 WeakPolarHBondContact CA-O 3.49Å; C121-K123 PolarHBondContact O-N 3.44Å; K123-G125 VanDerWaalsContact C-N 3.3Å; K123-G125 PolarHBondContact O-N 3.28Å; K123-G126 PolarHBondContact O-N 3.47Å
124	C	66.5	Low	75	Confident	70 Å²	70	76.8 Å²	76.8	47%	0.473	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	46.3	178.7	-62.3	0	0	0	0	113.8	F115 A118 R119 G126	F115-C124 HydrophobicContact CD2-CB 4.14Å; F115-C124 HydrophobicContact CE2-CB 4.14Å; A118-C124 HydrophobicContact CB-CB 4.1Å; R119-C124 PolarHBondContact NH1-O 2.8Å; R119-C124 VanDerWaalsContact NH1-O 3.16Å; C124-G126 VanDerWaalsContact C-N 3.34Å; C124-G126 PolarHBondContact O-N 3.26Å
125	G	61.6	Low	74.6	Confident	41 Å²	41	77.9 Å²	77.9	42%	0.423	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	10.1	-179.1	0	0	0	0	0	115.1	R119 K123	R119-G125 PolarHBondContact NH1-O 3.18Å; R119-G125 PolarHBondContact NH2-O 2.84Å; K123-G125 VanDerWaalsContact C-N 3.3Å; K123-G125 PolarHBondContact O-N 3.28Å
126	G	60.7	Low	74.5	Confident	18 Å²	18	76.8 Å²	76.8	19%	0.186	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-38.4	175.5	0	0	0	0	0	112.4	K123 C124 V128	K123-G126 PolarHBondContact O-N 3.47Å; C124-G126 VanDerWaalsContact C-N 3.34Å; C124-G126 PolarHBondContact O-N 3.26Å; G126-V128 PolarHBondContact O-N 3.48Å
127	R	66.5	Low	74.4	Confident	209 Å²	209	75.4 Å²	75.4	79%	0.789	41%	0.414	S	S	*	.	S	Bend	trans	-70.3	122.6	168.3	-79	175.3	-174.6	168.9	0.9	110.7	G122	G122-R127 WeakPolarHBondContact O-CG 3.38Å; G122-R127 PolarHBondContact O-N 2.98Å
128	V	66.5	Low	74.5	Confident	56 Å²	56	75.8 Å²	75.8	34%	0.339	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-80.7	121.7	173.3	-174.9	0	0	0	0	108	G126 R809	G126-V128 PolarHBondContact O-N 3.48Å; V128-R809 HydrophobicContact CG1-CB 4.05Å; V128-R809 WeakPolarHBondContact CG1-O 3.27Å
129	Q	68.7	Low	74.9	Confident	129 Å²	129	78.9 Å²	78.9	60%	0.603	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-84.2	125.9	164.4	-71.5	-178.2	-20.7	0	0	107.5	K810	Q129-K810 WeakPolarHBondContact O-CG 3.39Å
130	F	70.6	Confident	75.5	Confident	107 Å²	107	78.1 Å²	78.1	47%	0.469	42%	0.424	S	S	.	.			trans	-72	-38.7	-176.9	-61.1	-74.9	0	0	0	112.1	T811 E812	F130-T811 HydrophobicContact CD1-CG2 4.31Å; F130-T811 PolarHBondContact O-N 3.17Å; F130-T811 PolarHBondContact O-OG1 3.18Å; F130-E812 PolarHBondContact O-N 3.42Å
131	V	74.7	Confident	76.1	Confident	44 Å²	44	76.9 Å²	76.9	27%	0.267	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-100.6	134	-169.9	-165.6	0	0	0	0	112.8	K810 E812 Y818	V131-K810 PolarHBondContact O-NZ 2.83Å; V131-E812 HydrophobicContact CG2-CB 4.37Å; V131-Y818 HydrophobicContact CG1-CD2 3.79Å; V131-Y818 HydrophobicContact CG1-CE2 3.74Å; V131-Y818 HydrophobicContact CG1-CG 4.38Å; V131-Y818 HydrophobicContact CG2-CE1 4.45Å
132	D	78.6	Confident	76.9	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.016	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-63.6	135.2	167.7	-82.2	-31.6	0	0	0	110.4	D136 R140 R455 K810 E812 Y814	D132-D136 HydrophobicContact CB-CB 4.31Å; D132-R140 IonicContact OD1-NH2 2.82Å; D132-R140 PolarHBondContact OD1-NH2 3.21Å; D132-R140 IonicContact OD2-NH1 3.45Å; D132-R140 IonicContact OD2-NH2 2.93Å; D132-R140 PolarHBondContact OD2-NH2 3.06Å; D132-R455 IonicContact OD2-CZ 3.86Å; D132-R455 IonicContact OD2-NE 2.74Å; D132-R455 IonicContact OD2-NH2 3.57Å; D132-R455 PolarHBondContact OD2-NH2 3.15Å; D132-K810 WeakPolarHBondContact OD1-CD 3.33Å; D132-E812 PolarHBondContact N-O 2.86Å; D132-Y814 WeakPolarHBondContact O-CA 3.33Å; D132-Y814 VanDerWaalsContact O-CB 3.27Å; D132-Y814 WeakPolarHBondContact O-CB 3.38Å
133	S	79.8	Confident	78.2	Confident	57 Å²	57	76.6 Å²	76.6	40%	0.399	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-80.7	162.1	166.8	-55.4	0	0	0	0	110.9	H135 D136	S133-H135 PolarHBondContact O-N 3.23Å; S133-D136 PolarHBondContact N-OD2 3.25Å; S133-D136 WeakPolarHBondContact O-CB 3.4Å; S133-D136 PolarHBondContact O-N 2.87Å
134	K	78.1	Confident	79.4	Confident	144 Å²	144	70.3 Å²	70.3	63%	0.626	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.9	-39.7	-179.5	-173.2	176.6	-178.6	177.9	0	114.9	Y814	K134-Y814 HydrophobicContact CB-CD2 4.47Å; K134-Y814 HydrophobicContact CB-CE2 4.19Å
135	H	82.3	Confident	80.8	Confident	123 Å²	123	71.5 Å²	71.5	57%	0.569	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-1.2	-176.9	-61.4	100	0	0	0	114.5	S133 C138 K139	S133-H135 PolarHBondContact O-N 3.23Å; H135-C138 PolarHBondContact O-N 3.16Å; H135-K139 WeakPolarHBondContact O-CG 3.44Å; H135-K139 PolarHBondContact O-N 3.29Å
136	D	85	Confident	82.5	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.027	37%	0.366	C	S	.	.	H	α-helix	trans	-67.1	-34.8	-173.4	-74.1	-4.8	0	0	0	114.7	D132 S133 C138 K139 R140 L807 K810	D132-D136 HydrophobicContact CB-CB 4.31Å; S133-D136 PolarHBondContact N-OD2 3.25Å; S133-D136 WeakPolarHBondContact O-CB 3.4Å; S133-D136 PolarHBondContact O-N 2.87Å; D136-C138 VanDerWaalsContact C-N 3.32Å; D136-C138 PolarHBondContact O-N 2.79Å; D136-K139 PolarHBondContact O-N 3.16Å; D136-K139 IonicContact OD1-NZ 2.66Å; D136-K139 PolarHBondContact OD1-NZ 3.2Å; D136-R140 VanDerWaalsContact O-CB 3.31Å; D136-R140 WeakPolarHBondContact O-CB 3.27Å; D136-R140 PolarHBondContact O-N 3.43Å; D136-L807 HydrophobicContact CB-CD2 3.86Å; D136-K810 WeakPolarHBondContact OD2-CE 3.09Å; D136-K810 IonicContact OD2-NZ 3.56Å; D136-K810 PolarHBondContact OD2-NZ 3.37Å
137	P	83.6	Confident	84.2	Confident	65 Å²	65	70.6 Å²	70.6	42%	0.422	36%	0.357	S	S	.	.	H	α-helix	trans	-57.7	-44.8	170.8	-25.9	35.4	0	0	0	112.3	R140 V141	P137-R140 PolarHBondContact O-N 3.33Å; P137-V141 WeakPolarHBondContact O-CG2 3.49Å; P137-V141 PolarHBondContact O-N 2.74Å; P137-V141 VanDerWaalsContact O-N 3.1Å
138	C	88.6	Confident	85.7	Confident	80 Å²	80	63.1 Å²	63.1	54%	0.541	34%	0.335	S	S	.	.	H	α-helix	trans	-64.3	-48.1	176.9	-178.8	0	0	0	0	111.1	H135 D136 R140 V141 V142	H135-C138 PolarHBondContact O-N 3.16Å; D136-C138 VanDerWaalsContact C-N 3.32Å; D136-C138 PolarHBondContact O-N 2.79Å; C138-R140 VanDerWaalsContact C-N 3.27Å; C138-R140 PolarHBondContact O-N 3.48Å; C138-V141 PolarHBondContact O-N 3.44Å; C138-V142 WeakPolarHBondContact O-CG2 3.44Å; C138-V142 PolarHBondContact O-N 2.99Å
139	K	90.1	Very high	87.2	Confident	84 Å²	84	64.8 Å²	64.8	37%	0.365	34%	0.341	S	S	.	.	H	α-helix	trans	-57.5	-40.4	175.8	-69.1	175.4	-170.7	164.4	0	112.3	H135 D136 V142 Y143 L807	H135-K139 WeakPolarHBondContact O-CG 3.44Å; H135-K139 PolarHBondContact O-N 3.29Å; D136-K139 PolarHBondContact O-N 3.16Å; D136-K139 IonicContact OD1-NZ 2.66Å; D136-K139 PolarHBondContact OD1-NZ 3.2Å; K139-V142 PolarHBondContact O-N 3.09Å; K139-Y143 HydrophobicContact CB-CD2 4.44Å; K139-Y143 HydrophobicContact CB-CE2 4.09Å; K139-Y143 WeakPolarHBondContact O-CB 3.19Å; K139-Y143 WeakPolarHBondContact O-CD2 3.23Å; K139-Y143 PolarHBondContact O-N 3.44Å; K139-L807 HydrophobicContact CB-CD1 3.91Å
140	R	90.2	Very high	88.6	Confident	25 Å²	25	59.7 Å²	59.7	9%	0.094	32%	0.318	C	S	.	.	H	α-helix	trans	-61.6	-47.2	178.6	-172.4	-175.8	-69.1	132.8	1	110.3	D132 D136 P137 C138 T144 R465 L804 L807 Y808	D132-R140 IonicContact OD1-NH2 2.82Å; D132-R140 PolarHBondContact OD1-NH2 3.21Å; D132-R140 IonicContact OD2-NH1 3.45Å; D132-R140 IonicContact OD2-NH2 2.93Å; D132-R140 PolarHBondContact OD2-NH2 3.06Å; D136-R140 VanDerWaalsContact O-CB 3.31Å; D136-R140 WeakPolarHBondContact O-CB 3.27Å; D136-R140 PolarHBondContact O-N 3.43Å; P137-R140 PolarHBondContact O-N 3.33Å; C138-R140 VanDerWaalsContact C-N 3.27Å; C138-R140 PolarHBondContact O-N 3.48Å; R140-T144 VanDerWaalsContact O-CB 3.25Å; R140-T144 WeakPolarHBondContact O-CB 3.07Å; R140-T144 PolarHBondContact O-N 3.17Å; R140-T144 PolarHBondContact O-OG1 2.68Å; R140-R465 VanDerWaalsContact NH1-NH1 3.14Å; R140-L804 HydrophobicContact CG-CD1 3.93Å; R140-L807 HydrophobicContact CB-CD1 4.09Å; R140-L807 PolarHBondContact NH2-O 3.47Å; R140-Y808 HydrophobicContact CG-CD1 4.13Å; R140-Y808 HydrophobicContact CG-CE1 3.67Å
141	V	91.1	Very high	89.8	Confident	86 Å²	86	54.6 Å²	54.6	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-51	176.4	174	0	0	0	0	110.7	P137 C138 Y143 T144 I145	P137-V141 WeakPolarHBondContact O-CG2 3.49Å; P137-V141 PolarHBondContact O-N 2.74Å; P137-V141 VanDerWaalsContact O-N 3.1Å; C138-V141 PolarHBondContact O-N 3.44Å; V141-Y143 PolarHBondContact O-N 2.85Å; V141-T144 WeakPolarHBondContact O-CB 3.41Å; V141-T144 PolarHBondContact O-N 3.39Å; V141-I145 HydrophobicContact CG1-CD1 3.73Å; V141-I145 HydrophobicContact CG1-CG1 4.44Å; V141-I145 WeakPolarHBondContact O-CG1 3.08Å; V141-I145 PolarHBondContact O-N 3.47Å
142	V	95.1	Very high	90.9	Very high	67 Å²	67	55.1 Å²	55.1	41%	0.406	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-49.4	-178.7	173.8	0	0	0	0	111.5	C138 K139 T144 I145 C146	C138-V142 WeakPolarHBondContact O-CG2 3.44Å; C138-V142 PolarHBondContact O-N 2.99Å; K139-V142 PolarHBondContact O-N 3.09Å; V142-T144 VanDerWaalsContact C-N 3.31Å; V142-T144 PolarHBondContact O-N 3.09Å; V142-I145 PolarHBondContact O-N 3.01Å; V142-C146 PolarHBondContact O-N 3.48Å; V142-C146 PolarHBondContact O-SG 2.93Å
143	Y	94.6	Very high	91.8	Very high	47 Å²	47	61.4 Å²	61.4	18%	0.184	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-33	179.9	-62.5	-16.1	0	0	0	112.6	K139 V141 L147 F800 K803 L807	K139-Y143 HydrophobicContact CB-CD2 4.44Å; K139-Y143 HydrophobicContact CB-CE2 4.09Å; K139-Y143 WeakPolarHBondContact O-CB 3.19Å; K139-Y143 WeakPolarHBondContact O-CD2 3.23Å; K139-Y143 PolarHBondContact O-N 3.44Å; V141-Y143 PolarHBondContact O-N 2.85Å; Y143-L147 VanDerWaalsContact O-CB 3.26Å; Y143-L147 WeakPolarHBondContact O-CB 3.38Å; Y143-L147 PolarHBondContact O-N 2.83Å; Y143-F800 AromaticContact CD1-CD1 3.65Å; Y143-F800 HydrophobicContact CD1-CD1 3.65Å; Y143-F800 AromaticContact CD1-CE1 3.7Å; Y143-F800 HydrophobicContact CD1-CE1 3.7Å; Y143-F800 HydrophobicContact CE1-CD1 4.34Å; Y143-F800 HydrophobicContact CE1-CE1 4.11Å; Y143-F800 HydrophobicContact CG-CD1 4.04Å; Y143-K803 HydrophobicContact CD2-CB 3.84Å; Y143-K803 HydrophobicContact CE2-CB 3.78Å; Y143-K803 HydrophobicContact CE2-CD 3.97Å; Y143-K803 HydrophobicContact CE2-CG 4.43Å; Y143-L807 HydrophobicContact CD2-CD1 3.68Å; Y143-L807 HydrophobicContact CE2-CD1 4.04Å
144	T	94.9	Very high	92.6	Very high	17 Å²	17	58.7 Å²	58.7	10%	0.104	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-50.6	172.3	-59	0	0	0	0	110.2	R140 V141 V142 C146 L147 V148 L447 T451 Y808	R140-T144 VanDerWaalsContact O-CB 3.25Å; R140-T144 WeakPolarHBondContact O-CB 3.07Å; R140-T144 PolarHBondContact O-N 3.17Å; R140-T144 PolarHBondContact O-OG1 2.68Å; V141-T144 WeakPolarHBondContact O-CB 3.41Å; V141-T144 PolarHBondContact O-N 3.39Å; V142-T144 VanDerWaalsContact C-N 3.31Å; V142-T144 PolarHBondContact O-N 3.09Å; T144-C146 PolarHBondContact O-N 3.47Å; T144-L147 PolarHBondContact O-N 2.82Å; T144-V148 HydrophobicContact CG2-CG2 4.33Å; T144-V148 WeakPolarHBondContact O-CB 3.26Å; T144-V148 VanDerWaalsContact O-CG2 3.27Å; T144-V148 WeakPolarHBondContact O-CG2 3.42Å; T144-V148 PolarHBondContact O-N 2.81Å; T144-L447 HydrophobicContact CG2-CD2 3.93Å; T144-T451 HydrophobicContact CG2-CG2 3.43Å; T144-T451 VanDerWaalsContact CG2-CG2 3.43Å; T144-Y808 PolarHBondContact OG1-OH 3.01Å
145	I	96	Very high	93.4	Very high	94 Å²	94	54.8 Å²	54.8	48%	0.482	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-48	179.5	-67.2	168.5	0	0	0	110.4	V141 V142 L147 V148 L149	V141-I145 HydrophobicContact CG1-CD1 3.73Å; V141-I145 HydrophobicContact CG1-CG1 4.44Å; V141-I145 WeakPolarHBondContact O-CG1 3.08Å; V141-I145 PolarHBondContact O-N 3.47Å; V142-I145 PolarHBondContact O-N 3.01Å; I145-L147 VanDerWaalsContact C-N 3.34Å; I145-L147 PolarHBondContact O-N 3.32Å; I145-V148 PolarHBondContact O-N 2.93Å; I145-L149 HydrophobicContact CG2-CD1 4.03Å; I145-L149 HydrophobicContact CG2-CG 4.47Å; I145-L149 WeakPolarHBondContact O-CG 3.18Å; I145-L149 PolarHBondContact O-N 2.93Å
146	C	97.4	Very high	94.1	Very high	40 Å²	40	51.4 Å²	51.4	27%	0.27	29%	0.286	S	S	.	.	H	α-helix	trans	-58.7	-45.3	177.6	-67.8	0	0	0	0	111.9	V142 T144 L149 I150 F800	V142-C146 PolarHBondContact O-N 3.48Å; V142-C146 PolarHBondContact O-SG 2.93Å; T144-C146 PolarHBondContact O-N 3.47Å; C146-L149 PolarHBondContact O-N 3.32Å; C146-I150 WeakPolarHBondContact O-CD1 3.41Å; C146-I150 VanDerWaalsContact O-CG1 3.22Å; C146-I150 WeakPolarHBondContact O-CG1 3.03Å; C146-I150 PolarHBondContact O-N 3.43Å; C146-F800 HydrophobicContact CB-CD1 4.05Å; C146-F800 HydrophobicContact CB-CD2 4.09Å; C146-F800 HydrophobicContact CB-CE1 3.91Å; C146-F800 HydrophobicContact CB-CE2 3.96Å; C146-F800 HydrophobicContact CB-CG 4.15Å; C146-F800 HydrophobicContact CB-CZ 3.86Å
147	L	96.9	Very high	94.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.1	-41.7	-179.4	-173.6	61	0	0	0	111.9	Y143 T144 I145 L149 I150 V151 L447 L472 A797 F800 A801 L804	Y143-L147 VanDerWaalsContact O-CB 3.26Å; Y143-L147 WeakPolarHBondContact O-CB 3.38Å; Y143-L147 PolarHBondContact O-N 2.83Å; T144-L147 PolarHBondContact O-N 2.82Å; I145-L147 VanDerWaalsContact C-N 3.34Å; I145-L147 PolarHBondContact O-N 3.32Å; L147-L149 VanDerWaalsContact C-N 3.34Å; L147-L149 PolarHBondContact O-N 3.02Å; L147-I150 PolarHBondContact O-N 3.21Å; L147-V151 HydrophobicContact CD1-CG2 3.95Å; L147-V151 HydrophobicContact CG-CG2 4.22Å; L147-V151 WeakPolarHBondContact O-CB 3.35Å; L147-V151 VanDerWaalsContact O-CG2 3.26Å; L147-V151 WeakPolarHBondContact O-CG2 3.3Å; L147-V151 PolarHBondContact O-N 3.01Å; L147-L447 HydrophobicContact CB-CD2 4.4Å; L147-L447 HydrophobicContact CD2-CD1 4.49Å; L147-L447 HydrophobicContact CD2-CD2 3.99Å; L147-L447 HydrophobicContact CD2-CG 4.29Å; L147-L447 HydrophobicContact CG-CD1 4.36Å; L147-L447 HydrophobicContact CG-CD2 4.37Å; L147-L472 HydrophobicContact CD2-CD2 3.79Å; L147-A797 HydrophobicContact CD1-CB 4.19Å; L147-F800 HydrophobicContact CB-CB 4.19Å; L147-F800 HydrophobicContact CD1-CB 4.3Å; L147-A801 HydrophobicContact CD1-CB 4.35Å; L147-A801 HydrophobicContact CD2-CB 4.03Å; L147-L804 HydrophobicContact CD2-CD2 4Å
148	V	97.3	Very high	95.2	Very high	53 Å²	53	48.7 Å²	48.7	32%	0.321	27%	0.27	S	S	.	.	H	α-helix	trans	-56.6	-50.4	173.9	168.7	0	0	0	0	109.9	T144 I145 I150 V151 T152 L447	T144-V148 HydrophobicContact CG2-CG2 4.33Å; T144-V148 WeakPolarHBondContact O-CB 3.26Å; T144-V148 VanDerWaalsContact O-CG2 3.27Å; T144-V148 WeakPolarHBondContact O-CG2 3.42Å; T144-V148 PolarHBondContact O-N 2.81Å; I145-V148 PolarHBondContact O-N 2.93Å; V148-I150 PolarHBondContact O-N 2.95Å; V148-V151 PolarHBondContact O-N 2.95Å; V148-T152 HydrophobicContact CG1-CG2 4.29Å; V148-T152 WeakPolarHBondContact O-CB 3.25Å; V148-T152 VanDerWaalsContact O-CG2 3.26Å; V148-T152 WeakPolarHBondContact O-CG2 3.31Å; V148-T152 PolarHBondContact O-N 3.29Å; V148-T152 PolarHBondContact O-OG1 3Å; V148-T152 VanDerWaalsContact O-OG1 3.08Å; V148-L447 HydrophobicContact CG2-CD1 3.8Å; V148-L447 HydrophobicContact CG2-CD2 4.08Å; V148-L447 HydrophobicContact CG2-CG 4.49Å
149	L	97.8	Very high	95.5	Very high	90 Å²	90	48.2 Å²	48.2	47%	0.471	26%	0.264	S	S	.	.	H	α-helix	trans	-58.8	-49.8	179.1	-70.5	174.2	0	0	0	111.5	I145 C146 L147 V151 T152 F153	I145-L149 HydrophobicContact CG2-CD1 4.03Å; I145-L149 HydrophobicContact CG2-CG 4.47Å; I145-L149 WeakPolarHBondContact O-CG 3.18Å; I145-L149 PolarHBondContact O-N 2.93Å; C146-L149 PolarHBondContact O-N 3.32Å; L147-L149 VanDerWaalsContact C-N 3.34Å; L147-L149 PolarHBondContact O-N 3.02Å; L149-V151 PolarHBondContact O-N 3.16Å; L149-T152 WeakPolarHBondContact CA-OG1 3.42Å; L149-T152 PolarHBondContact O-N 3.39Å; L149-T152 PolarHBondContact O-OG1 3.2Å; L149-F153 WeakPolarHBondContact O-CD2 3.42Å; L149-F153 PolarHBondContact O-N 3.22Å
150	I	97.7	Very high	95.8	Very high	22 Å²	22	46.1 Å²	46.1	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-49.2	179.9	-67.5	161.1	0	0	0	111.1	C146 L147 V148 T152 F153 Q154 L793 P796 A797 F800	C146-I150 WeakPolarHBondContact O-CD1 3.41Å; C146-I150 VanDerWaalsContact O-CG1 3.22Å; C146-I150 WeakPolarHBondContact O-CG1 3.03Å; C146-I150 PolarHBondContact O-N 3.43Å; L147-I150 PolarHBondContact O-N 3.21Å; V148-I150 PolarHBondContact O-N 2.95Å; I150-T152 VanDerWaalsContact C-N 3.32Å; I150-T152 PolarHBondContact O-N 3.45Å; I150-F153 PolarHBondContact O-N 2.95Å; I150-Q154 HydrophobicContact CG2-CG 4.42Å; I150-Q154 VanDerWaalsContact O-CG 3.29Å; I150-Q154 WeakPolarHBondContact O-CG 3.49Å; I150-Q154 PolarHBondContact O-N 3.35Å; I150-L793 HydrophobicContact CG2-CB 4.12Å; I150-P796 HydrophobicContact CD1-CB 3.92Å; I150-P796 HydrophobicContact CD1-CG 4.38Å; I150-A797 HydrophobicContact CG2-CB 3.84Å; I150-F800 HydrophobicContact CD1-CD2 3.52Å; I150-F800 HydrophobicContact CD1-CE2 3.8Å
151	V	96.9	Very high	96.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-35.9	-179.2	178.6	0	0	0	0	111.1	L147 V148 L149 Q154 L155 F440 L443 Y444	L147-V151 HydrophobicContact CD1-CG2 3.95Å; L147-V151 HydrophobicContact CG-CG2 4.22Å; L147-V151 WeakPolarHBondContact O-CB 3.35Å; L147-V151 VanDerWaalsContact O-CG2 3.26Å; L147-V151 WeakPolarHBondContact O-CG2 3.3Å; L147-V151 PolarHBondContact O-N 3.01Å; V148-V151 PolarHBondContact O-N 2.95Å; L149-V151 PolarHBondContact O-N 3.16Å; V151-Q154 PolarHBondContact O-N 2.84Å; V151-L155 WeakPolarHBondContact O-CB 3.47Å; V151-L155 PolarHBondContact O-N 3.34Å; V151-F440 HydrophobicContact CG1-CB 4.07Å; V151-F440 HydrophobicContact CG1-CD1 4.14Å; V151-F440 HydrophobicContact CG1-CG 4.26Å; V151-L443 HydrophobicContact CG2-CB 4.27Å; V151-L443 HydrophobicContact CG2-CD1 3.77Å; V151-Y444 HydrophobicContact CG1-CD2 4.09Å; V151-Y444 HydrophobicContact CG1-CE1 4.17Å; V151-Y444 HydrophobicContact CG1-CE2 3.53Å
152	T	96.7	Very high	96.3	Very high	56 Å²	56	44.7 Å²	44.7	34%	0.344	25%	0.245	S	C	.	.	H	α-helix	trans	-64.4	-41.9	173.9	54.3	0	0	0	0	112.6	V148 L149 I150 Q154 L155 A156 Y444	V148-T152 HydrophobicContact CG1-CG2 4.29Å; V148-T152 WeakPolarHBondContact O-CB 3.25Å; V148-T152 VanDerWaalsContact O-CG2 3.26Å; V148-T152 WeakPolarHBondContact O-CG2 3.31Å; V148-T152 PolarHBondContact O-N 3.29Å; V148-T152 PolarHBondContact O-OG1 3Å; V148-T152 VanDerWaalsContact O-OG1 3.08Å; L149-T152 WeakPolarHBondContact CA-OG1 3.42Å; L149-T152 PolarHBondContact O-N 3.39Å; L149-T152 PolarHBondContact O-OG1 3.2Å; I150-T152 VanDerWaalsContact C-N 3.32Å; I150-T152 PolarHBondContact O-N 3.45Å; T152-Q154 VanDerWaalsContact C-N 3.34Å; T152-L155 PolarHBondContact O-N 3.43Å; T152-A156 PolarHBondContact O-N 2.86Å; T152-Y444 WeakPolarHBondContact CA-OH 3.3Å; T152-Y444 WeakPolarHBondContact CG2-OH 3.48Å; T152-Y444 PolarHBondContact N-OH 2.88Å
153	F	97	Very high	96.3	Very high	134 Å²	134	43.2 Å²	43.2	59%	0.588	23%	0.234	S	C	*	.	H	α-helix	trans	-65.4	-39	175.1	-77.9	-64.1	0	0	0	111.9	L149 I150 A156 A157 L793	L149-F153 WeakPolarHBondContact O-CD2 3.42Å; L149-F153 PolarHBondContact O-N 3.22Å; I150-F153 PolarHBondContact O-N 2.95Å; F153-A156 PolarHBondContact O-N 2.62Å; F153-A157 WeakPolarHBondContact O-CB 3.45Å; F153-A157 PolarHBondContact O-N 2.96Å; F153-L793 HydrophobicContact CB-CD1 3.99Å
154	Q	96.4	Very high	96.4	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-42.5	174.5	-71	178	-56.7	0	0	112.1	I150 V151 T152 A156 A157 V158 F440 T790 L793	I150-Q154 HydrophobicContact CG2-CG 4.42Å; I150-Q154 VanDerWaalsContact O-CG 3.29Å; I150-Q154 WeakPolarHBondContact O-CG 3.49Å; I150-Q154 PolarHBondContact O-N 3.35Å; V151-Q154 PolarHBondContact O-N 2.84Å; T152-Q154 VanDerWaalsContact C-N 3.34Å; Q154-A156 VanDerWaalsContact C-N 3.34Å; Q154-A156 PolarHBondContact O-N 3.3Å; Q154-A157 PolarHBondContact O-N 3.1Å; Q154-V158 WeakPolarHBondContact O-CG2 3.47Å; Q154-V158 PolarHBondContact O-N 3.49Å; Q154-F440 HydrophobicContact CB-CD1 4.5Å; Q154-F440 HydrophobicContact CB-CE1 3.68Å; Q154-F440 HydrophobicContact CB-CE2 4.21Å; Q154-F440 HydrophobicContact CB-CZ 3.52Å; Q154-F440 HydrophobicContact CG-CE1 4.43Å; Q154-T790 HydrophobicContact CB-CG2 4.46Å; Q154-T790 PolarHBondContact NE2-O 2.92Å; Q154-T790 PolarHBondContact O-OG1 2.96Å; Q154-L793 HydrophobicContact CG-CB 3.46Å; Q154-L793 VanDerWaalsContact CG-CB 3.46Å; Q154-L793 HydrophobicContact CG-CD1 3.72Å; Q154-L793 HydrophobicContact CG-CG 4.25Å; Q154-L793 VanDerWaalsContact NE2-CB 3.33Å; Q154-L793 PolarHBondContact NE2-O 3.18Å
155	L	96.5	Very high	96.4	Very high	63 Å²	63	40.6 Å²	40.6	33%	0.33	22%	0.222	S	C	.	.	H	α-helix	trans	-59.7	-47	175.8	-179.7	64.1	0	0	0	110.6	V151 T152 A157 V158 V159 F440 Y444	V151-L155 WeakPolarHBondContact O-CB 3.47Å; V151-L155 PolarHBondContact O-N 3.34Å; T152-L155 PolarHBondContact O-N 3.43Å; L155-A157 VanDerWaalsContact C-N 3.35Å; L155-A157 PolarHBondContact O-N 3.02Å; L155-V158 PolarHBondContact O-N 3.22Å; L155-V159 HydrophobicContact CD1-CG2 4.34Å; L155-V159 HydrophobicContact CG-CG2 4.49Å; L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.47Å; L155-V159 PolarHBondContact O-N 3.04Å; L155-F440 HydrophobicContact CB-CD2 4.32Å; L155-F440 HydrophobicContact CD1-CD2 4.05Å; L155-Y444 HydrophobicContact CD2-CE2 4.3Å
156	A	96	Very high	96.3	Very high	51 Å²	51	39.6 Å²	39.6	42%	0.421	22%	0.215	S	C	.	.	H	α-helix	trans	-59.2	-44.2	176.2	0	0	0	0	0	112.2	T152 F153 Q154 V159 L160	T152-A156 PolarHBondContact O-N 2.86Å; F153-A156 PolarHBondContact O-N 2.62Å; Q154-A156 VanDerWaalsContact C-N 3.34Å; Q154-A156 PolarHBondContact O-N 3.3Å; A156-V159 PolarHBondContact O-N 2.8Å; A156-L160 WeakPolarHBondContact O-CG 3.39Å; A156-L160 PolarHBondContact O-N 2.88Å
157	A	96.1	Very high	96.2	Very high	13 Å²	13	37.8 Å²	37.8	11%	0.107	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-39.8	178.1	0	0	0	0	0	113	F153 Q154 L155 L160 A161 F789 T790	F153-A157 WeakPolarHBondContact O-CB 3.45Å; F153-A157 PolarHBondContact O-N 2.96Å; Q154-A157 PolarHBondContact O-N 3.1Å; L155-A157 VanDerWaalsContact C-N 3.35Å; L155-A157 PolarHBondContact O-N 3.02Å; A157-L160 PolarHBondContact O-N 2.8Å; A157-A161 PolarHBondContact O-N 2.98Å; A157-F789 HydrophobicContact CB-CB 4.19Å; A157-T790 WeakPolarHBondContact CB-OG1 3.34Å
158	V	96.1	Very high	96.1	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-70	-37.9	174.7	174.3	0	0	0	0	112.1	Q154 L155 L160 A161 F162 L433 P436 I437 F440 T790	Q154-V158 WeakPolarHBondContact O-CG2 3.47Å; Q154-V158 PolarHBondContact O-N 3.49Å; L155-V158 PolarHBondContact O-N 3.22Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 2.89Å; V158-A161 WeakPolarHBondContact O-CB 3.42Å; V158-A161 PolarHBondContact O-N 2.89Å; V158-A161 VanDerWaalsContact O-N 3.16Å; V158-F162 WeakPolarHBondContact O-CB 3.27Å; V158-F162 PolarHBondContact O-N 3.45Å; V158-L433 HydrophobicContact CG1-CD2 4.25Å; V158-P436 HydrophobicContact CG1-CG 4.12Å; V158-P436 HydrophobicContact CG2-CB 4.01Å; V158-P436 HydrophobicContact CG2-CG 4Å; V158-I437 HydrophobicContact CG1-CD1 4.36Å; V158-I437 HydrophobicContact CG1-CG1 3.97Å; V158-F440 HydrophobicContact CB-CE2 4.05Å; V158-F440 HydrophobicContact CG2-CE2 3.57Å; V158-F440 HydrophobicContact CG2-CZ 3.86Å; V158-T790 HydrophobicContact CG2-CG2 3.66Å; V158-T790 WeakPolarHBondContact CG2-OG1 3.46Å
159	V	95.6	Very high	95.9	Very high	70 Å²	70	37.3 Å²	37.3	42%	0.424	20%	0.197	S	C	.	.	H	α-helix	trans	-60.8	-43	174.5	169.1	0	0	0	0	110.3	L155 A156 A161 F162 I163	L155-V159 HydrophobicContact CD1-CG2 4.34Å; L155-V159 HydrophobicContact CG-CG2 4.49Å; L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.47Å; L155-V159 PolarHBondContact O-N 3.04Å; A156-V159 PolarHBondContact O-N 2.8Å; V159-A161 PolarHBondContact O-N 3.39Å; V159-F162 WeakPolarHBondContact O-CB 3.13Å; V159-F162 PolarHBondContact O-N 3.32Å; V159-I163 HydrophobicContact CG1-CD1 3.91Å; V159-I163 WeakPolarHBondContact O-CG1 3.33Å; V159-I163 PolarHBondContact O-N 3.37Å
160	L	95.6	Very high	95.7	Very high	39 Å²	39	35.2 Å²	35.2	20%	0.204	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-40.9	173.2	-68.7	171.4	0	0	0	112.1	V41 F43 A156 A157 V158 F162 I163 N164	V41-L160 HydrophobicContact CB-CD2 4.47Å; V41-L160 HydrophobicContact CG1-CD2 3.92Å; F43-L160 HydrophobicContact CE1-CD2 4.11Å; F43-L160 HydrophobicContact CE2-CD1 3.82Å; F43-L160 HydrophobicContact CE2-CD2 4.48Å; F43-L160 HydrophobicContact CZ-CD1 3.67Å; F43-L160 HydrophobicContact CZ-CD2 3.6Å; F43-L160 HydrophobicContact CZ-CG 4.28Å; A156-L160 WeakPolarHBondContact O-CG 3.39Å; A156-L160 PolarHBondContact O-N 2.88Å; A157-L160 PolarHBondContact O-N 2.8Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 2.89Å; L160-F162 VanDerWaalsContact C-N 3.29Å; L160-F162 PolarHBondContact O-N 2.89Å; L160-I163 PolarHBondContact O-N 3.12Å; L160-N164 VanDerWaalsContact O-CB 3.32Å; L160-N164 WeakPolarHBondContact O-CB 3.31Å; L160-N164 PolarHBondContact O-N 2.99Å; L160-N164 PolarHBondContact O-ND2 3.36Å
161	A	96.2	Very high	95.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-39.3	174.4	0	0	0	0	0	111.7	A157 V158 V159 N164 H165 L433 F783	A157-A161 PolarHBondContact O-N 2.98Å; V158-A161 WeakPolarHBondContact O-CB 3.42Å; V158-A161 PolarHBondContact O-N 2.89Å; V158-A161 VanDerWaalsContact O-N 3.16Å; V159-A161 PolarHBondContact O-N 3.39Å; A161-N164 PolarHBondContact O-N 3.48Å; A161-H165 VanDerWaalsContact O-CB 3.31Å; A161-H165 WeakPolarHBondContact O-CB 3.19Å; A161-H165 PolarHBondContact O-N 3.32Å; A161-L433 HydrophobicContact CB-CD2 3.8Å; A161-F783 HydrophobicContact CB-CD2 4.28Å
162	F	95.6	Very high	95.1	Very high	82 Å²	82	35.1 Å²	35.1	36%	0.36	18%	0.184	S	C	.	.	H	α-helix	trans	-65.8	-47.3	177.6	-165.7	-81.2	0	0	0	112.4	V158 V159 L160 N164 H165 H166 V430 L433	V158-F162 WeakPolarHBondContact O-CB 3.27Å; V158-F162 PolarHBondContact O-N 3.45Å; V159-F162 WeakPolarHBondContact O-CB 3.13Å; V159-F162 PolarHBondContact O-N 3.32Å; L160-F162 VanDerWaalsContact C-N 3.29Å; L160-F162 PolarHBondContact O-N 2.89Å; F162-N164 VanDerWaalsContact C-N 3.34Å; F162-N164 PolarHBondContact O-N 2.84Å; F162-H165 PolarHBondContact O-N 2.97Å; F162-H166 PolarHBondContact O-N 3.27Å; F162-V430 HydrophobicContact CE2-CG1 4.3Å; F162-V430 HydrophobicContact CE2-CG2 4.25Å; F162-V430 HydrophobicContact CZ-CG2 4.41Å; F162-L433 HydrophobicContact CB-CD1 4.01Å; F162-L433 HydrophobicContact CD2-CB 4.17Å; F162-L433 HydrophobicContact CD2-CD1 3.86Å; F162-L433 HydrophobicContact CG-CD1 4.29Å
163	I	95.7	Very high	94.6	Very high	35 Å²	35	35 Å²	35	18%	0.179	18%	0.184	C	C	.	.	H	α-helix	trans	-61.2	-45.5	176.5	-65.7	165.2	0	0	0	110.2	L37 V41 V159 L160 H165 H166 L167	L37-I163 HydrophobicContact CD1-CD1 4.44Å; L37-I163 HydrophobicContact CD1-CG1 4.46Å; L37-I163 HydrophobicContact CD1-CG2 3.68Å; L37-I163 HydrophobicContact CD2-CG2 3.98Å; L37-I163 HydrophobicContact CG-CG2 3.68Å; V41-I163 HydrophobicContact CG1-CB 4.23Å; V41-I163 HydrophobicContact CG1-CD1 4.16Å; V41-I163 HydrophobicContact CG1-CG2 3.6Å; V41-I163 HydrophobicContact CG2-CG2 4.23Å; V159-I163 HydrophobicContact CG1-CD1 3.91Å; V159-I163 WeakPolarHBondContact O-CG1 3.33Å; V159-I163 PolarHBondContact O-N 3.37Å; L160-I163 PolarHBondContact O-N 3.12Å; I163-H165 VanDerWaalsContact C-N 3.34Å; I163-H165 PolarHBondContact O-N 3.45Å; I163-H166 WeakPolarHBondContact O-CB 3.36Å; I163-H166 PolarHBondContact O-N 2.99Å; I163-L167 HydrophobicContact CG2-CD1 3.92Å; I163-L167 HydrophobicContact CG2-CG 4.3Å; I163-L167 WeakPolarHBondContact O-CG 3.42Å; I163-L167 PolarHBondContact O-N 2.78Å
164	N	95.9	Very high	94.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68	-32.2	179.6	-76	-59	0	0	0	113	S44 Y45 L160 A161 F162 L167 F168 P779 A782 F783	S44-N164 PolarHBondContact OG-ND2 3.26Å; S44-N164 VanDerWaalsContact OG-ND2 3.07Å; Y45-N164 WeakPolarHBondContact CE1-OD1 3.28Å; L160-N164 VanDerWaalsContact O-CB 3.32Å; L160-N164 WeakPolarHBondContact O-CB 3.31Å; L160-N164 PolarHBondContact O-N 2.99Å; L160-N164 PolarHBondContact O-ND2 3.36Å; A161-N164 PolarHBondContact O-N 3.48Å; F162-N164 VanDerWaalsContact C-N 3.34Å; F162-N164 PolarHBondContact O-N 2.84Å; N164-L167 PolarHBondContact O-N 2.79Å; N164-F168 VanDerWaalsContact O-CB 3.3Å; N164-F168 WeakPolarHBondContact O-CB 3.33Å; N164-F168 PolarHBondContact O-N 3.35Å; N164-P779 WeakPolarHBondContact O-CB 3.5Å; N164-A782 HydrophobicContact CB-CB 4.04Å; N164-A782 VanDerWaalsContact CG-CB 3.45Å; N164-A782 WeakPolarHBondContact ND2-CB 3.43Å; N164-F783 HydrophobicContact CB-CB 4.44Å
165	H	95	Very high	93.6	Very high	9 Å²	9	39.9 Å²	39.9	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-65.7	-41.4	171.4	-174.1	59.8	0	0	0	111.8	A161 F162 I163 F168 H169 V425 L426 G429 L433 F783	A161-H165 VanDerWaalsContact O-CB 3.31Å; A161-H165 WeakPolarHBondContact O-CB 3.19Å; A161-H165 PolarHBondContact O-N 3.32Å; F162-H165 PolarHBondContact O-N 2.97Å; I163-H165 VanDerWaalsContact C-N 3.34Å; I163-H165 PolarHBondContact O-N 3.45Å; H165-F168 PolarHBondContact O-N 2.94Å; H165-H169 PolarHBondContact O-N 2.92Å; H165-V425 PolarHBondContact CE1-O 2.83Å; H165-L426 WeakPolarHBondContact NE2-CA 3.38Å; H165-L426 PolarHBondContact NE2-O 3.09Å; H165-G429 WeakPolarHBondContact NE2-CA 3.01Å; H165-L433 HydrophobicContact CB-CD1 4.18Å; H165-F783 HydrophobicContact CB-CD2 3.82Å; H165-F783 HydrophobicContact CB-CE2 4.29Å
166	H	94.5	Very high	93.2	Very high	73 Å²	73	38.3 Å²	38.3	34%	0.338	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-47.3	172.9	-178.8	-73.9	0	0	0	111.7	F162 I163 F168 H169 E170	F162-H166 PolarHBondContact O-N 3.27Å; I163-H166 WeakPolarHBondContact O-CB 3.36Å; I163-H166 PolarHBondContact O-N 2.99Å; H166-F168 VanDerWaalsContact C-N 3.26Å; H166-F168 PolarHBondContact O-N 3.48Å; H166-H169 WeakPolarHBondContact O-CB 3.28Å; H166-H169 PolarHBondContact O-N 3.3Å; H166-H169 VanDerWaalsContact O-N 3.15Å; H166-E170 IonicContact CE1-OE1 3.39Å; H166-E170 PolarHBondContact O-N 3.32Å
167	L	95.4	Very high	92.9	Very high	3 Å²	3	38 Å²	38	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-33	177.1	-69.8	172.5	0	0	0	112.6	T34 L37 R38 V41 I163 N164 A171 P779	T34-L167 HydrophobicContact CG2-CD2 3.97Å; L37-L167 HydrophobicContact CB-CD2 4.43Å; L37-L167 HydrophobicContact CD2-CD2 4.24Å; L37-L167 HydrophobicContact CG-CD2 4.3Å; R38-L167 HydrophobicContact CB-CD1 4.2Å; R38-L167 HydrophobicContact CB-CD2 4.09Å; V41-L167 HydrophobicContact CG2-CD1 3.46Å; V41-L167 VanDerWaalsContact CG2-CD1 3.46Å; I163-L167 HydrophobicContact CG2-CD1 3.92Å; I163-L167 HydrophobicContact CG2-CG 4.3Å; I163-L167 WeakPolarHBondContact O-CG 3.42Å; I163-L167 PolarHBondContact O-N 2.78Å; N164-L167 PolarHBondContact O-N 2.79Å; L167-A171 WeakPolarHBondContact O-CB 3.22Å; L167-A171 PolarHBondContact O-N 3.03Å; L167-P779 HydrophobicContact CB-CB 4.05Å
168	F	95	Very high	92.7	Very high	18 Å²	18	43.5 Å²	43.5	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-44.8	172.6	176.1	-114.5	0	0	0	111	N164 H165 H166 A171 L172 V425 F776 P779 F780	N164-F168 VanDerWaalsContact O-CB 3.3Å; N164-F168 WeakPolarHBondContact O-CB 3.33Å; N164-F168 PolarHBondContact O-N 3.35Å; H165-F168 PolarHBondContact O-N 2.94Å; H166-F168 VanDerWaalsContact C-N 3.26Å; H166-F168 PolarHBondContact O-N 3.48Å; F168-A171 WeakPolarHBondContact O-CB 3.22Å; F168-A171 PolarHBondContact O-N 3.13Å; F168-L172 HydrophobicContact CD1-CD1 4.22Å; F168-L172 HydrophobicContact CE1-CD1 3.65Å; F168-L172 HydrophobicContact CE2-CD1 4.22Å; F168-L172 HydrophobicContact CE2-CD2 4.28Å; F168-L172 HydrophobicContact CE2-CG 4.31Å; F168-L172 HydrophobicContact CZ-CD1 3.65Å; F168-L172 HydrophobicContact CZ-CD2 4.31Å; F168-L172 HydrophobicContact CZ-CG 4.23Å; F168-L172 WeakPolarHBondContact O-CG 3.44Å; F168-L172 PolarHBondContact O-N 3.41Å; F168-V425 HydrophobicContact CE1-CG1 4.4Å; F168-F776 AromaticContact CE2-CD2 3.77Å; F168-F776 HydrophobicContact CE2-CD2 3.77Å; F168-F776 AromaticContact CE2-CE2 3.57Å; F168-F776 HydrophobicContact CE2-CE2 3.57Å; F168-F776 HydrophobicContact CE2-CG 4.36Å; F168-F776 AromaticContact CE2-CZ 3.97Å; F168-F776 HydrophobicContact CE2-CZ 3.97Å; F168-F776 AromaticContact CZ-CE2 3.94Å; F168-F776 HydrophobicContact CZ-CE2 3.94Å; F168-F776 HydrophobicContact CZ-CZ 4.26Å; F168-P779 HydrophobicContact CB-CB 4.04Å; F168-P779 HydrophobicContact CB-CG 4.31Å; F168-F780 HydrophobicContact CD1-CD2 4.38Å; F168-F780 HydrophobicContact CD2-CB 3.82Å; F168-F780 HydrophobicContact CD2-CD2 4.13Å; F168-F780 HydrophobicContact CD2-CG 4.47Å; F168-F780 AromaticContact CE1-CD2 3.93Å; F168-F780 HydrophobicContact CE1-CD2 3.93Å; F168-F780 HydrophobicContact CE1-CE2 4.44Å; F168-F780 HydrophobicContact CE2-CB 3.89Å; F168-F780 AromaticContact CE2-CD2 3.65Å; F168-F780 HydrophobicContact CE2-CD2 3.65Å; F168-F780 HydrophobicContact CE2-CG 4.16Å; F168-F780 HydrophobicContact CG-CD2 4.46Å; F168-F780 AromaticContact CZ-CD2 3.54Å; F168-F780 HydrophobicContact CZ-CD2 3.54Å; F168-F780 HydrophobicContact CZ-CE2 4.12Å; F168-F780 HydrophobicContact CZ-CG 4.47Å
169	H	93	Very high	92.4	Very high	24 Å²	24	43.7 Å²	43.7	11%	0.111	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-48.5	173.9	174.6	-91.7	0	0	0	112.3	H165 H166 A171 L172 V173 L426	H165-H169 PolarHBondContact O-N 2.92Å; H166-H169 WeakPolarHBondContact O-CB 3.28Å; H166-H169 PolarHBondContact O-N 3.3Å; H166-H169 VanDerWaalsContact O-N 3.15Å; H169-A171 PolarHBondContact O-N 3.06Å; H169-L172 WeakPolarHBondContact O-CB 3.2Å; H169-L172 PolarHBondContact O-N 3.27Å; H169-V173 PolarHBondContact O-N 3.29Å; H169-V173 VanDerWaalsContact O-N 3.12Å; H169-L426 HydrophobicContact CB-CD1 3.88Å
170	E	91.9	Very high	92.2	Very high	47 Å²	47	40.3 Å²	40.3	22%	0.22	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-37.8	175.7	-72.1	-55.4	135.2	0	0	112	T34 H166 L172 V173 S174 I179	T34-E170 HydrophobicContact CG2-CB 4.16Å; T34-E170 HydrophobicContact CG2-CG 4.12Å; H166-E170 IonicContact CE1-OE1 3.39Å; H166-E170 PolarHBondContact O-N 3.32Å; E170-L172 PolarHBondContact O-N 3.29Å; E170-V173 PolarHBondContact O-N 3.49Å; E170-S174 WeakPolarHBondContact O-CB 3.46Å; E170-S174 PolarHBondContact O-N 3.4Å; E170-I179 HydrophobicContact CB-CG2 3.89Å
171	A	92.3	Very high	92	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-24	174.3	0	0	0	0	0	113.4	L167 F168 H169 I179 G180 A181 T775	L167-A171 WeakPolarHBondContact O-CB 3.22Å; L167-A171 PolarHBondContact O-N 3.03Å; F168-A171 WeakPolarHBondContact O-CB 3.22Å; F168-A171 PolarHBondContact O-N 3.13Å; H169-A171 PolarHBondContact O-N 3.06Å; A171-I179 WeakPolarHBondContact CA-O 3.18Å; A171-G180 CarbonylContact O-C 3.57Å; A171-G180 WeakPolarHBondContact O-CA 3.39Å; A171-A181 WeakPolarHBondContact O-CB 3.4Å; A171-A181 PolarHBondContact O-N 3.47Å; A171-T775 HydrophobicContact CB-CG2 4.16Å; A171-T775 WeakPolarHBondContact CB-O 3.24Å
172	L	89.8	Confident	91.6	Very high	20 Å²	20	41.8 Å²	41.8	11%	0.105	19%	0.192	C	C	.	.	H	α-helix	trans	-88.9	-28.1	178.5	-64.7	176.8	0	0	0	113.6	F168 H169 E170 F182 Y418 V422 F776	F168-L172 HydrophobicContact CD1-CD1 4.22Å; F168-L172 HydrophobicContact CE1-CD1 3.65Å; F168-L172 HydrophobicContact CE2-CD1 4.22Å; F168-L172 HydrophobicContact CE2-CD2 4.28Å; F168-L172 HydrophobicContact CE2-CG 4.31Å; F168-L172 HydrophobicContact CZ-CD1 3.65Å; F168-L172 HydrophobicContact CZ-CD2 4.31Å; F168-L172 HydrophobicContact CZ-CG 4.23Å; F168-L172 WeakPolarHBondContact O-CG 3.44Å; F168-L172 PolarHBondContact O-N 3.41Å; H169-L172 WeakPolarHBondContact O-CB 3.2Å; H169-L172 PolarHBondContact O-N 3.27Å; E170-L172 PolarHBondContact O-N 3.29Å; L172-F182 HydrophobicContact CD2-CE2 3.74Å; L172-Y418 PolarHBondContact O-OH 2.82Å; L172-V422 HydrophobicContact CB-CG1 3.9Å; L172-V422 HydrophobicContact CB-CG2 4.36Å; L172-V422 HydrophobicContact CD1-CG1 3.92Å; L172-V422 HydrophobicContact CD1-CG2 4.23Å; L172-F776 HydrophobicContact CD2-CD2 3.67Å; L172-F776 HydrophobicContact CD2-CE2 3.66Å
173	V	86.8	Confident	91.3	Very high	54 Å²	54	38.9 Å²	38.9	33%	0.327	18%	0.181	S	C	.	.	H	α-helix	trans	-107.9	-29.8	-170.2	-179.5	0	0	0	0	113.1	H169 E170 R175 L419 V422	H169-V173 PolarHBondContact O-N 3.29Å; H169-V173 VanDerWaalsContact O-N 3.12Å; E170-V173 PolarHBondContact O-N 3.49Å; V173-R175 PolarHBondContact O-N 3.42Å; V173-L419 HydrophobicContact CB-CD1 4.49Å; V173-L419 HydrophobicContact CG1-CD1 3.8Å; V173-L419 HydrophobicContact CG2-CD1 3.86Å; V173-V422 HydrophobicContact CG2-CG1 3.61Å
174	S	87.8	Confident	91.1	Very high	23 Å²	23	38.5 Å²	38.5	16%	0.161	18%	0.179	C	C	.	.			trans	-65	132.2	-172.1	-175.1	0	0	0	0	112.9	E170 D176 G180 S183	E170-S174 WeakPolarHBondContact O-CB 3.46Å; E170-S174 PolarHBondContact O-N 3.4Å; S174-D176 VanDerWaalsContact C-N 3.32Å; S174-D176 PolarHBondContact OG-N 3.32Å; S174-G180 WeakPolarHBondContact O-CA 3.4Å; S174-S183 PolarHBondContact O-OG 2.83Å; S174-S183 VanDerWaalsContact O-OG 3.05Å
175	R	84.5	Confident	90.8	Very high	213 Å²	213	39.1 Å²	39.1	80%	0.804	18%	0.184	S	C	*	.	S	Bend	trans	-79.2	-17.1	174.6	-65.4	-175.9	-179.7	176.6	0.7	112.8	V173 S183	V173-R175 PolarHBondContact O-N 3.42Å; R175-S183 WeakPolarHBondContact O-CB 3.5Å
176	D	89.2	Confident	90.6	Very high	30 Å²	30	40.6 Å²	40.6	16%	0.16	19%	0.192	C	C	.	.	S	Bend	trans	-77.9	120.7	176.4	-170.8	-40.5	0	0	0	110	T31 S174 R178 I179 G180 S183	T31-D176 WeakPolarHBondContact CG2-OD2 3.08Å; S174-D176 VanDerWaalsContact C-N 3.32Å; S174-D176 PolarHBondContact OG-N 3.32Å; D176-R178 PolarHBondContact O-N 3.24Å; D176-R178 VanDerWaalsContact O-N 3.07Å; D176-R178 WeakPolarHBondContact OD1-CB 3.37Å; D176-R178 WeakPolarHBondContact OD1-CG 3.48Å; D176-R178 PolarHBondContact OD1-N 3.44Å; D176-R178 IonicContact OD1-NE 2.68Å; D176-R178 PolarHBondContact OD1-NE 3.26Å; D176-R178 VanDerWaalsContact OD1-NE 3.13Å; D176-R178 IonicContact OD2-CZ 3.63Å; D176-R178 IonicContact OD2-NE 2.92Å; D176-R178 PolarHBondContact OD2-NE 3.45Å; D176-R178 IonicContact OD2-NH2 3.92Å; D176-R178 PolarHBondContact OD2-NH2 3.24Å; D176-I179 PolarHBondContact O-N 3.05Å; D176-G180 PolarHBondContact O-N 3.39Å; D176-S183 PolarHBondContact O-OG 3.25Å
177	P	89.7	Confident	90.4	Very high	44 Å²	44	39.6 Å²	39.6	29%	0.286	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-9	-179.1	28.7	-36.9	0	0	0	114.5	I179 S183 Q184 L187	P177-I179 VanDerWaalsContact C-N 3.31Å; P177-S183 WeakPolarHBondContact CA-OG 3.38Å; P177-Q184 HydrophobicContact CB-CB 4.27Å; P177-Q184 WeakPolarHBondContact O-CB 3.19Å; P177-Q184 WeakPolarHBondContact O-CG 3.42Å; P177-L187 HydrophobicContact CB-CB 4.41Å; P177-L187 HydrophobicContact CB-CD2 3.87Å; P177-L187 HydrophobicContact CG-CD2 3.93Å
178	R	91	Very high	90.3	Very high	128 Å²	128	39.9 Å²	39.9	48%	0.483	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-25.7	171.5	-61.4	177.1	-73.9	-173.6	-1.7	111.9	D28 L35 D176	D28-R178 IonicContact OD1-NH2 2.63Å; D28-R178 PolarHBondContact OD1-NH2 2.64Å; L35-R178 HydrophobicContact CD1-CB 4.35Å; L35-R178 HydrophobicContact CD2-CB 4.34Å; D176-R178 PolarHBondContact O-N 3.24Å; D176-R178 VanDerWaalsContact O-N 3.07Å; D176-R178 WeakPolarHBondContact OD1-CB 3.37Å; D176-R178 WeakPolarHBondContact OD1-CG 3.48Å; D176-R178 PolarHBondContact OD1-N 3.44Å; D176-R178 IonicContact OD1-NE 2.68Å; D176-R178 PolarHBondContact OD1-NE 3.26Å; D176-R178 VanDerWaalsContact OD1-NE 3.13Å; D176-R178 IonicContact OD2-CZ 3.63Å; D176-R178 IonicContact OD2-NE 2.92Å; D176-R178 PolarHBondContact OD2-NE 3.45Å; D176-R178 IonicContact OD2-NH2 3.92Å; D176-R178 PolarHBondContact OD2-NH2 3.24Å
179	I	90.9	Very high	90.1	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-47.6	-176	-62.3	170.3	0	0	0	111.2	T31 T34 L35 E170 A171 D176 P177 T775	T31-I179 HydrophobicContact CG2-CD1 3.67Å; T31-I179 HydrophobicContact CG2-CG1 4.4Å; T34-I179 HydrophobicContact CG2-CD1 3.82Å; T34-I179 HydrophobicContact CG2-CG1 4.25Å; T34-I179 HydrophobicContact CG2-CG2 3.9Å; L35-I179 HydrophobicContact CD2-CG1 4Å; L35-I179 HydrophobicContact CG-CD1 4.48Å; L35-I179 HydrophobicContact CG-CG1 4.17Å; E170-I179 HydrophobicContact CB-CG2 3.89Å; A171-I179 WeakPolarHBondContact CA-O 3.18Å; D176-I179 PolarHBondContact O-N 3.05Å; P177-I179 VanDerWaalsContact C-N 3.31Å; I179-T775 WeakPolarHBondContact O-CG2 3.25Å
180	G	90.5	Very high	90	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.204	C	C	.	.			trans	-80.6	128.9	-172.8	0	0	0	0	0	113.2	A171 S174 D176 S183 Q184	A171-G180 CarbonylContact O-C 3.57Å; A171-G180 WeakPolarHBondContact O-CA 3.39Å; S174-G180 WeakPolarHBondContact O-CA 3.4Å; D176-G180 PolarHBondContact O-N 3.39Å; G180-S183 WeakPolarHBondContact CA-OG 3.31Å; G180-S183 PolarHBondContact O-OG 3.41Å; G180-Q184 WeakPolarHBondContact O-CB 3.49Å; G180-Q184 PolarHBondContact O-N 3.41Å
181	A	91.6	Very high	90	Very high	5 Å²	5	42.4 Å²	42.4	4%	0.041	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-49.1	175.5	0	0	0	0	0	110.9	A171 S183 Q184 A185 S771 T775 F776	A171-A181 WeakPolarHBondContact O-CB 3.4Å; A171-A181 PolarHBondContact O-N 3.47Å; A181-S183 PolarHBondContact O-N 3.13Å; A181-Q184 PolarHBondContact O-N 3.04Å; A181-A185 WeakPolarHBondContact O-CB 3.43Å; A181-A185 PolarHBondContact O-N 3.49Å; A181-S771 PolarHBondContact O-OG 3.19Å; A181-T775 HydrophobicContact CB-CG2 3.92Å; A181-F776 HydrophobicContact CB-CB 3.9Å
182	F	87.9	Confident	90	Very high	65 Å²	65	44 Å²	44	29%	0.285	21%	0.212	S	C	.	.	H	α-helix	trans	-66.6	-39.7	-178.3	-68.3	-78.1	0	0	0	113	L172 A185 N186 I406 Y418	L172-F182 HydrophobicContact CD2-CE2 3.74Å; F182-A185 PolarHBondContact O-N 3.27Å; F182-N186 WeakPolarHBondContact O-CB 3.14Å; F182-N186 PolarHBondContact O-N 3.04Å; F182-I406 HydrophobicContact CB-CG2 4.26Å; F182-I406 HydrophobicContact CD1-CG2 4.22Å; F182-Y418 WeakPolarHBondContact CD2-OH 3.32Å; F182-Y418 HydrophobicContact CE2-CE2 4.5Å; F182-Y418 AromaticContact CE2-CZ 3.98Å; F182-Y418 WeakPolarHBondContact CE2-OH 3.44Å
183	S	88.5	Confident	89.9	Confident	21 Å²	21	43.7 Å²	43.7	15%	0.147	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-40.3	174.6	51.6	0	0	0	0	111.6	S174 R175 D176 P177 G180 A181 N186 L187	S174-S183 PolarHBondContact O-OG 2.83Å; S174-S183 VanDerWaalsContact O-OG 3.05Å; R175-S183 WeakPolarHBondContact O-CB 3.5Å; D176-S183 PolarHBondContact O-OG 3.25Å; P177-S183 WeakPolarHBondContact CA-OG 3.38Å; G180-S183 WeakPolarHBondContact CA-OG 3.31Å; G180-S183 PolarHBondContact O-OG 3.41Å; A181-S183 PolarHBondContact O-N 3.13Å; S183-N186 PolarHBondContact O-N 3.27Å; S183-L187 WeakPolarHBondContact O-CB 3.15Å; S183-L187 PolarHBondContact O-N 3.46Å
184	Q	92.2	Very high	90.1	Very high	26 Å²	26	46.4 Å²	46.4	12%	0.121	22%	0.219	C	C	.	.	H	α-helix	trans	-65.6	-42.3	174.2	-168.8	176.6	16.4	0	0	112.6	P177 G180 A181 L187 S188 R767 T775	P177-Q184 HydrophobicContact CB-CB 4.27Å; P177-Q184 WeakPolarHBondContact O-CB 3.19Å; P177-Q184 WeakPolarHBondContact O-CG 3.42Å; G180-Q184 WeakPolarHBondContact O-CB 3.49Å; G180-Q184 PolarHBondContact O-N 3.41Å; A181-Q184 PolarHBondContact O-N 3.04Å; Q184-L187 PolarHBondContact O-N 3.28Å; Q184-S188 WeakPolarHBondContact O-CB 3.45Å; Q184-S188 PolarHBondContact O-N 2.96Å; Q184-R767 HydrophobicContact CG-CG 3.66Å; Q184-T775 PolarHBondContact OE1-OG1 3.27Å
185	A	90.1	Very high	90.2	Very high	14 Å²	14	45.6 Å²	45.6	12%	0.116	21%	0.214	C	C	.	.	H	α-helix	trans	-61.8	-47	173.8	0	0	0	0	0	110.7	A181 F182 L187 S188 L189 I406 S771	A181-A185 WeakPolarHBondContact O-CB 3.43Å; A181-A185 PolarHBondContact O-N 3.49Å; F182-A185 PolarHBondContact O-N 3.27Å; A185-L187 PolarHBondContact O-N 2.98Å; A185-S188 WeakPolarHBondContact O-CB 3.49Å; A185-S188 PolarHBondContact O-N 3.28Å; A185-S188 VanDerWaalsContact O-N 3.14Å; A185-S188 PolarHBondContact O-OG 2.95Å; A185-L189 WeakPolarHBondContact O-CG 3.24Å; A185-L189 PolarHBondContact O-N 3.41Å; A185-I406 HydrophobicContact CB-CD1 4.07Å; A185-S771 PolarHBondContact N-OG 3.19Å
186	N	89.2	Confident	90.2	Very high	39 Å²	39	36.4 Å²	36.4	21%	0.209	18%	0.181	C	C	.	.	H	α-helix	trans	-58.7	-47.1	177	-176.1	38	0	0	0	111.9	F182 S183 S188 L189 I190 R403 I406	F182-N186 WeakPolarHBondContact O-CB 3.14Å; F182-N186 PolarHBondContact O-N 3.04Å; S183-N186 PolarHBondContact O-N 3.27Å; N186-S188 VanDerWaalsContact C-N 3.31Å; N186-S188 PolarHBondContact O-N 3.42Å; N186-L189 PolarHBondContact O-N 3.25Å; N186-L189 VanDerWaalsContact O-N 3.15Å; N186-I190 WeakPolarHBondContact O-CG1 3.29Å; N186-I190 PolarHBondContact O-N 2.85Å; N186-R403 WeakPolarHBondContact OD1-CG 3.29Å; N186-I406 HydrophobicContact CB-CG2 4.18Å
187	L	91.6	Very high	90.1	Very high	53 Å²	53	40.2 Å²	40.2	28%	0.277	20%	0.196	S	C	.	.	H	α-helix	trans	-57.8	-44.2	174.4	178	61.8	0	0	0	111.5	P177 S183 Q184 A185 L189 I190 E191	P177-L187 HydrophobicContact CB-CB 4.41Å; P177-L187 HydrophobicContact CB-CD2 3.87Å; P177-L187 HydrophobicContact CG-CD2 3.93Å; S183-L187 WeakPolarHBondContact O-CB 3.15Å; S183-L187 PolarHBondContact O-N 3.46Å; Q184-L187 PolarHBondContact O-N 3.28Å; A185-L187 PolarHBondContact O-N 2.98Å; L187-L189 VanDerWaalsContact C-N 3.28Å; L187-L189 PolarHBondContact O-N 2.92Å; L187-I190 PolarHBondContact O-N 3.28Å; L187-E191 HydrophobicContact CD1-CG 4.15Å; L187-E191 WeakPolarHBondContact CD1-OE1 3.43Å; L187-E191 PolarHBondContact O-N 3.41Å
188	S	93.4	Very high	89.9	Confident	8 Å²	8	42.6 Å²	42.6	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-40.1	177	81.3	0	0	0	0	112.3	Q184 A185 N186 F192 A764 G768	Q184-S188 WeakPolarHBondContact O-CB 3.45Å; Q184-S188 PolarHBondContact O-N 2.96Å; A185-S188 WeakPolarHBondContact O-CB 3.49Å; A185-S188 PolarHBondContact O-N 3.28Å; A185-S188 VanDerWaalsContact O-N 3.14Å; A185-S188 PolarHBondContact O-OG 2.95Å; N186-S188 VanDerWaalsContact C-N 3.31Å; N186-S188 PolarHBondContact O-N 3.42Å; S188-F192 WeakPolarHBondContact O-CB 3.26Å; S188-F192 PolarHBondContact O-N 2.91Å; S188-A764 WeakPolarHBondContact CB-O 3.49Å; S188-G768 VanDerWaalsContact CB-N 3.32Å; S188-G768 VanDerWaalsContact OG-CA 3.3Å; S188-G768 WeakPolarHBondContact OG-CA 3.38Å
189	L	90.5	Very high	89.5	Confident	19 Å²	19	37 Å²	37	10%	0.099	19%	0.186	C	C	.	.	H	α-helix	trans	-69.8	-35.5	178.8	-64.3	172.3	0	0	0	112.1	A185 N186 L187 E193 L399 I402 R403 I406	A185-L189 WeakPolarHBondContact O-CG 3.24Å; A185-L189 PolarHBondContact O-N 3.41Å; N186-L189 PolarHBondContact O-N 3.25Å; N186-L189 VanDerWaalsContact O-N 3.15Å; L187-L189 VanDerWaalsContact C-N 3.28Å; L187-L189 PolarHBondContact O-N 2.92Å; L189-E193 WeakPolarHBondContact O-CB 3.33Å; L189-E193 PolarHBondContact O-N 3.24Å; L189-E193 VanDerWaalsContact O-N 3.11Å; L189-L399 HydrophobicContact CD2-CD2 3.36Å; L189-I402 HydrophobicContact CD1-CB 4.41Å; L189-I402 HydrophobicContact CD1-CG2 3.87Å; L189-I402 HydrophobicContact CD2-CG2 4.46Å; L189-R403 VanDerWaalsContact C-NH2 3.33Å; L189-R403 HydrophobicContact CD1-CB 4.02Å; L189-R403 PolarHBondContact O-NH2 3.08Å; L189-I406 HydrophobicContact CD1-CD1 3.66Å
190	I	90	Very high	88.9	Confident	71 Å²	71	37.2 Å²	37.2	36%	0.364	19%	0.188	S	C	.	.	H	α-helix	trans	-66.8	-53.9	176.7	-67.4	167.1	0	0	0	109.9	N186 L187 F192 E193 E194	N186-I190 WeakPolarHBondContact O-CG1 3.29Å; N186-I190 PolarHBondContact O-N 2.85Å; L187-I190 PolarHBondContact O-N 3.28Å; I190-F192 VanDerWaalsContact C-N 3.25Å; I190-F192 PolarHBondContact O-N 3.19Å; I190-E193 PolarHBondContact O-N 3.32Å; I190-E193 VanDerWaalsContact O-N 3.16Å; I190-E194 PolarHBondContact O-N 3.25Å
191	E	93.5	Very high	88.4	Confident	53 Å²	53	41.4 Å²	41.4	25%	0.248	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-34.8	179.5	-69.6	-174.2	-152.4	0	0	111.9	L187 E194 A195 A764 R767	L187-E191 HydrophobicContact CD1-CG 4.15Å; L187-E191 WeakPolarHBondContact CD1-OE1 3.43Å; L187-E191 PolarHBondContact O-N 3.41Å; E191-E194 PolarHBondContact O-N 3.33Å; E191-A195 VanDerWaalsContact O-CB 3.29Å; E191-A195 WeakPolarHBondContact O-CB 3.35Å; E191-A195 PolarHBondContact O-N 3.23Å; E191-A764 HydrophobicContact CB-CB 3.82Å; E191-R767 VanDerWaalsContact CD-CZ 3.42Å; E191-R767 VanDerWaalsContact CD-NH2 3.26Å; E191-R767 IonicContact OE1-CZ 2.67Å; E191-R767 IonicContact OE1-NE 2.79Å; E191-R767 IonicContact OE1-NH1 2.78Å; E191-R767 PolarHBondContact OE1-NH1 2.88Å; E191-R767 IonicContact OE1-NH2 3.13Å; E191-R767 PolarHBondContact OE1-NH2 2.93Å; E191-R767 IonicContact OE2-CZ 3.18Å; E191-R767 IonicContact OE2-NH1 3.27Å; E191-R767 PolarHBondContact OE2-NH1 3.34Å; E191-R767 IonicContact OE2-NH2 2.91Å; E191-R767 PolarHBondContact OE2-NH2 3.02Å
192	F	91.2	Very high	87.7	Confident	33 Å²	33	44.8 Å²	44.8	15%	0.145	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-43.4	176.7	-169.2	-83.9	0	0	0	110.5	S188 I190 L196 V395 L399 I572 L761 A764 A765	S188-F192 WeakPolarHBondContact O-CB 3.26Å; S188-F192 PolarHBondContact O-N 2.91Å; I190-F192 VanDerWaalsContact C-N 3.25Å; I190-F192 PolarHBondContact O-N 3.19Å; F192-L196 HydrophobicContact CD1-CD1 3.72Å; F192-L196 HydrophobicContact CD1-CG 4.08Å; F192-L196 HydrophobicContact CE1-CD1 3.42Å; F192-L196 VanDerWaalsContact CE1-CD1 3.42Å; F192-L196 HydrophobicContact CE1-CG 3.94Å; F192-L196 HydrophobicContact CZ-CD1 4.4Å; F192-L196 WeakPolarHBondContact O-CB 3.21Å; F192-L196 VanDerWaalsContact O-CG 3.31Å; F192-L196 WeakPolarHBondContact O-CG 3.01Å; F192-L196 PolarHBondContact O-N 2.88Å; F192-L196 VanDerWaalsContact O-N 3.11Å; F192-V395 HydrophobicContact CE1-CG1 3.93Å; F192-L399 HydrophobicContact CD1-CD1 3.57Å; F192-L399 HydrophobicContact CD1-CD2 4.2Å; F192-L399 HydrophobicContact CE1-CD1 4.09Å; F192-I572 HydrophobicContact CE2-CD1 4.46Å; F192-I572 HydrophobicContact CZ-CD1 4.38Å; F192-L761 HydrophobicContact CD1-CD1 4.14Å; F192-L761 HydrophobicContact CD2-CD1 3.55Å; F192-L761 HydrophobicContact CD2-CG 4.28Å; F192-L761 HydrophobicContact CE1-CD1 4.02Å; F192-L761 HydrophobicContact CE2-CD1 3.36Å; F192-L761 HydrophobicContact CE2-CG 3.83Å; F192-L761 HydrophobicContact CG-CD1 3.95Å; F192-L761 HydrophobicContact CZ-CD1 3.63Å; F192-L761 HydrophobicContact CZ-CG 4.3Å; F192-A764 HydrophobicContact CB-CB 3.78Å; F192-A764 HydrophobicContact CD2-CB 4.2Å; F192-A764 HydrophobicContact CG-CB 4.47Å; F192-A765 HydrophobicContact CD2-CB 4.15Å; F192-A765 HydrophobicContact CE2-CB 4.05Å
193	E	88.8	Confident	87	Confident	13 Å²	13	41.7 Å²	41.7	6%	0.061	21%	0.209	C	C	.	.	H	α-helix	trans	-63.9	-39.1	175.1	-172.6	-173.9	165.5	0	0	112.3	L189 I190 L196 K197 L399 R403	L189-E193 WeakPolarHBondContact O-CB 3.33Å; L189-E193 PolarHBondContact O-N 3.24Å; L189-E193 VanDerWaalsContact O-N 3.11Å; I190-E193 PolarHBondContact O-N 3.32Å; I190-E193 VanDerWaalsContact O-N 3.16Å; E193-L196 WeakPolarHBondContact O-CB 2.97Å; E193-K197 WeakPolarHBondContact O-CG 3.4Å; E193-K197 PolarHBondContact O-N 3.5Å; E193-K197 WeakPolarHBondContact OE1-CE 2.95Å; E193-K197 IonicContact OE1-NZ 3.46Å; E193-K197 PolarHBondContact OE1-NZ 3.31Å; E193-L399 HydrophobicContact CB-CD1 4.37Å; E193-R403 IonicContact OE2-CZ 2.68Å; E193-R403 VanDerWaalsContact OE2-CZ 3.27Å; E193-R403 IonicContact OE2-NH1 3.81Å; E193-R403 PolarHBondContact OE2-NH1 3.11Å; E193-R403 IonicContact OE2-NH2 3.32Å; E193-R403 PolarHBondContact OE2-NH2 2.92Å
194	E	90.1	Very high	86.1	Confident	111 Å²	111	44.7 Å²	44.7	52%	0.519	22%	0.22	S	C	.	.	H	α-helix	trans	-68.6	-49.4	178.4	-172.2	169.9	-161.2	0	0	112	I190 E191 L196 K197 D198	I190-E194 PolarHBondContact O-N 3.25Å; E191-E194 PolarHBondContact O-N 3.33Å; E194-L196 PolarHBondContact O-N 3.49Å; E194-K197 WeakPolarHBondContact O-CB 3.34Å; E194-K197 PolarHBondContact O-N 2.83Å; E194-D198 PolarHBondContact O-N 3.27Å
195	A	89.5	Confident	85.1	Confident	6 Å²	6	48.4 Å²	48.4	5%	0.05	24%	0.241	C	C	.	.	H	α-helix	trans	-55.7	-42.9	175.7	0	0	0	0	0	111.3	E191 D198 M199 L761	E191-A195 VanDerWaalsContact O-CB 3.29Å; E191-A195 WeakPolarHBondContact O-CB 3.35Å; E191-A195 PolarHBondContact O-N 3.23Å; A195-D198 PolarHBondContact O-N 3.48Å; A195-M199 HydrophobicContact CB-CE 4.08Å; A195-M199 VanDerWaalsContact O-CE 3.31Å; A195-M199 WeakPolarHBondContact O-CE 3.3Å; A195-M199 PolarHBondContact O-N 2.85Å; A195-L761 HydrophobicContact CB-CB 4.47Å; A195-L761 HydrophobicContact CB-CD1 4.32Å
196	L	85.3	Confident	83.8	Confident	21 Å²	21	48.8 Å²	48.8	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-44.1	175.2	-95.6	-163.3	0	0	0	112.5	F192 E193 E194 M199 V200 M392 V395 L761	F192-L196 HydrophobicContact CD1-CD1 3.72Å; F192-L196 HydrophobicContact CD1-CG 4.08Å; F192-L196 HydrophobicContact CE1-CD1 3.42Å; F192-L196 VanDerWaalsContact CE1-CD1 3.42Å; F192-L196 HydrophobicContact CE1-CG 3.94Å; F192-L196 HydrophobicContact CZ-CD1 4.4Å; F192-L196 WeakPolarHBondContact O-CB 3.21Å; F192-L196 VanDerWaalsContact O-CG 3.31Å; F192-L196 WeakPolarHBondContact O-CG 3.01Å; F192-L196 PolarHBondContact O-N 2.88Å; F192-L196 VanDerWaalsContact O-N 3.11Å; E193-L196 WeakPolarHBondContact O-CB 2.97Å; E194-L196 PolarHBondContact O-N 3.49Å; L196-M199 PolarHBondContact O-N 3.16Å; L196-V200 WeakPolarHBondContact O-CG2 3.46Å; L196-V200 PolarHBondContact O-N 2.97Å; L196-M392 VanDerWaalsContact C-SD 3.52Å; L196-M392 HydrophobicContact CB-CE 3.55Å; L196-M392 HydrophobicContact CB-SD 3.24Å; L196-M392 WeakPolarHBondContact CB-SD 3.35Å; L196-M392 HydrophobicContact CD1-CE 4.47Å; L196-M392 HydrophobicContact CD1-SD 3.64Å; L196-M392 HydrophobicContact CD2-SD 3.62Å; L196-M392 HydrophobicContact CG-SD 3.64Å; L196-M392 WeakPolarHBondContact O-CE 3.44Å; L196-M392 VanDerWaalsContact O-SD 3.38Å; L196-V395 HydrophobicContact CD1-CB 4.31Å; L196-V395 HydrophobicContact CD1-CG1 3.54Å; L196-L761 HydrophobicContact CD2-CD1 3.81Å; L196-L761 HydrophobicContact CD2-CD2 4.3Å; L196-L761 HydrophobicContact CG-CD1 3.74Å
197	K	86.6	Confident	82	Confident	109 Å²	109	51.2 Å²	51.2	47%	0.474	26%	0.261	S	S	.	.	H	α-helix	trans	-65.3	-42.6	175.8	-76.2	171.1	-174.2	162.4	0	111.8	E193 E194 M199 V200 Q201 M392	E193-K197 WeakPolarHBondContact O-CG 3.4Å; E193-K197 PolarHBondContact O-N 3.5Å; E193-K197 WeakPolarHBondContact OE1-CE 2.95Å; E193-K197 IonicContact OE1-NZ 3.46Å; E193-K197 PolarHBondContact OE1-NZ 3.31Å; E194-K197 WeakPolarHBondContact O-CB 3.34Å; E194-K197 PolarHBondContact O-N 2.83Å; K197-M199 VanDerWaalsContact C-N 3.32Å; K197-M199 PolarHBondContact O-N 3.46Å; K197-V200 PolarHBondContact O-N 3.46Å; K197-Q201 WeakPolarHBondContact O-CB 3.31Å; K197-Q201 PolarHBondContact O-N 2.92Å; K197-M392 HydrophobicContact CG-CE 3.98Å
198	D	86.1	Confident	80.2	Confident	94 Å²	94	53.2 Å²	53.2	50%	0.503	28%	0.28	S	S	.	.	H	α-helix	trans	-62.5	-40.4	178.2	-74.3	-11.8	0	0	0	111.6	E194 A195 Q201 M202	E194-D198 PolarHBondContact O-N 3.27Å; A195-D198 PolarHBondContact O-N 3.48Å; D198-Q201 PolarHBondContact O-N 3.23Å; D198-M202 VanDerWaalsContact O-CB 3.3Å; D198-M202 WeakPolarHBondContact O-CB 3.46Å; D198-M202 PolarHBondContact O-N 3.27Å
199	M	81.1	Confident	78.6	Confident	11 Å²	11	54 Å²	54	5%	0.054	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-43.4	174.7	-85.5	177.6	-112.2	0	0	112.9	A195 L196 K197 Q201 M202 A203 F581 I756 L761	A195-M199 HydrophobicContact CB-CE 4.08Å; A195-M199 VanDerWaalsContact O-CE 3.31Å; A195-M199 WeakPolarHBondContact O-CE 3.3Å; A195-M199 PolarHBondContact O-N 2.85Å; L196-M199 PolarHBondContact O-N 3.16Å; K197-M199 VanDerWaalsContact C-N 3.32Å; K197-M199 PolarHBondContact O-N 3.46Å; M199-Q201 VanDerWaalsContact C-N 3.33Å; M199-M202 PolarHBondContact O-N 2.87Å; M199-A203 VanDerWaalsContact O-CB 3.26Å; M199-A203 WeakPolarHBondContact O-CB 3.39Å; M199-A203 PolarHBondContact O-N 3.35Å; M199-F581 HydrophobicContact SD-CB 4.35Å; M199-F581 HydrophobicContact SD-CD2 4.36Å; M199-F581 HydrophobicContact SD-CG 4.27Å; M199-I756 HydrophobicContact CB-CG2 4.1Å; M199-I756 HydrophobicContact CG-CG2 3.6Å; M199-I756 HydrophobicContact SD-CG2 4.42Å; M199-L761 HydrophobicContact CE-CB 3.46Å; M199-L761 VanDerWaalsContact CE-CB 3.46Å; M199-L761 HydrophobicContact CE-CD1 4.09Å; M199-L761 HydrophobicContact CE-CD2 3.89Å; M199-L761 HydrophobicContact CE-CG 4.01Å; M199-L761 HydrophobicContact SD-CD2 4.34Å
200	V	78.5	Confident	77.5	Confident	10 Å²	10	59.3 Å²	59.3	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-44.1	174.5	173.6	0	0	0	0	110.7	L196 K197 M202 A203 K204 F388 E389 M392	L196-V200 WeakPolarHBondContact O-CG2 3.46Å; L196-V200 PolarHBondContact O-N 2.97Å; K197-V200 PolarHBondContact O-N 3.46Å; V200-M202 VanDerWaalsContact C-N 3.32Å; V200-M202 PolarHBondContact O-N 3.45Å; V200-A203 WeakPolarHBondContact O-CB 3.31Å; V200-A203 PolarHBondContact O-N 3.34Å; V200-K204 WeakPolarHBondContact O-CG 3.4Å; V200-K204 PolarHBondContact O-N 2.93Å; V200-F388 HydrophobicContact CG2-CB 4.27Å; V200-E389 HydrophobicContact CG1-CG 3.6Å; V200-M392 HydrophobicContact CG2-CB 4.49Å; V200-M392 HydrophobicContact CG2-CE 4.1Å; V200-M392 HydrophobicContact CG2-CG 3.49Å; V200-M392 VanDerWaalsContact CG2-CG 3.49Å; V200-M392 HydrophobicContact CG2-SD 3.87Å
201	Q	80	Confident	76.7	Confident	88 Å²	88	56.7 Å²	56.7	41%	0.411	30%	0.299	S	S	.	.	H	α-helix	trans	-66.5	-38.7	-179.2	-171.5	56.8	48	0	0	111.2	K197 D198 M199 K204 N205	K197-Q201 WeakPolarHBondContact O-CB 3.31Å; K197-Q201 PolarHBondContact O-N 2.92Å; D198-Q201 PolarHBondContact O-N 3.23Å; M199-Q201 VanDerWaalsContact C-N 3.33Å; Q201-K204 PolarHBondContact O-N 2.98Å; Q201-N205 VanDerWaalsContact NE2-CG 3.34Å; Q201-N205 PolarHBondContact NE2-ND2 2.69Å; Q201-N205 VanDerWaalsContact NE2-ND2 3.16Å; Q201-N205 PolarHBondContact NE2-OD1 3.47Å; Q201-N205 VanDerWaalsContact O-CB 3.26Å; Q201-N205 WeakPolarHBondContact O-CB 3.47Å; Q201-N205 PolarHBondContact O-N 3.42Å; Q201-N205 PolarHBondContact O-ND2 3.41Å
202	M	77.4	Confident	76	Confident	76 Å²	76	56.8 Å²	56.8	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-65.2	-47.2	173.3	-167.9	172	-65.2	0	0	110.7	D198 M199 V200 K204 N205 T206 I756 P757	D198-M202 VanDerWaalsContact O-CB 3.3Å; D198-M202 WeakPolarHBondContact O-CB 3.46Å; D198-M202 PolarHBondContact O-N 3.27Å; M199-M202 PolarHBondContact O-N 2.87Å; V200-M202 VanDerWaalsContact C-N 3.32Å; V200-M202 PolarHBondContact O-N 3.45Å; M202-K204 PolarHBondContact O-N 3.35Å; M202-K204 VanDerWaalsContact O-N 3.17Å; M202-N205 CarbonylContact O-C 3.57Å; M202-N205 PolarHBondContact O-N 3.39Å; M202-T206 WeakPolarHBondContact O-CB 3.44Å; M202-T206 PolarHBondContact O-N 2.89Å; M202-T206 PolarHBondContact O-OG1 3.47Å; M202-I756 HydrophobicContact CG-CG1 4.42Å; M202-P757 HydrophobicContact CE-CG 4.14Å; M202-P757 WeakPolarHBondContact SD-CD 3.24Å; M202-P757 HydrophobicContact SD-CG 4.16Å
203	A	72.9	Confident	75.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-51.4	-39.1	173.6	0	0	0	0	0	114	M199 V200 W753 I756	M199-A203 VanDerWaalsContact O-CB 3.26Å; M199-A203 WeakPolarHBondContact O-CB 3.39Å; M199-A203 PolarHBondContact O-N 3.35Å; V200-A203 WeakPolarHBondContact O-CB 3.31Å; V200-A203 PolarHBondContact O-N 3.34Å; A203-W753 HydrophobicContact CB-CD2 4.04Å; A203-W753 HydrophobicContact CB-CE3 4Å; A203-W753 HydrophobicContact CB-CH2 3.21Å; A203-W753 HydrophobicContact CB-CZ2 3.28Å; A203-W753 HydrophobicContact CB-CZ3 3.53Å; A203-I756 HydrophobicContact CB-CD1 3.75Å
204	K	71.2	Confident	75	Confident	84 Å²	84	63.5 Å²	63.5	37%	0.365	34%	0.336	S	S	.	.	H	α-helix	trans	-71.7	-41.8	173.2	-69.6	177.7	179.8	-175.6	0	112.5	V200 Q201 M202 A385 E389	V200-K204 WeakPolarHBondContact O-CG 3.4Å; V200-K204 PolarHBondContact O-N 2.93Å; Q201-K204 PolarHBondContact O-N 2.98Å; M202-K204 PolarHBondContact O-N 3.35Å; M202-K204 VanDerWaalsContact O-N 3.17Å; K204-A385 HydrophobicContact CG-CB 3.66Å; K204-E389 WeakPolarHBondContact CE-OE1 3.48Å; K204-E389 IonicContact NZ-OE1 3.15Å; K204-E389 PolarHBondContact NZ-OE1 3.44Å
205	N	71.1	Confident	74.8	Confident	104 Å²	104	61 Å²	61	56%	0.556	32%	0.323	S	S	*	.	H	α-helix	trans	-83.8	-14.4	-174.2	-70.8	-7.2	0	0	0	114.2	Q201 M202 S207	Q201-N205 VanDerWaalsContact NE2-CG 3.34Å; Q201-N205 PolarHBondContact NE2-ND2 2.69Å; Q201-N205 VanDerWaalsContact NE2-ND2 3.16Å; Q201-N205 PolarHBondContact NE2-OD1 3.47Å; Q201-N205 VanDerWaalsContact O-CB 3.26Å; Q201-N205 WeakPolarHBondContact O-CB 3.47Å; Q201-N205 PolarHBondContact O-N 3.42Å; Q201-N205 PolarHBondContact O-ND2 3.41Å; M202-N205 CarbonylContact O-C 3.57Å; M202-N205 PolarHBondContact O-N 3.39Å; N205-S207 VanDerWaalsContact C-N 3.28Å; N205-S207 PolarHBondContact O-N 2.97Å
206	T	62.4	Low	74.6	Confident	21 Å²	21	65.4 Å²	65.4	13%	0.129	34%	0.343	C	S	.	.			trans	-64.8	91.4	-179.2	-62.8	0	0	0	0	109	M202 R381 T752	M202-T206 WeakPolarHBondContact O-CB 3.44Å; M202-T206 PolarHBondContact O-N 2.89Å; M202-T206 PolarHBondContact O-OG1 3.47Å; T206-R381 PolarHBondContact O-NE 3.18Å; T206-T752 WeakPolarHBondContact CG2-O 3.34Å
207	S	51.4	Low	74.7	Confident	90 Å²	90	70.8 Å²	70.8	63%	0.629	36%	0.361	S	S	*	.			trans	-87	123.5	170.5	59.5	0	0	0	0	108	N205	N205-S207 VanDerWaalsContact C-N 3.28Å; N205-S207 PolarHBondContact O-N 2.97Å
208	S	54	Low	74.7	Confident	96 Å²	96	65.6 Å²	65.6	67%	0.671	34%	0.339	S	S	*	.			trans	57.3	80.4	167.4	69.9	0	0	0	0	116.6
209	T	59.9	Low	74.8	Confident	24 Å²	24	63.2 Å²	63.2	15%	0.147	33%	0.325	C	S	.	.			trans	-64.6	140.8	139.8	45.1	0	0	0	0	107.9	L211 A751 T752 D755	T209-L211 VanDerWaalsContact C-N 3.34Å; T209-L211 WeakPolarHBondContact O-CD1 3.37Å; T209-L211 PolarHBondContact O-N 3.43Å; T209-L211 WeakPolarHBondContact OG1-CD1 3.26Å; T209-A751 WeakPolarHBondContact CG2-O 3.17Å; T209-A751 PolarHBondContact OG1-O 2.97Å; T209-T752 WeakPolarHBondContact OG1-CA 3.36Å; T209-D755 VanDerWaalsContact CG2-OD2 3.28Å; T209-D755 WeakPolarHBondContact CG2-OD2 3.34Å
210	D	66.1	Low	75.3	Confident	131 Å²	131	69.4 Å²	69.4	70%	0.701	35%	0.348	S	S	*	.			trans	-67.5	97.6	174.5	178.2	19.7	0	0	0	109	S212	D210-S212 PolarHBondContact O-N 3.37Å; D210-S212 WeakPolarHBondContact OD1-CB 3.08Å; D210-S212 PolarHBondContact OD1-N 2.86Å; D210-S212 PolarHBondContact OD1-OG 3.08Å; D210-S212 PolarHBondContact OD2-OG 3.47Å
211	L	73	Confident	75.8	Confident	15 Å²	15	70.3 Å²	70.3	8%	0.079	35%	0.352	C	S	.	.			trans	-80.5	9.3	178.3	-96.8	78.5	0	0	0	112.3	T209 K213 Q214 K215 W371 A375 A748 T752	T209-L211 VanDerWaalsContact C-N 3.34Å; T209-L211 WeakPolarHBondContact O-CD1 3.37Å; T209-L211 PolarHBondContact O-N 3.43Å; T209-L211 WeakPolarHBondContact OG1-CD1 3.26Å; L211-K213 PolarHBondContact O-N 2.92Å; L211-Q214 CarbonylContact O-C 3.46Å; L211-Q214 PolarHBondContact O-N 3.42Å; L211-Q214 VanDerWaalsContact O-N 3.09Å; L211-K215 PolarHBondContact O-N 3.18Å; L211-W371 HydrophobicContact CB-CZ2 3.95Å; L211-W371 HydrophobicContact CD2-CZ2 4.01Å; L211-W371 HydrophobicContact CG-CZ2 4.4Å; L211-W371 WeakPolarHBondContact O-CZ2 3.2Å; L211-A375 HydrophobicContact CB-CB 4.5Å; L211-A375 HydrophobicContact CD2-CB 3.88Å; L211-A748 HydrophobicContact CD2-CB 4.04Å; L211-T752 HydrophobicContact CD1-CG2 4.16Å; L211-T752 HydrophobicContact CD2-CG2 4.39Å
212	S	79	Confident	76.2	Confident	55 Å²	55	66.5 Å²	66.5	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-53.4	-47.3	-177.8	61.9	0	0	0	0	113.3	D210 Q214 K215 E216	D210-S212 PolarHBondContact O-N 3.37Å; D210-S212 WeakPolarHBondContact OD1-CB 3.08Å; D210-S212 PolarHBondContact OD1-N 2.86Å; D210-S212 PolarHBondContact OD1-OG 3.08Å; D210-S212 PolarHBondContact OD2-OG 3.47Å; S212-Q214 VanDerWaalsContact C-N 3.31Å; S212-Q214 PolarHBondContact O-N 3.12Å; S212-K215 WeakPolarHBondContact O-CB 3.47Å; S212-K215 PolarHBondContact O-N 3.3Å; S212-E216 PolarHBondContact O-N 3.23Å
213	K	79.8	Confident	76.8	Confident	151 Å²	151	65.3 Å²	65.3	66%	0.657	33%	0.329	S	S	*	.	H	α-helix	trans	-62.3	-39.7	177.8	-69.6	179.6	-178.6	171.3	0	112.2	L211 E216 R217	L211-K213 PolarHBondContact O-N 2.92Å; K213-E216 PolarHBondContact O-N 2.95Å; K213-R217 WeakPolarHBondContact O-CG 3.47Å; K213-R217 PolarHBondContact O-N 2.71Å; K213-R217 VanDerWaalsContact O-N 3.12Å
214	Q	80.2	Confident	77.7	Confident	37 Å²	37	70.9 Å²	70.9	17%	0.173	36%	0.359	C	S	.	.	H	α-helix	trans	-71.4	-36.8	178.9	-118.8	78.2	-16.5	0	0	110.7	L211 S212 R217 F218 W371 A748	L211-Q214 CarbonylContact O-C 3.46Å; L211-Q214 PolarHBondContact O-N 3.42Å; L211-Q214 VanDerWaalsContact O-N 3.09Å; S212-Q214 VanDerWaalsContact C-N 3.31Å; S212-Q214 PolarHBondContact O-N 3.12Å; Q214-R217 PolarHBondContact O-N 2.92Å; Q214-F218 WeakPolarHBondContact O-CB 3.35Å; Q214-F218 PolarHBondContact O-N 3Å; Q214-W371 HydrophobicContact CB-CH2 3.77Å; Q214-W371 HydrophobicContact CB-CZ2 3.99Å; Q214-W371 WeakPolarHBondContact O-CH2 3.23Å; Q214-A748 HydrophobicContact CB-CB 4.43Å; Q214-A748 HydrophobicContact CG-CB 4.05Å
215	K	84.7	Confident	78.6	Confident	57 Å²	57	67.5 Å²	67.5	25%	0.248	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-45.4	173.3	-169.2	176.8	-177.7	175.5	0	110.7	L211 S212 R217 F218 M219 D368 W371	L211-K215 PolarHBondContact O-N 3.18Å; S212-K215 WeakPolarHBondContact O-CB 3.47Å; S212-K215 PolarHBondContact O-N 3.3Å; K215-R217 VanDerWaalsContact C-N 3.33Å; K215-R217 PolarHBondContact O-N 3.3Å; K215-F218 WeakPolarHBondContact O-CB 3.11Å; K215-F218 PolarHBondContact O-N 3.36Å; K215-M219 HydrophobicContact CG-CG 4.42Å; K215-M219 VanDerWaalsContact O-CG 3.31Å; K215-M219 WeakPolarHBondContact O-CG 3.24Å; K215-M219 PolarHBondContact O-N 2.86Å; K215-D368 VanDerWaalsContact CE-OD1 3.3Å; K215-D368 WeakPolarHBondContact CE-OD1 3.25Å; K215-D368 IonicContact NZ-OD1 3.8Å; K215-D368 PolarHBondContact NZ-OD1 2.88Å; K215-W371 HydrophobicContact CB-CD2 3.99Å; K215-W371 HydrophobicContact CB-CG 4.43Å; K215-W371 HydrophobicContact CB-CH2 4.33Å; K215-W371 HydrophobicContact CB-CZ2 3.56Å; K215-W371 HydrophobicContact CD-CD2 4.45Å; K215-W371 HydrophobicContact CD-CG 4.01Å; K215-W371 HydrophobicContact CG-CD2 3.78Å; K215-W371 HydrophobicContact CG-CG 3.81Å; K215-W371 HydrophobicContact CG-CZ2 4.31Å; K215-W371 VanDerWaalsContact N-CH2 3.32Å
216	E	87.1	Confident	79.5	Confident	100 Å²	100	62.8 Å²	62.8	47%	0.467	32%	0.323	S	S	.	.	H	α-helix	trans	-60.2	-44.4	178.3	-172.8	-178.2	-173.3	0	0	111.4	S212 K213 M219 R220	S212-E216 PolarHBondContact O-N 3.23Å; K213-E216 PolarHBondContact O-N 2.95Å; E216-M219 PolarHBondContact O-N 3.22Å; E216-R220 WeakPolarHBondContact O-CG 3.33Å; E216-R220 PolarHBondContact O-N 2.98Å; E216-R220 IonicContact OE1-CZ 2.94Å; E216-R220 IonicContact OE1-NE 3.2Å; E216-R220 IonicContact OE1-NH2 3.08Å; E216-R220 PolarHBondContact OE1-NH2 3.45Å
217	R	87.2	Confident	80.8	Confident	134 Å²	134	65.3 Å²	65.3	51%	0.506	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-45.3	175.1	-72.8	178.5	179.4	-173.3	1.2	112.3	K213 Q214 K215 M219 R220 I221	K213-R217 WeakPolarHBondContact O-CG 3.47Å; K213-R217 PolarHBondContact O-N 2.71Å; K213-R217 VanDerWaalsContact O-N 3.12Å; Q214-R217 PolarHBondContact O-N 2.92Å; K215-R217 VanDerWaalsContact C-N 3.33Å; K215-R217 PolarHBondContact O-N 3.3Å; R217-M219 PolarHBondContact O-N 2.91Å; R217-R220 PolarHBondContact O-N 3.15Å; R217-I221 WeakPolarHBondContact O-CG1 3.48Å; R217-I221 PolarHBondContact O-N 3.3Å
218	F	86.1	Confident	82.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-57.6	-47.3	176.2	176.5	-92.9	0	0	0	111.7	Q214 K215 R220 I221 I222 L367 W371 L606 L741 L745	Q214-F218 WeakPolarHBondContact O-CB 3.35Å; Q214-F218 PolarHBondContact O-N 3Å; K215-F218 WeakPolarHBondContact O-CB 3.11Å; K215-F218 PolarHBondContact O-N 3.36Å; F218-R220 PolarHBondContact O-N 3.37Å; F218-I221 PolarHBondContact O-N 2.87Å; F218-I222 HydrophobicContact CE1-CG1 4.38Å; F218-I222 WeakPolarHBondContact O-CG1 3.41Å; F218-I222 PolarHBondContact O-N 3.48Å; F218-L367 HydrophobicContact CE1-CD2 3.77Å; F218-L367 HydrophobicContact CZ-CD2 4.02Å; F218-W371 HydrophobicContact CB-CE3 3.87Å; F218-W371 HydrophobicContact CB-CH2 4.23Å; F218-W371 HydrophobicContact CB-CZ3 3.46Å; F218-W371 VanDerWaalsContact CB-CZ3 3.46Å; F218-W371 AromaticContact CD1-CE3 3.77Å; F218-W371 HydrophobicContact CD1-CE3 3.77Å; F218-W371 HydrophobicContact CD1-CZ3 4.22Å; F218-W371 HydrophobicContact CD2-CE3 4.14Å; F218-W371 AromaticContact CD2-CZ3 3.97Å; F218-W371 HydrophobicContact CD2-CZ3 3.97Å; F218-W371 HydrophobicContact CE1-CE3 4.34Å; F218-W371 AromaticContact CG-CE3 3.66Å; F218-W371 HydrophobicContact CG-CE3 3.66Å; F218-W371 AromaticContact CG-CZ3 3.63Å; F218-W371 HydrophobicContact CG-CZ3 3.63Å; F218-L606 HydrophobicContact CE2-CD1 4.38Å; F218-L606 HydrophobicContact CZ-CD1 3.77Å; F218-L741 HydrophobicContact CD2-CD2 3.88Å; F218-L741 HydrophobicContact CE2-CD2 3.59Å; F218-L741 HydrophobicContact CZ-CD2 4.24Å; F218-L745 HydrophobicContact CD2-CD2 4.21Å; F218-L745 HydrophobicContact CE2-CD2 3.96Å; F218-L745 HydrophobicContact CE2-CG 4.32Å
219	M	88.9	Confident	84.4	Confident	43 Å²	43	58.1 Å²	58.1	21%	0.212	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-36.1	178.4	-66.3	-60	-107.9	0	0	112.5	K215 E216 R217 I222 D223 L367	K215-M219 HydrophobicContact CG-CG 4.42Å; K215-M219 VanDerWaalsContact O-CG 3.31Å; K215-M219 WeakPolarHBondContact O-CG 3.24Å; K215-M219 PolarHBondContact O-N 2.86Å; E216-M219 PolarHBondContact O-N 3.22Å; R217-M219 PolarHBondContact O-N 2.91Å; M219-I222 PolarHBondContact O-N 3.48Å; M219-D223 PolarHBondContact O-N 3.46Å; M219-L367 HydrophobicContact CE-CB 4.41Å; M219-L367 HydrophobicContact SD-CB 4.23Å; M219-L367 HydrophobicContact SD-CD1 4.49Å
220	R	90.1	Very high	85.9	Confident	141 Å²	141	58.9 Å²	58.9	53%	0.532	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-41.4	173.8	-75.2	-179.8	-170.3	175.3	1.6	112.7	E216 R217 F218 I222 D223 D224	E216-R220 WeakPolarHBondContact O-CG 3.33Å; E216-R220 PolarHBondContact O-N 2.98Å; E216-R220 IonicContact OE1-CZ 2.94Å; E216-R220 IonicContact OE1-NE 3.2Å; E216-R220 IonicContact OE1-NH2 3.08Å; E216-R220 PolarHBondContact OE1-NH2 3.45Å; R217-R220 PolarHBondContact O-N 3.15Å; F218-R220 PolarHBondContact O-N 3.37Å; R220-I222 VanDerWaalsContact C-N 3.25Å; R220-I222 PolarHBondContact O-N 2.95Å; R220-D223 PolarHBondContact O-N 2.93Å; R220-D224 PolarHBondContact O-N 3.21Å
221	I	89.3	Confident	87	Confident	29 Å²	29	58.6 Å²	58.6	15%	0.149	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-38.8	176.3	-71.1	178.4	0	0	0	111.1	R217 F218 G225 L737 L740 L741 E744	R217-I221 WeakPolarHBondContact O-CG1 3.48Å; R217-I221 PolarHBondContact O-N 3.3Å; F218-I221 PolarHBondContact O-N 2.87Å; I221-G225 PolarHBondContact O-N 3.34Å; I221-L737 HydrophobicContact CG2-CD2 3.93Å; I221-L737 WeakPolarHBondContact O-CD2 3.31Å; I221-L740 HydrophobicContact CD1-CB 4.4Å; I221-L740 HydrophobicContact CG2-CB 3.76Å; I221-L740 HydrophobicContact CG2-CD1 4.26Å; I221-L741 HydrophobicContact CB-CD2 4.49Å; I221-L741 HydrophobicContact CG2-CD2 3.84Å; I221-L741 HydrophobicContact CG2-CG 4.48Å; I221-E744 HydrophobicContact CD1-CB 4.36Å; I221-E744 HydrophobicContact CD1-CG 3.21Å
222	I	89	Confident	87.9	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-48	174.8	-64.8	-70.2	0	0	0	110.4	F218 M219 R220 D224 G225 L226 I363 L367 L737 L741	F218-I222 HydrophobicContact CE1-CG1 4.38Å; F218-I222 WeakPolarHBondContact O-CG1 3.41Å; F218-I222 PolarHBondContact O-N 3.48Å; M219-I222 PolarHBondContact O-N 3.48Å; R220-I222 VanDerWaalsContact C-N 3.25Å; R220-I222 PolarHBondContact O-N 2.95Å; I222-D224 PolarHBondContact O-N 3.44Å; I222-G225 CarbonylContact O-C 3.31Å; I222-G225 PolarHBondContact O-N 2.89Å; I222-G225 VanDerWaalsContact O-N 3.14Å; I222-L226 HydrophobicContact CG2-CD1 3.98Å; I222-L226 HydrophobicContact CG2-CG 4.21Å; I222-L226 VanDerWaalsContact O-CG 3.28Å; I222-L226 WeakPolarHBondContact O-CG 3.44Å; I222-L226 PolarHBondContact O-N 3.41Å; I222-I363 HydrophobicContact CG2-CD1 4.49Å; I222-L367 HydrophobicContact CD1-CD2 3.75Å; I222-L367 HydrophobicContact CG1-CD2 3.78Å; I222-L367 HydrophobicContact CG2-CD1 3.78Å; I222-L367 HydrophobicContact CG2-CD2 4.41Å; I222-L737 HydrophobicContact CD1-CD2 4.44Å; I222-L741 HydrophobicContact CD1-CD1 3.87Å; I222-L741 HydrophobicContact CD1-CD2 3.66Å; I222-L741 HydrophobicContact CD1-CG 4.35Å; I222-L741 HydrophobicContact CG1-CD2 4.08Å
223	D	90.5	Very high	88.6	Confident	51 Å²	51	56.1 Å²	56.1	27%	0.273	27%	0.266	S	S	.	.	H	α-helix	trans	-57.5	-49.4	179.5	-74.3	-14.6	0	0	0	112.1	M219 R220 G225 L226 V227 K360	M219-D223 PolarHBondContact O-N 3.46Å; R220-D223 PolarHBondContact O-N 2.93Å; D223-G225 VanDerWaalsContact C-N 3.3Å; D223-G225 PolarHBondContact O-N 3.01Å; D223-L226 PolarHBondContact O-N 3.31Å; D223-V227 WeakPolarHBondContact O-CG2 3.44Å; D223-V227 PolarHBondContact O-N 2.99Å; D223-K360 VanDerWaalsContact OD1-CD 3.27Å; D223-K360 WeakPolarHBondContact OD1-CD 3.43Å; D223-K360 WeakPolarHBondContact OD1-CE 3.31Å; D223-K360 IonicContact OD1-NZ 2.84Å; D223-K360 PolarHBondContact OD1-NZ 3.07Å; D223-K360 IonicContact OD2-NZ 3.13Å; D223-K360 PolarHBondContact OD2-NZ 3.29Å
224	D	90.6	Very high	89.2	Confident	118 Å²	118	49.9 Å²	49.9	63%	0.631	24%	0.241	S	C	*	.	H	α-helix	trans	-62.2	-39.5	176.3	-68.1	-14.9	0	0	0	111.5	R220 I222 L226 V227 S228	R220-D224 PolarHBondContact O-N 3.21Å; I222-D224 PolarHBondContact O-N 3.44Å; D224-L226 VanDerWaalsContact C-N 3.33Å; D224-L226 PolarHBondContact O-N 3.05Å; D224-V227 PolarHBondContact O-N 3Å; D224-S228 PolarHBondContact O-N 3.43Å
225	G	89.4	Confident	89.7	Confident	13 Å²	13	55.8 Å²	55.8	13%	0.134	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-34.9	176.4	0	0	0	0	0	113.4	I221 I222 D223 S228 F229	I221-G225 PolarHBondContact O-N 3.34Å; I222-G225 CarbonylContact O-C 3.31Å; I222-G225 PolarHBondContact O-N 2.89Å; I222-G225 VanDerWaalsContact O-N 3.14Å; D223-G225 VanDerWaalsContact C-N 3.3Å; D223-G225 PolarHBondContact O-N 3.01Å; G225-S228 PolarHBondContact O-N 3.31Å; G225-F229 WeakPolarHBondContact O-CB 3.44Å; G225-F229 PolarHBondContact O-N 3.05Å
226	L	90.1	Very high	90	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-73.7	-36.7	177.4	-70	-178.4	0	0	0	112.4	I222 D223 D224 F229 E230 A356 V359 K360 F610	I222-L226 HydrophobicContact CG2-CD1 3.98Å; I222-L226 HydrophobicContact CG2-CG 4.21Å; I222-L226 VanDerWaalsContact O-CG 3.28Å; I222-L226 WeakPolarHBondContact O-CG 3.44Å; I222-L226 PolarHBondContact O-N 3.41Å; D223-L226 PolarHBondContact O-N 3.31Å; D224-L226 VanDerWaalsContact C-N 3.33Å; D224-L226 PolarHBondContact O-N 3.05Å; L226-F229 WeakPolarHBondContact O-CB 3.34Å; L226-F229 PolarHBondContact O-N 2.93Å; L226-E230 PolarHBondContact O-N 2.74Å; L226-A356 HydrophobicContact CB-CB 4.32Å; L226-V359 HydrophobicContact CD1-CG1 4.41Å; L226-V359 HydrophobicContact CD2-CB 4.2Å; L226-V359 HydrophobicContact CD2-CG1 3.36Å; L226-K360 HydrophobicContact CD1-CB 3.52Å; L226-K360 HydrophobicContact CD1-CG 4.07Å; L226-F610 HydrophobicContact CD2-CE2 3.91Å
227	V	90.1	Very high	90.3	Very high	75 Å²	75	51.2 Å²	51.2	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-47.9	169.8	174.6	0	0	0	0	110	D223 D224 F229 E230 E231	D223-V227 WeakPolarHBondContact O-CG2 3.44Å; D223-V227 PolarHBondContact O-N 2.99Å; D224-V227 PolarHBondContact O-N 3Å; V227-F229 VanDerWaalsContact C-N 3.26Å; V227-F229 PolarHBondContact O-N 3.42Å; V227-E230 PolarHBondContact O-N 2.86Å; V227-E230 VanDerWaalsContact O-N 3.15Å; V227-E231 WeakPolarHBondContact O-CG 3.36Å; V227-E231 PolarHBondContact O-N 3.46Å
228	S	90.3	Very high	90.5	Very high	32 Å²	32	49.2 Å²	49.2	22%	0.224	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-35.3	176.7	-170.4	0	0	0	0	112.6	D224 G225 D232 K736	D224-S228 PolarHBondContact O-N 3.43Å; G225-S228 PolarHBondContact O-N 3.31Å; S228-D232 WeakPolarHBondContact O-CB 3.26Å; S228-D232 PolarHBondContact O-N 2.88Å; S228-K736 PolarHBondContact OG-NZ 3.05Å
229	F	91	Very high	90.8	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-44	174.3	169	-97.5	0	0	0	112.1	G225 L226 V227 D232 F233 L355 V359 F610 L615 M730	G225-F229 WeakPolarHBondContact O-CB 3.44Å; G225-F229 PolarHBondContact O-N 3.05Å; L226-F229 WeakPolarHBondContact O-CB 3.34Å; L226-F229 PolarHBondContact O-N 2.93Å; V227-F229 VanDerWaalsContact C-N 3.26Å; V227-F229 PolarHBondContact O-N 3.42Å; F229-D232 PolarHBondContact O-N 2.9Å; F229-F233 VanDerWaalsContact O-CB 3.28Å; F229-F233 WeakPolarHBondContact O-CB 3.5Å; F229-F233 PolarHBondContact O-N 3.07Å; F229-L355 HydrophobicContact CE1-CD1 4.28Å; F229-L355 HydrophobicContact CE1-CD2 3.92Å; F229-L355 HydrophobicContact CE1-CG 4.05Å; F229-V359 HydrophobicContact CE1-CG2 4.12Å; F229-F610 HydrophobicContact CD2-CE1 4.45Å; F229-F610 AromaticContact CD2-CZ 3.81Å; F229-F610 HydrophobicContact CD2-CZ 3.81Å; F229-F610 HydrophobicContact CE2-CE1 4.36Å; F229-F610 AromaticContact CE2-CZ 3.9Å; F229-F610 HydrophobicContact CE2-CZ 3.9Å; F229-F610 HydrophobicContact CG-CZ 4.13Å; F229-F610 HydrophobicContact CZ-CZ 4.31Å; F229-L615 HydrophobicContact CE1-CD1 3.92Å; F229-L615 HydrophobicContact CZ-CD1 3.48Å; F229-L615 VanDerWaalsContact CZ-CD1 3.48Å; F229-M730 HydrophobicContact CE2-CB 4.49Å
230	E	90.8	Very high	91.1	Very high	40 Å²	40	51.3 Å²	51.3	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-42.6	176.7	-177.4	177.1	102.7	0	0	111.8	L226 V227 F233 T234 L355 A356	L226-E230 PolarHBondContact O-N 2.74Å; V227-E230 PolarHBondContact O-N 2.86Å; V227-E230 VanDerWaalsContact O-N 3.15Å; E230-F233 PolarHBondContact O-N 3.01Å; E230-T234 WeakPolarHBondContact O-CB 3.11Å; E230-T234 PolarHBondContact O-N 2.83Å; E230-T234 PolarHBondContact O-OG1 3.48Å; E230-L355 HydrophobicContact CG-CB 4.31Å; E230-L355 HydrophobicContact CG-CD2 4.49Å; E230-A356 HydrophobicContact CB-CB 4.2Å; E230-A356 VanDerWaalsContact OE2-CB 3.25Å; E230-A356 WeakPolarHBondContact OE2-CB 3.48Å; E230-A356 PolarHBondContact OE2-N 2.97Å
231	E	90.8	Very high	91.3	Very high	126 Å²	126	48 Å²	48	59%	0.589	25%	0.249	S	C	*	.	H	α-helix	trans	-62.5	-47.4	174.8	-69.4	177.6	168.5	0	0	112	V227 F233 T234 K235	V227-E231 WeakPolarHBondContact O-CG 3.36Å; V227-E231 PolarHBondContact O-N 3.46Å; E231-F233 VanDerWaalsContact C-N 3.33Å; E231-F233 PolarHBondContact O-N 3.08Å; E231-T234 PolarHBondContact O-N 3.46Å; E231-K235 WeakPolarHBondContact O-CB 3.47Å; E231-K235 PolarHBondContact O-N 3.12Å
232	D	91.3	Very high	91.6	Very high	17 Å²	17	46.7 Å²	46.7	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-41.3	177	-90	-40	0	0	0	111.2	S228 F229 K235 L236 R732 K736	S228-D232 WeakPolarHBondContact O-CB 3.26Å; S228-D232 PolarHBondContact O-N 2.88Å; F229-D232 PolarHBondContact O-N 2.9Å; D232-K235 PolarHBondContact O-N 3.45Å; D232-L236 VanDerWaalsContact O-CB 3.27Å; D232-L236 WeakPolarHBondContact O-CB 3.37Å; D232-L236 VanDerWaalsContact O-CG 3.27Å; D232-L236 WeakPolarHBondContact O-CG 3.23Å; D232-L236 PolarHBondContact O-N 3.31Å; D232-R732 WeakPolarHBondContact OD1-CD 3.5Å; D232-R732 IonicContact OD1-CZ 2.76Å; D232-R732 IonicContact OD1-NH1 2.66Å; D232-R732 PolarHBondContact OD1-NH1 3.27Å; D232-R732 WeakPolarHBondContact OD2-CD 3.28Å; D232-K736 IonicContact OD1-NZ 2.76Å; D232-K736 IonicContact OD2-NZ 3.77Å; D232-K736 PolarHBondContact OD2-NZ 3.2Å
233	F	92.7	Very high	91.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63	-49	175.1	180	-98	0	0	0	112	F229 E230 E231 K235 L236 S237 L355 F619 Y718 L722 V726 S729	F229-F233 VanDerWaalsContact O-CB 3.28Å; F229-F233 WeakPolarHBondContact O-CB 3.5Å; F229-F233 PolarHBondContact O-N 3.07Å; E230-F233 PolarHBondContact O-N 3.01Å; E231-F233 VanDerWaalsContact C-N 3.33Å; E231-F233 PolarHBondContact O-N 3.08Å; F233-K235 VanDerWaalsContact C-N 3.26Å; F233-K235 PolarHBondContact O-N 3.25Å; F233-L236 PolarHBondContact O-N 2.88Å; F233-S237 VanDerWaalsContact O-CB 3.23Å; F233-S237 WeakPolarHBondContact O-CB 3.39Å; F233-S237 PolarHBondContact O-N 3.37Å; F233-S237 PolarHBondContact O-OG 2.89Å; F233-L355 HydrophobicContact CB-CD2 3.95Å; F233-L355 HydrophobicContact CD1-CD2 3.33Å; F233-L355 HydrophobicContact CE1-CD2 3.95Å; F233-L355 HydrophobicContact CG-CD2 3.68Å; F233-F619 HydrophobicContact CD1-CZ 4.44Å; F233-F619 AromaticContact CE1-CE1 3.97Å; F233-F619 HydrophobicContact CE1-CE1 3.97Å; F233-F619 AromaticContact CE1-CE2 3.88Å; F233-F619 HydrophobicContact CE1-CE2 3.88Å; F233-F619 AromaticContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CE1-CZ 3.48Å; F233-F619 VanDerWaalsContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CZ-CD2 4.43Å; F233-F619 HydrophobicContact CZ-CE1 4.42Å; F233-F619 HydrophobicContact CZ-CE2 4.03Å; F233-F619 HydrophobicContact CZ-CZ 4.03Å; F233-Y718 WeakPolarHBondContact CE1-OH 3.32Å; F233-Y718 WeakPolarHBondContact CZ-OH 3.47Å; F233-L722 HydrophobicContact CE2-CD1 4.46Å; F233-L722 HydrophobicContact CZ-CD1 4.02Å; F233-V726 HydrophobicContact CE2-CG2 3.68Å; F233-V726 HydrophobicContact CZ-CG2 4.38Å; F233-S729 VanDerWaalsContact CA-OG 3.26Å; F233-S729 WeakPolarHBondContact CA-OG 3.29Å
234	T	92.4	Very high	92.2	Very high	21 Å²	21	49.7 Å²	49.7	13%	0.129	26%	0.26	C	S	.	.	H	α-helix	trans	-57.2	-42.4	178.2	-60.7	0	0	0	0	111	E230 E231 Q238 A239 N240	E230-T234 WeakPolarHBondContact O-CB 3.11Å; E230-T234 PolarHBondContact O-N 2.83Å; E230-T234 PolarHBondContact O-OG1 3.48Å; E231-T234 PolarHBondContact O-N 3.46Å; T234-Q238 PolarHBondContact O-N 3.4Å; T234-A239 HydrophobicContact CG2-CB 4.25Å; T234-A239 PolarHBondContact O-N 3.44Å; T234-A239 VanDerWaalsContact O-N 3.14Å; T234-N240 WeakPolarHBondContact CG2-OD1 3.39Å
235	K	92	Very high	92.6	Very high	161 Å²	161	44.4 Å²	44.4	70%	0.7	23%	0.233	S	C	*	.	H	α-helix	trans	-69.6	-49.2	177.8	-173.5	174.8	-178.6	174.2	0	113.2	E231 D232 F233 Q238	E231-K235 WeakPolarHBondContact O-CB 3.47Å; E231-K235 PolarHBondContact O-N 3.12Å; D232-K235 PolarHBondContact O-N 3.45Å; F233-K235 VanDerWaalsContact C-N 3.26Å; F233-K235 PolarHBondContact O-N 3.25Å; K235-Q238 PolarHBondContact O-N 3.37Å
236	L	91.4	Very high	93	Very high	58 Å²	58	43.9 Å²	43.9	30%	0.304	23%	0.227	S	C	.	.	H	α-helix	trans	-72	-31.4	-176	-73	172.9	0	0	0	113	D232 F233 Q238 S725 S729	D232-L236 VanDerWaalsContact O-CB 3.27Å; D232-L236 WeakPolarHBondContact O-CB 3.37Å; D232-L236 VanDerWaalsContact O-CG 3.27Å; D232-L236 WeakPolarHBondContact O-CG 3.23Å; D232-L236 PolarHBondContact O-N 3.31Å; F233-L236 PolarHBondContact O-N 2.88Å; L236-Q238 VanDerWaalsContact C-N 3.32Å; L236-S725 PolarHBondContact O-OG 3.31Å; L236-S729 WeakPolarHBondContact CD1-OG 3.39Å
237	S	91.6	Very high	93.3	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-83.5	-8.6	176	67.2	0	0	0	0	113.2	F233 A239 Y718 S725	F233-S237 VanDerWaalsContact O-CB 3.23Å; F233-S237 WeakPolarHBondContact O-CB 3.39Å; F233-S237 PolarHBondContact O-N 3.37Å; F233-S237 PolarHBondContact O-OG 2.89Å; S237-A239 PolarHBondContact O-N 2.85Å; S237-Y718 VanDerWaalsContact CB-CE2 3.46Å; S237-Y718 WeakPolarHBondContact O-CD2 3.37Å; S237-Y718 WeakPolarHBondContact O-CE2 3.31Å; S237-Y718 WeakPolarHBondContact OG-CE2 3.31Å; S237-S725 WeakPolarHBondContact CA-OG 3.41Å
238	Q	91.8	Very high	93.5	Very high	92 Å²	92	43.2 Å²	43.2	43%	0.43	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	35.1	-172.7	-58.6	175	39.9	0	0	112.2	T234 K235 L236 N240 N241	T234-Q238 PolarHBondContact O-N 3.4Å; K235-Q238 PolarHBondContact O-N 3.37Å; L236-Q238 VanDerWaalsContact C-N 3.32Å; Q238-N240 PolarHBondContact O-N 2.94Å; Q238-N240 VanDerWaalsContact O-N 3.16Å; Q238-N241 WeakPolarHBondContact O-CB 3.47Å; Q238-N241 PolarHBondContact O-N 3.14Å; Q238-N241 PolarHBondContact OE1-ND2 3.4Å; Q238-N241 VanDerWaalsContact OE1-ND2 3.14Å
239	A	93.3	Very high	93.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-32	-177	0	0	0	0	0	112.4	T234 S237 N241 V242 S243 F348 I352 Y718	T234-A239 HydrophobicContact CG2-CB 4.25Å; T234-A239 PolarHBondContact O-N 3.44Å; T234-A239 VanDerWaalsContact O-N 3.14Å; S237-A239 PolarHBondContact O-N 2.85Å; A239-N241 VanDerWaalsContact C-N 3.29Å; A239-N241 PolarHBondContact O-N 2.94Å; A239-V242 WeakPolarHBondContact O-CB 3.21Å; A239-V242 PolarHBondContact O-N 2.97Å; A239-V242 VanDerWaalsContact O-N 3.11Å; A239-S243 PolarHBondContact O-N 2.97Å; A239-F348 HydrophobicContact CB-CZ 4.49Å; A239-I352 HydrophobicContact CB-CD1 3.62Å; A239-I352 HydrophobicContact CB-CG1 4.29Å; A239-Y718 HydrophobicContact CB-CE2 3.78Å
240	N	93.9	Very high	94.1	Very high	86 Å²	86	41.8 Å²	41.8	46%	0.46	22%	0.22	S	C	.	.	H	α-helix	trans	-57.4	-39	175.1	-67.2	-11.6	0	0	0	112.5	T234 Q238 V242 S243 D244	T234-N240 WeakPolarHBondContact CG2-OD1 3.39Å; Q238-N240 PolarHBondContact O-N 2.94Å; Q238-N240 VanDerWaalsContact O-N 3.16Å; N240-V242 PolarHBondContact O-N 3.34Å; N240-S243 PolarHBondContact O-N 3.45Å; N240-D244 WeakPolarHBondContact O-CB 3.22Å; N240-D244 PolarHBondContact O-N 3.41Å
241	N	95.2	Very high	94.4	Very high	71 Å²	71	43.6 Å²	43.6	38%	0.38	23%	0.234	S	C	.	.	H	α-helix	trans	-62.9	-35.5	179	-65.4	-5.5	0	0	0	111.8	Q238 A239 A245	Q238-N241 WeakPolarHBondContact O-CB 3.47Å; Q238-N241 PolarHBondContact O-N 3.14Å; Q238-N241 PolarHBondContact OE1-ND2 3.4Å; Q238-N241 VanDerWaalsContact OE1-ND2 3.14Å; A239-N241 VanDerWaalsContact C-N 3.29Å; A239-N241 PolarHBondContact O-N 2.94Å; N241-A245 VanDerWaalsContact O-CB 3.3Å; N241-A245 WeakPolarHBondContact O-CB 3.33Å; N241-A245 PolarHBondContact O-N 3.24Å
242	V	96	Very high	94.5	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-72.8	-47.5	175.5	-177	0	0	0	0	110.3	A239 N240 D244 A245 I246 F348 N714 L715 Y718	A239-V242 WeakPolarHBondContact O-CB 3.21Å; A239-V242 PolarHBondContact O-N 2.97Å; A239-V242 VanDerWaalsContact O-N 3.11Å; N240-V242 PolarHBondContact O-N 3.34Å; V242-D244 VanDerWaalsContact C-N 3.33Å; V242-D244 PolarHBondContact O-N 3.13Å; V242-A245 PolarHBondContact O-N 2.83Å; V242-I246 HydrophobicContact CG1-CD1 3.85Å; V242-I246 HydrophobicContact CG1-CG1 4.44Å; V242-I246 WeakPolarHBondContact O-CB 3.38Å; V242-I246 WeakPolarHBondContact O-CG1 3.07Å; V242-I246 PolarHBondContact O-N 3.29Å; V242-F348 HydrophobicContact CB-CD1 4.27Å; V242-F348 HydrophobicContact CB-CE1 3.45Å; V242-F348 VanDerWaalsContact CB-CE1 3.45Å; V242-F348 HydrophobicContact CB-CE2 4.4Å; V242-F348 HydrophobicContact CB-CZ 3.55Å; V242-F348 HydrophobicContact CG1-CD1 3.82Å; V242-F348 HydrophobicContact CG1-CD2 4.21Å; V242-F348 HydrophobicContact CG1-CE1 3.42Å; V242-F348 VanDerWaalsContact CG1-CE1 3.42Å; V242-F348 HydrophobicContact CG1-CE2 3.86Å; V242-F348 HydrophobicContact CG1-CG 4.2Å; V242-F348 HydrophobicContact CG1-CZ 3.46Å; V242-F348 VanDerWaalsContact CG1-CZ 3.46Å; V242-F348 HydrophobicContact CG2-CE1 4.39Å; V242-F348 HydrophobicContact CG2-CZ 4.01Å; V242-N714 HydrophobicContact CG2-CB 4.12Å; V242-L715 HydrophobicContact CG1-CD2 3.61Å; V242-L715 HydrophobicContact CG1-CG 3.87Å; V242-Y718 HydrophobicContact CG2-CD2 3.81Å; V242-Y718 HydrophobicContact CG2-CG 3.9Å
243	S	95.8	Very high	94.7	Very high	18 Å²	18	37 Å²	37	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-54.8	-47.3	176.6	171.3	0	0	0	0	111.9	A239 N240 I246 S247 N349	A239-S243 PolarHBondContact O-N 2.97Å; N240-S243 PolarHBondContact O-N 3.45Å; S243-I246 PolarHBondContact O-N 3.1Å; S243-S247 VanDerWaalsContact O-CB 3.25Å; S243-S247 WeakPolarHBondContact O-CB 3.49Å; S243-S247 PolarHBondContact O-N 3.39Å; S243-S247 PolarHBondContact O-OG 3.44Å; S243-N349 WeakPolarHBondContact CB-OD1 3.48Å; S243-N349 PolarHBondContact OG-ND2 3.45Å; S243-N349 PolarHBondContact OG-OD1 3.39Å; S243-N349 VanDerWaalsContact OG-OD1 3.04Å
244	D	96.8	Very high	94.9	Very high	103 Å²	103	41 Å²	41	55%	0.551	22%	0.218	S	C	*	.	H	α-helix	trans	-68.8	-40.4	-177.6	-66.3	-16.5	0	0	0	111.1	N240 V242 S247 G248	N240-D244 WeakPolarHBondContact O-CB 3.22Å; N240-D244 PolarHBondContact O-N 3.41Å; V242-D244 VanDerWaalsContact C-N 3.33Å; V242-D244 PolarHBondContact O-N 3.13Å; D244-S247 PolarHBondContact O-N 3.42Å; D244-G248 PolarHBondContact O-N 3.17Å
245	A	97.2	Very high	95	Very high	8 Å²	8	41.1 Å²	41.1	7%	0.066	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-43.4	175.8	0	0	0	0	0	112	N241 V242 F249 A711	N241-A245 VanDerWaalsContact O-CB 3.3Å; N241-A245 WeakPolarHBondContact O-CB 3.33Å; N241-A245 PolarHBondContact O-N 3.24Å; V242-A245 PolarHBondContact O-N 2.83Å; A245-F249 PolarHBondContact O-N 3.11Å; A245-F249 VanDerWaalsContact O-N 3.1Å; A245-A711 HydrophobicContact CB-CB 4.08Å
246	I	97.6	Very high	95.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-49.2	174.3	-73.8	174.3	0	0	0	110.4	V242 S243 G248 F249 Q250 L345 F348 F630 A711 L715	V242-I246 HydrophobicContact CG1-CD1 3.85Å; V242-I246 HydrophobicContact CG1-CG1 4.44Å; V242-I246 WeakPolarHBondContact O-CB 3.38Å; V242-I246 WeakPolarHBondContact O-CG1 3.07Å; V242-I246 PolarHBondContact O-N 3.29Å; S243-I246 PolarHBondContact O-N 3.1Å; I246-G248 VanDerWaalsContact C-N 3.31Å; I246-G248 PolarHBondContact O-N 3.16Å; I246-F249 PolarHBondContact O-N 3.32Å; I246-Q250 HydrophobicContact CG2-CG 4.19Å; I246-Q250 WeakPolarHBondContact O-CB 3.31Å; I246-Q250 VanDerWaalsContact O-CG 3.29Å; I246-Q250 WeakPolarHBondContact O-CG 3.26Å; I246-Q250 PolarHBondContact O-N 2.89Å; I246-L345 HydrophobicContact CG2-CB 3.57Å; I246-L345 HydrophobicContact CG2-CD1 4.42Å; I246-F348 HydrophobicContact CD1-CB 3.95Å; I246-F348 HydrophobicContact CD1-CD1 4.25Å; I246-F348 HydrophobicContact CD1-CG 4.12Å; I246-F630 HydrophobicContact CG1-CZ 4.47Å; I246-A711 HydrophobicContact CG1-CB 4.34Å; I246-L715 HydrophobicContact CD1-CD2 4.48Å
247	S	96.5	Very high	95.4	Very high	39 Å²	39	32.2 Å²	32.2	27%	0.273	18%	0.182	S	C	.	.	H	α-helix	trans	-63.3	-38.4	-177.9	-59.9	0	0	0	0	111.7	S243 D244 T251	S243-S247 VanDerWaalsContact O-CB 3.25Å; S243-S247 WeakPolarHBondContact O-CB 3.49Å; S243-S247 PolarHBondContact O-N 3.39Å; S243-S247 PolarHBondContact O-OG 3.44Å; D244-S247 PolarHBondContact O-N 3.42Å; S247-T251 WeakPolarHBondContact O-CB 3.41Å; S247-T251 PolarHBondContact O-N 2.98Å; S247-T251 PolarHBondContact O-OG1 3.44Å
248	G	95.6	Very high	95.5	Very high	26 Å²	26	34 Å²	34	27%	0.268	19%	0.193	S	C	.	.	H	α-helix	trans	-61	-50.7	174	0	0	0	0	0	112.1	D244 I246 T251 S252 Q707	D244-G248 PolarHBondContact O-N 3.17Å; I246-G248 VanDerWaalsContact C-N 3.31Å; I246-G248 PolarHBondContact O-N 3.16Å; G248-T251 PolarHBondContact O-N 3Å; G248-S252 PolarHBondContact O-N 3.41Å; G248-S252 PolarHBondContact O-OG 3.33Å; G248-Q707 PolarHBondContact O-OE1 3.19Å
249	F	96.9	Very high	95.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.3	-50.1	175.5	168	-100.6	0	0	0	112	A245 I246 T251 S252 A253 V342 L345 F630 L633 L636 I704 Q707 M708	A245-F249 PolarHBondContact O-N 3.11Å; A245-F249 VanDerWaalsContact O-N 3.1Å; I246-F249 PolarHBondContact O-N 3.32Å; F249-T251 VanDerWaalsContact C-N 3.31Å; F249-T251 PolarHBondContact O-N 3.45Å; F249-S252 PolarHBondContact O-N 3.37Å; F249-A253 HydrophobicContact CZ-CB 4.44Å; F249-A253 WeakPolarHBondContact O-CB 3.41Å; F249-A253 PolarHBondContact O-N 2.66Å; F249-V342 HydrophobicContact CE1-CG2 4.35Å; F249-L345 HydrophobicContact CD1-CD1 3.73Å; F249-L345 HydrophobicContact CE1-CD1 3.78Å; F249-F630 AromaticContact CD1-CE1 3.71Å; F249-F630 HydrophobicContact CD1-CE1 3.71Å; F249-F630 HydrophobicContact CD1-CZ 4.25Å; F249-F630 HydrophobicContact CE1-CD1 4.48Å; F249-F630 AromaticContact CE1-CE1 3.75Å; F249-F630 HydrophobicContact CE1-CE1 3.75Å; F249-F630 HydrophobicContact CG-CE1 4.17Å; F249-F630 HydrophobicContact CZ-CE1 4.22Å; F249-L633 HydrophobicContact CE1-CD1 3.9Å; F249-L633 HydrophobicContact CZ-CD1 3.92Å; F249-L636 HydrophobicContact CE2-CD1 3.75Å; F249-L636 HydrophobicContact CZ-CD1 3.73Å; F249-I704 HydrophobicContact CD2-CG2 4.23Å; F249-I704 HydrophobicContact CE2-CG2 3.81Å; F249-Q707 HydrophobicContact CB-CB 4.25Å; F249-M708 HydrophobicContact CD2-CB 3.73Å; F249-M708 HydrophobicContact CD2-CG 4.29Å; F249-M708 HydrophobicContact CE2-CB 3.7Å; F249-M708 HydrophobicContact CE2-CG 3.94Å; F249-M708 HydrophobicContact CE2-SD 4.36Å; F249-M708 HydrophobicContact CZ-CG 4.39Å
250	Q	96.3	Very high	95.6	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.019	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-41.6	-179.6	-72.4	178.5	-52.4	0	0	112	I246 S252 A253 R254 V342 L345 N346	I246-Q250 HydrophobicContact CG2-CG 4.19Å; I246-Q250 WeakPolarHBondContact O-CB 3.31Å; I246-Q250 VanDerWaalsContact O-CG 3.29Å; I246-Q250 WeakPolarHBondContact O-CG 3.26Å; I246-Q250 PolarHBondContact O-N 2.89Å; Q250-S252 VanDerWaalsContact C-N 3.35Å; Q250-A253 PolarHBondContact O-N 2.94Å; Q250-R254 WeakPolarHBondContact O-CB 3.3Å; Q250-R254 WeakPolarHBondContact O-CG 3.37Å; Q250-R254 PolarHBondContact O-N 3.34Å; Q250-V342 HydrophobicContact CB-CG1 4.18Å; Q250-V342 HydrophobicContact CG-CG1 3.87Å; Q250-V342 PolarHBondContact NE2-O 3.5Å; Q250-L345 HydrophobicContact CG-CB 4.48Å; Q250-L345 HydrophobicContact CG-CD1 4.23Å; Q250-N346 VanDerWaalsContact NE2-CG 3.27Å; Q250-N346 PolarHBondContact NE2-ND2 3.13Å; Q250-N346 PolarHBondContact NE2-OD1 3.25Å; Q250-N346 PolarHBondContact OE1-OD1 2.97Å; Q250-N346 VanDerWaalsContact OE1-OD1 3.07Å
251	T	96.8	Very high	95.7	Very high	79 Å²	79	37.3 Å²	37.3	49%	0.485	23%	0.229	S	C	.	.	H	α-helix	trans	-62.3	-41.9	177.7	-64	0	0	0	0	111.7	S247 G248 F249 A255 R700	S247-T251 WeakPolarHBondContact O-CB 3.41Å; S247-T251 PolarHBondContact O-N 2.98Å; S247-T251 PolarHBondContact O-OG1 3.44Å; G248-T251 PolarHBondContact O-N 3Å; F249-T251 VanDerWaalsContact C-N 3.31Å; F249-T251 PolarHBondContact O-N 3.45Å; T251-A255 WeakPolarHBondContact O-CB 3.45Å; T251-A255 PolarHBondContact O-N 3.5Å; T251-R700 PolarHBondContact O-NH2 3.29Å
252	S	94.4	Very high	95.6	Very high	5 Å²	5	34.3 Å²	34.3	4%	0.035	21%	0.214	C	C	.	.	H	α-helix	trans	-70.3	-45.6	175.8	-61.3	0	0	0	0	112.1	G248 F249 Q250 R254 A255 F256 Q707	G248-S252 PolarHBondContact O-N 3.41Å; G248-S252 PolarHBondContact O-OG 3.33Å; F249-S252 PolarHBondContact O-N 3.37Å; Q250-S252 VanDerWaalsContact C-N 3.35Å; S252-R254 PolarHBondContact O-N 2.93Å; S252-A255 WeakPolarHBondContact O-CB 3.3Å; S252-A255 PolarHBondContact O-N 3.43Å; S252-A255 VanDerWaalsContact O-N 3.16Å; S252-F256 VanDerWaalsContact O-CD2 3.29Å; S252-F256 WeakPolarHBondContact O-CD2 3.21Å; S252-Q707 PolarHBondContact OG-NE2 3.05Å; S252-Q707 PolarHBondContact OG-OE1 3.45Å
253	A	95.1	Very high	95.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.4	-46.3	178.4	0	0	0	0	0	111.9	F249 Q250 A255 F256 I335 V342	F249-A253 HydrophobicContact CZ-CB 4.44Å; F249-A253 WeakPolarHBondContact O-CB 3.41Å; F249-A253 PolarHBondContact O-N 2.66Å; Q250-A253 PolarHBondContact O-N 2.94Å; A253-A255 VanDerWaalsContact C-N 3.3Å; A253-A255 PolarHBondContact O-N 2.98Å; A253-F256 PolarHBondContact O-N 3.05Å; A253-I335 HydrophobicContact CB-CG2 4.24Å; A253-V342 HydrophobicContact CB-CG1 4.32Å
254	R	95.8	Very high	95.5	Very high	83 Å²	83	37 Å²	37	31%	0.313	24%	0.235	S	C	.	.	H	α-helix	trans	-65.9	-30.6	178.3	-69.9	-169.4	-167.1	100.7	5.3	113.1	Q250 S252 F256 L257 L339 D343	Q250-R254 WeakPolarHBondContact O-CB 3.3Å; Q250-R254 WeakPolarHBondContact O-CG 3.37Å; Q250-R254 PolarHBondContact O-N 3.34Å; S252-R254 PolarHBondContact O-N 2.93Å; R254-F256 PolarHBondContact O-N 2.71Å; R254-L257 HydrophobicContact CB-CD1 4.25Å; R254-L257 HydrophobicContact CG-CD1 4.25Å; R254-L257 PolarHBondContact O-N 2.85Å; R254-L339 HydrophobicContact CG-CD1 4.37Å; R254-D343 IonicContact CZ-OD1 3.56Å; R254-D343 IonicContact NE-OD1 3.1Å; R254-D343 PolarHBondContact NE-OD1 3.16Å; R254-D343 IonicContact NH2-OD1 3.64Å; R254-D343 PolarHBondContact NH2-OD1 3.11Å
255	A	96	Very high	95.3	Very high	23 Å²	23	35 Å²	35	19%	0.19	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-20	177.7	0	0	0	0	0	113.3	T251 S252 A253 S260 A262	T251-A255 WeakPolarHBondContact O-CB 3.45Å; T251-A255 PolarHBondContact O-N 3.5Å; S252-A255 WeakPolarHBondContact O-CB 3.3Å; S252-A255 PolarHBondContact O-N 3.43Å; S252-A255 VanDerWaalsContact O-N 3.16Å; A253-A255 VanDerWaalsContact C-N 3.3Å; A253-A255 PolarHBondContact O-N 2.98Å; A255-S260 WeakPolarHBondContact O-CB 3.5Å; A255-S260 PolarHBondContact O-OG 3.4Å; A255-A262 WeakPolarHBondContact O-CB 3.38Å
256	F	95.4	Very high	95	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	25	179.5	-64.1	-82.8	0	0	0	113.4	S252 A253 R254 A262 I263 I266 S332 L697 R700 F701 I704	S252-F256 VanDerWaalsContact O-CD2 3.29Å; S252-F256 WeakPolarHBondContact O-CD2 3.21Å; A253-F256 PolarHBondContact O-N 3.05Å; R254-F256 PolarHBondContact O-N 2.71Å; F256-A262 HydrophobicContact CD1-CB 3.88Å; F256-A262 HydrophobicContact CE1-CB 3.71Å; F256-A262 HydrophobicContact CZ-CB 4.36Å; F256-I263 HydrophobicContact CB-CD1 4.36Å; F256-I263 HydrophobicContact CD1-CD1 4.12Å; F256-I266 HydrophobicContact CD1-CD1 4.45Å; F256-I266 HydrophobicContact CE1-CD1 4.04Å; F256-S332 VanDerWaalsContact O-CB 3.26Å; F256-S332 WeakPolarHBondContact O-CB 3.22Å; F256-S332 PolarHBondContact O-OG 2.67Å; F256-L697 HydrophobicContact CE1-CB 4.4Å; F256-L697 WeakPolarHBondContact CZ-O 3.27Å; F256-R700 HydrophobicContact CE2-CB 4.23Å; F256-R700 HydrophobicContact CE2-CG 4.04Å; F256-R700 HydrophobicContact CZ-CB 4.19Å; F256-R700 HydrophobicContact CZ-CG 4.43Å; F256-F701 HydrophobicContact CB-CD2 3.95Å; F256-F701 HydrophobicContact CB-CE2 4.11Å; F256-F701 HydrophobicContact CD1-CB 4.37Å; F256-F701 AromaticContact CD1-CD2 3.65Å; F256-F701 HydrophobicContact CD1-CD2 3.65Å; F256-F701 HydrophobicContact CD1-CE2 4.4Å; F256-F701 HydrophobicContact CD1-CG 4.42Å; F256-F701 HydrophobicContact CD2-CB 4.39Å; F256-F701 AromaticContact CD2-CD2 3.78Å; F256-F701 HydrophobicContact CD2-CD2 3.78Å; F256-F701 HydrophobicContact CE1-CB 3.9Å; F256-F701 HydrophobicContact CE1-CD2 4.06Å; F256-F701 HydrophobicContact CE1-CG 4.41Å; F256-F701 HydrophobicContact CE2-CB 3.93Å; F256-F701 HydrophobicContact CE2-CD2 4.18Å; F256-F701 AromaticContact CG-CD2 3.52Å; F256-F701 HydrophobicContact CG-CD2 3.52Å; F256-F701 HydrophobicContact CG-CE2 4.18Å; F256-F701 HydrophobicContact CZ-CB 3.68Å; F256-F701 HydrophobicContact CZ-CD2 4.33Å; F256-I704 HydrophobicContact CD2-CD1 3.96Å; F256-I704 HydrophobicContact CE2-CD1 4.49Å
257	L	96	Very high	94.7	Very high	33 Å²	33	37.7 Å²	37.7	17%	0.173	24%	0.24	C	C	.	.	S	Bend	trans	-67.5	153.3	168.4	-76.4	169.5	0	0	0	111.6	R254 G259 S260 I335 Q336 L339	R254-L257 HydrophobicContact CB-CD1 4.25Å; R254-L257 HydrophobicContact CG-CD1 4.25Å; R254-L257 PolarHBondContact O-N 2.85Å; L257-G259 PolarHBondContact O-N 3.43Å; L257-S260 WeakPolarHBondContact O-CB 3.36Å; L257-S260 PolarHBondContact O-N 2.74Å; L257-S260 PolarHBondContact O-OG 3.07Å; L257-I335 HydrophobicContact CD2-CB 4.46Å; L257-I335 HydrophobicContact CD2-CG2 3.79Å; L257-I335 HydrophobicContact CG-CG2 4.46Å; L257-Q336 HydrophobicContact CD2-CB 3.93Å; L257-Q336 HydrophobicContact CD2-CG 4.37Å; L257-L339 HydrophobicContact CD1-CD1 4.09Å; L257-L339 HydrophobicContact CD1-CD2 4.25Å; L257-L339 HydrophobicContact CD2-CD1 4.38Å
258	P	93.1	Very high	94.5	Very high	41 Å²	41	41.6 Å²	41.6	27%	0.266	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	132.2	174.7	-28.2	39.3	0	0	0	111.4	S260 S332 N333 Q336	P258-S260 VanDerWaalsContact C-N 3.31Å; P258-S332 WeakPolarHBondContact CD-O 3.39Å; P258-S332 VanDerWaalsContact CD-OG 3.28Å; P258-S332 WeakPolarHBondContact CD-OG 3.28Å; P258-S332 WeakPolarHBondContact CG-OG 3.29Å; P258-N333 VanDerWaalsContact CG-OD1 3.31Å; P258-N333 WeakPolarHBondContact CG-OD1 3.35Å; P258-Q336 HydrophobicContact CG-CB 4.12Å; P258-Q336 VanDerWaalsContact CG-OE1 3.31Å
259	G	91.8	Very high	94.2	Very high	78 Å²	78	40.6 Å²	40.6	80%	0.804	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.2	1.1	-174.9	0	0	0	0	0	114.9	L257	L257-G259 PolarHBondContact O-N 3.43Å
260	S	95.4	Very high	93.9	Very high	22 Å²	22	42 Å²	42	15%	0.154	25%	0.246	C	C	.	.			trans	-67.2	157.4	170.7	80.9	0	0	0	0	111.7	A255 L257 P258 A262 I263 A264	A255-S260 WeakPolarHBondContact O-CB 3.5Å; A255-S260 PolarHBondContact O-OG 3.4Å; L257-S260 WeakPolarHBondContact O-CB 3.36Å; L257-S260 PolarHBondContact O-N 2.74Å; L257-S260 PolarHBondContact O-OG 3.07Å; P258-S260 VanDerWaalsContact C-N 3.31Å; S260-A262 PolarHBondContact O-N 2.81Å; S260-I263 PolarHBondContact O-N 3.3Å; S260-I263 PolarHBondContact OG-N 2.98Å; S260-A264 PolarHBondContact O-N 3.35Å
261	E	95	Very high	93.6	Very high	146 Å²	146	48 Å²	48	68%	0.682	27%	0.273	S	S	*	.	H	α-helix	trans	-57.9	-38.9	176.1	-169.7	-175.3	169.6	0	0	111.9	I263 A264 Q265	E261-I263 PolarHBondContact O-N 2.82Å; E261-A264 PolarHBondContact O-N 3.38Å; E261-Q265 HydrophobicContact CG-CG 4.46Å; E261-Q265 WeakPolarHBondContact O-CG 3.44Å; E261-Q265 PolarHBondContact O-N 3.18Å; E261-Q265 PolarHBondContact OE1-NE2 2.92Å
262	A	94.7	Very high	93.3	Very high	9 Å²	9	44.9 Å²	44.9	7%	0.074	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-46	178.9	0	0	0	0	0	111.9	A255 F256 S260 A264 Q265 I266 L697	A255-A262 WeakPolarHBondContact O-CB 3.38Å; F256-A262 HydrophobicContact CD1-CB 3.88Å; F256-A262 HydrophobicContact CE1-CB 3.71Å; F256-A262 HydrophobicContact CZ-CB 4.36Å; S260-A262 PolarHBondContact O-N 2.81Å; A262-A264 VanDerWaalsContact C-N 3.34Å; A262-Q265 PolarHBondContact O-N 3.03Å; A262-I266 WeakPolarHBondContact O-CB 3.46Å; A262-I266 VanDerWaalsContact O-CG1 3.24Å; A262-I266 WeakPolarHBondContact O-CG1 3.48Å; A262-I266 PolarHBondContact O-N 3.49Å; A262-L697 HydrophobicContact CB-CD1 4.19Å; A262-L697 HydrophobicContact CB-CD2 3.8Å
263	I	93.9	Very high	93	Very high	20 Å²	20	44.7 Å²	44.7	10%	0.103	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-38.1	178.1	-63.9	-62.5	0	0	0	110.8	F256 S260 E261 I266 S267 V328	F256-I263 HydrophobicContact CB-CD1 4.36Å; F256-I263 HydrophobicContact CD1-CD1 4.12Å; S260-I263 PolarHBondContact O-N 3.3Å; S260-I263 PolarHBondContact OG-N 2.98Å; E261-I263 PolarHBondContact O-N 2.82Å; I263-I266 PolarHBondContact O-N 3.25Å; I263-S267 VanDerWaalsContact O-CB 3.32Å; I263-S267 WeakPolarHBondContact O-CB 3.18Å; I263-S267 PolarHBondContact O-N 2.8Å; I263-V328 HydrophobicContact CD1-CG1 3.82Å
264	A	94.1	Very high	92.7	Very high	57 Å²	57	48.2 Å²	48.2	47%	0.471	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-44.6	175.8	0	0	0	0	0	112.2	S260 E261 A262 S267 Y268	S260-A264 PolarHBondContact O-N 3.35Å; E261-A264 PolarHBondContact O-N 3.38Å; A262-A264 VanDerWaalsContact C-N 3.34Å; A264-S267 PolarHBondContact O-N 3.07Å; A264-Y268 VanDerWaalsContact O-CB 3.3Å; A264-Y268 WeakPolarHBondContact O-CB 3.48Å; A264-Y268 PolarHBondContact O-N 3.2Å
265	Q	93.7	Very high	92.5	Very high	62 Å²	62	49.7 Å²	49.7	29%	0.29	28%	0.28	S	S	.	.	H	α-helix	trans	-64.7	-43.8	176.9	-71.5	-175.4	30.8	0	0	111.9	E261 A262 Y268 F269 I694 L697	E261-Q265 HydrophobicContact CG-CG 4.46Å; E261-Q265 WeakPolarHBondContact O-CG 3.44Å; E261-Q265 PolarHBondContact O-N 3.18Å; E261-Q265 PolarHBondContact OE1-NE2 2.92Å; A262-Q265 PolarHBondContact O-N 3.03Å; Q265-Y268 PolarHBondContact O-N 3.16Å; Q265-F269 WeakPolarHBondContact O-CB 3.49Å; Q265-F269 PolarHBondContact O-N 2.91Å; Q265-I694 HydrophobicContact CB-CD1 4.02Å; Q265-L697 HydrophobicContact CB-CD1 3.97Å
266	I	91.8	Very high	92.2	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-61.5	-45.1	176.9	-73	170.1	0	0	0	110.8	F256 A262 I263 F269 N270 I325 V328 I694 L697 F698	F256-I266 HydrophobicContact CD1-CD1 4.45Å; F256-I266 HydrophobicContact CE1-CD1 4.04Å; A262-I266 WeakPolarHBondContact O-CB 3.46Å; A262-I266 VanDerWaalsContact O-CG1 3.24Å; A262-I266 WeakPolarHBondContact O-CG1 3.48Å; A262-I266 PolarHBondContact O-N 3.49Å; I263-I266 PolarHBondContact O-N 3.25Å; I266-F269 PolarHBondContact O-N 2.68Å; I266-N270 PolarHBondContact O-N 3.13Å; I266-I325 HydrophobicContact CG2-CD1 3.27Å; I266-V328 HydrophobicContact CD1-CG1 4.4Å; I266-I694 HydrophobicContact CG1-CD1 4.48Å; I266-L697 HydrophobicContact CD1-CB 4.19Å; I266-L697 HydrophobicContact CD1-CD1 4.44Å; I266-L697 HydrophobicContact CG1-CB 4.43Å; I266-L697 HydrophobicContact CG1-CD1 4.09Å; I266-F698 HydrophobicContact CD1-CD1 4.26Å; I266-F698 HydrophobicContact CD1-CE1 4.02Å; I266-F698 HydrophobicContact CG1-CE1 4.24Å; I266-F698 HydrophobicContact CG2-CE1 4.1Å; I266-F698 HydrophobicContact CG2-CZ 4.29Å
267	S	90.6	Very high	91.9	Very high	61 Å²	61	50.9 Å²	50.9	43%	0.427	28%	0.283	S	S	.	.	H	α-helix	trans	-66.2	-41.7	177.9	-173	0	0	0	0	112.3	I263 A264 N270 H271	I263-S267 VanDerWaalsContact O-CB 3.32Å; I263-S267 WeakPolarHBondContact O-CB 3.18Å; I263-S267 PolarHBondContact O-N 2.8Å; A264-S267 PolarHBondContact O-N 3.07Å; S267-N270 PolarHBondContact O-N 3.01Å; S267-H271 WeakPolarHBondContact O-CB 3.21Å; S267-H271 PolarHBondContact O-N 3.34Å
268	Y	91.2	Very high	91.6	Very high	121 Å²	121	52.6 Å²	52.6	48%	0.475	30%	0.298	S	S	.	.	H	α-helix	trans	-61.2	-48.2	175.9	175.4	-102.5	0	0	0	110.9	A264 Q265 N270 H271 S272	A264-Y268 VanDerWaalsContact O-CB 3.3Å; A264-Y268 WeakPolarHBondContact O-CB 3.48Å; A264-Y268 PolarHBondContact O-N 3.2Å; Q265-Y268 PolarHBondContact O-N 3.16Å; Y268-N270 VanDerWaalsContact C-N 3.33Å; Y268-N270 PolarHBondContact O-N 2.98Å; Y268-H271 PolarHBondContact O-N 3.43Å; Y268-S272 WeakPolarHBondContact O-CB 3.45Å; Y268-S272 PolarHBondContact O-N 3.31Å; Y268-S272 PolarHBondContact O-OG 2.67Å
269	F	91.1	Very high	91.6	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.018	31%	0.307	C	S	.	.	H	α-helix	trans	-56.4	-46.5	177.1	179.8	-97.5	0	0	0	111.9	Q265 I266 L273 F323 V648 L687 T690 R691 I694	Q265-F269 WeakPolarHBondContact O-CB 3.49Å; Q265-F269 PolarHBondContact O-N 2.91Å; I266-F269 PolarHBondContact O-N 2.68Å; F269-L273 VanDerWaalsContact O-CB 3.26Å; F269-L273 WeakPolarHBondContact O-CB 3.45Å; F269-L273 PolarHBondContact O-N 3.01Å; F269-F323 HydrophobicContact CE1-CD1 4.16Å; F269-F323 AromaticContact CE1-CE1 3.77Å; F269-F323 HydrophobicContact CE1-CE1 3.77Å; F269-F323 AromaticContact CE1-CZ 3.95Å; F269-F323 HydrophobicContact CE1-CZ 3.95Å; F269-F323 HydrophobicContact CZ-CE1 4.42Å; F269-F323 HydrophobicContact CZ-CZ 4.42Å; F269-V648 HydrophobicContact CE1-CG2 4.22Å; F269-V648 HydrophobicContact CZ-CG2 4.04Å; F269-L687 HydrophobicContact CD2-CD1 3.4Å; F269-L687 HydrophobicContact CD2-CG 4.3Å; F269-L687 HydrophobicContact CE2-CD1 3.63Å; F269-L687 HydrophobicContact CE2-CG 4.04Å; F269-L687 HydrophobicContact CG-CD1 4.2Å; F269-T690 WeakPolarHBondContact CD2-OG1 3.33Å; F269-R691 HydrophobicContact CE2-CG 3.96Å; F269-R691 HydrophobicContact CZ-CG 4.1Å; F269-I694 HydrophobicContact CB-CD1 3.88Å; F269-I694 HydrophobicContact CB-CG1 3.82Å; F269-I694 HydrophobicContact CD1-CG1 4.31Å; F269-I694 HydrophobicContact CD1-CG2 4.09Å; F269-I694 HydrophobicContact CD2-CG1 3.7Å; F269-I694 HydrophobicContact CE1-CG2 4.42Å; F269-I694 HydrophobicContact CE2-CG1 4.35Å; F269-I694 HydrophobicContact CG-CB 4.45Å; F269-I694 HydrophobicContact CG-CD1 4.3Å; F269-I694 HydrophobicContact CG-CG1 3.68Å; F269-I694 HydrophobicContact CG-CG2 4.3Å
270	N	89.6	Confident	91.6	Very high	30 Å²	30	51.7 Å²	51.7	16%	0.16	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-41	179.8	-169	69.1	0	0	0	112.9	I266 S267 Y268 L273 H274 I325	I266-N270 PolarHBondContact O-N 3.13Å; S267-N270 PolarHBondContact O-N 3.01Å; Y268-N270 VanDerWaalsContact C-N 3.33Å; Y268-N270 PolarHBondContact O-N 2.98Å; N270-L273 WeakPolarHBondContact O-CB 3.39Å; N270-L273 PolarHBondContact O-N 3.45Å; N270-H274 PolarHBondContact ND2-CD2 3.3Å; N270-H274 PolarHBondContact ND2-NE2 2.87Å; N270-H274 PolarHBondContact O-CD2 2.92Å; N270-H274 PolarHBondContact O-N 2.93Å; N270-H274 VanDerWaalsContact O-N 3.09Å; N270-I325 HydrophobicContact CB-CD1 4.03Å; N270-I325 HydrophobicContact CB-CG1 3.8Å
271	H	89.2	Confident	91.5	Very high	130 Å²	130	53.6 Å²	53.6	60%	0.602	28%	0.282	S	S	*	.	H	α-helix	trans	-64.2	-49.3	177.9	-174.3	68.8	0	0	0	111.4	S267 Y268 L273 H274 E275	S267-H271 WeakPolarHBondContact O-CB 3.21Å; S267-H271 PolarHBondContact O-N 3.34Å; Y268-H271 PolarHBondContact O-N 3.43Å; H271-L273 PolarHBondContact O-N 2.9Å; H271-H274 PolarHBondContact O-N 3.43Å; H271-E275 PolarHBondContact O-N 3.43Å; H271-E275 VanDerWaalsContact O-N 3.13Å
272	S	90.6	Very high	91.5	Very high	14 Å²	14	50.1 Å²	50.1	10%	0.098	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-32.9	176.3	-66.5	0	0	0	0	112.3	Y268 E275 V276	Y268-S272 WeakPolarHBondContact O-CB 3.45Å; Y268-S272 PolarHBondContact O-N 3.31Å; Y268-S272 PolarHBondContact O-OG 2.67Å; S272-E275 PolarHBondContact O-N 2.85Å; S272-V276 VanDerWaalsContact O-CG2 3.29Å; S272-V276 WeakPolarHBondContact O-CG2 3.44Å; S272-V276 PolarHBondContact O-N 3.19Å
273	L	89.7	Confident	91.4	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-48.9	173.2	177.8	68.9	0	0	0	112	F269 N270 H271 E275 V276 I277 F323 L652 L687	F269-L273 VanDerWaalsContact O-CB 3.26Å; F269-L273 WeakPolarHBondContact O-CB 3.45Å; F269-L273 PolarHBondContact O-N 3.01Å; N270-L273 WeakPolarHBondContact O-CB 3.39Å; N270-L273 PolarHBondContact O-N 3.45Å; H271-L273 PolarHBondContact O-N 2.9Å; L273-E275 VanDerWaalsContact C-N 3.27Å; L273-E275 PolarHBondContact O-N 3.16Å; L273-V276 PolarHBondContact O-N 3.36Å; L273-I277 HydrophobicContact CD1-CD1 4.01Å; L273-I277 HydrophobicContact CD1-CG1 4.17Å; L273-I277 HydrophobicContact CD2-CD1 4.37Å; L273-I277 HydrophobicContact CG-CD1 3.82Å; L273-I277 HydrophobicContact CG-CG1 4.33Å; L273-I277 VanDerWaalsContact O-CG1 3.24Å; L273-I277 WeakPolarHBondContact O-CG1 3.32Å; L273-I277 PolarHBondContact O-N 2.9Å; L273-F323 HydrophobicContact CD2-CD2 3.39Å; L273-F323 HydrophobicContact CD2-CE2 3.1Å; L273-F323 HydrophobicContact CD2-CZ 4.01Å; L273-F323 HydrophobicContact CG-CE2 4.49Å; L273-L652 HydrophobicContact CD1-CD1 3.4Å; L273-L687 VanDerWaalsContact CA-CD2 3.45Å; L273-L687 HydrophobicContact CB-CD2 3.95Å; L273-L687 HydrophobicContact CD1-CD2 4.04Å
274	H	88.9	Confident	91.4	Very high	73 Å²	73	52 Å²	52	34%	0.338	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-40.1	178.5	-76.7	-62.7	0	0	0	112.1	N270 H271 I277 S278 P320	N270-H274 PolarHBondContact ND2-CD2 3.3Å; N270-H274 PolarHBondContact ND2-NE2 2.87Å; N270-H274 PolarHBondContact O-CD2 2.92Å; N270-H274 PolarHBondContact O-N 2.93Å; N270-H274 VanDerWaalsContact O-N 3.09Å; H271-H274 PolarHBondContact O-N 3.43Å; H274-I277 PolarHBondContact O-N 3.39Å; H274-S278 PolarHBondContact O-N 3.41Å; H274-S278 VanDerWaalsContact O-N 3.16Å; H274-S278 PolarHBondContact O-OG 3.29Å; H274-P320 PolarHBondContact CE1-O 3.07Å; H274-P320 VanDerWaalsContact CE1-O 3.28Å
275	E	90.3	Very high	91.4	Very high	115 Å²	115	53.4 Å²	53.4	54%	0.537	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-45.2	175.3	-172.6	177	-167.5	0	0	111.8	H271 S272 L273 I277 S278 E279	H271-E275 PolarHBondContact O-N 3.43Å; H271-E275 VanDerWaalsContact O-N 3.13Å; S272-E275 PolarHBondContact O-N 2.85Å; L273-E275 VanDerWaalsContact C-N 3.27Å; L273-E275 PolarHBondContact O-N 3.16Å; E275-I277 VanDerWaalsContact C-N 3.34Å; E275-I277 PolarHBondContact O-N 3.41Å; E275-S278 PolarHBondContact O-N 2.87Å; E275-S278 PolarHBondContact O-OG 3.03Å; E275-E279 HydrophobicContact CG-CG 4.45Å; E275-E279 WeakPolarHBondContact O-CB 3.35Å; E275-E279 WeakPolarHBondContact O-CG 3.33Å; E275-E279 PolarHBondContact O-N 2.77Å
276	V	90.3	Very high	91.5	Very high	11 Å²	11	57 Å²	57	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-65.4	-38	176.7	173.5	0	0	0	0	111.5	S272 L273 S278 E279 L280 L652 P684 L687	S272-V276 VanDerWaalsContact O-CG2 3.29Å; S272-V276 WeakPolarHBondContact O-CG2 3.44Å; S272-V276 PolarHBondContact O-N 3.19Å; L273-V276 PolarHBondContact O-N 3.36Å; V276-S278 VanDerWaalsContact C-N 3.29Å; V276-S278 PolarHBondContact O-N 3.13Å; V276-E279 PolarHBondContact O-N 2.75Å; V276-L280 HydrophobicContact CG1-CB 4.41Å; V276-L280 WeakPolarHBondContact O-CB 3.22Å; V276-L280 PolarHBondContact O-N 2.65Å; V276-L652 HydrophobicContact CG1-CD2 3.77Å; V276-P684 HydrophobicContact CG1-CB 3.89Å; V276-L687 HydrophobicContact CB-CD2 4.29Å; V276-L687 HydrophobicContact CG2-CD2 4.02Å
277	I	89.5	Confident	91.6	Very high	36 Å²	36	56.8 Å²	56.8	19%	0.185	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-38.7	177.3	-70.2	175.3	0	0	0	111.2	L273 H274 E275 P281 V316 P320	L273-I277 HydrophobicContact CD1-CD1 4.01Å; L273-I277 HydrophobicContact CD1-CG1 4.17Å; L273-I277 HydrophobicContact CD2-CD1 4.37Å; L273-I277 HydrophobicContact CG-CD1 3.82Å; L273-I277 HydrophobicContact CG-CG1 4.33Å; L273-I277 VanDerWaalsContact O-CG1 3.24Å; L273-I277 WeakPolarHBondContact O-CG1 3.32Å; L273-I277 PolarHBondContact O-N 2.9Å; H274-I277 PolarHBondContact O-N 3.39Å; E275-I277 VanDerWaalsContact C-N 3.34Å; E275-I277 PolarHBondContact O-N 3.41Å; I277-P281 WeakPolarHBondContact O-CD 3.15Å; I277-V316 HydrophobicContact CB-CG2 4.5Å; I277-V316 HydrophobicContact CD1-CG1 4.35Å; I277-V316 HydrophobicContact CG1-CG1 3.85Å; I277-V316 HydrophobicContact CG1-CG2 4.26Å; I277-P320 HydrophobicContact CD1-CB 3.95Å
278	S	89.8	Confident	91.8	Very high	70 Å²	70	54.7 Å²	54.7	49%	0.49	27%	0.267	S	S	.	.	H	α-helix	trans	-76.5	-37.7	177.3	53.4	0	0	0	0	113.6	H274 E275 V276	H274-S278 PolarHBondContact O-N 3.41Å; H274-S278 VanDerWaalsContact O-N 3.16Å; H274-S278 PolarHBondContact O-OG 3.29Å; E275-S278 PolarHBondContact O-N 2.87Å; E275-S278 PolarHBondContact O-OG 3.03Å; V276-S278 VanDerWaalsContact C-N 3.29Å; V276-S278 PolarHBondContact O-N 3.13Å
279	E	92.2	Very high	91.9	Very high	97 Å²	97	52.4 Å²	52.4	45%	0.453	26%	0.263	S	S	.	.	H	α-helix	trans	-85.8	-31.6	-173	-68.9	-60.3	128.3	0	0	113.6	E275 V276 T282 I283	E275-E279 HydrophobicContact CG-CG 4.45Å; E275-E279 WeakPolarHBondContact O-CB 3.35Å; E275-E279 WeakPolarHBondContact O-CG 3.33Å; E275-E279 PolarHBondContact O-N 2.77Å; V276-E279 PolarHBondContact O-N 2.75Å; E279-T282 WeakPolarHBondContact O-CB 3.49Å; E279-T282 PolarHBondContact O-N 3.45Å; E279-I283 HydrophobicContact CB-CD1 4.16Å; E279-I283 WeakPolarHBondContact O-CG1 2.99Å; E279-I283 PolarHBondContact O-N 3.4Å
280	L	92.9	Very high	92.1	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-57.1	-41.2	-174.4	-170.8	69.7	0	0	0	113.9	V276 T282 I283 R284 L314 V316 T653 L680 P684	V276-L280 HydrophobicContact CG1-CB 4.41Å; V276-L280 WeakPolarHBondContact O-CB 3.22Å; V276-L280 PolarHBondContact O-N 2.65Å; L280-T282 VanDerWaalsContact C-N 3.29Å; L280-T282 PolarHBondContact O-N 3.19Å; L280-I283 PolarHBondContact O-N 3.45Å; L280-R284 WeakPolarHBondContact O-CB 3.46Å; L280-R284 PolarHBondContact O-N 3.13Å; L280-L314 HydrophobicContact CD1-CD1 4.14Å; L280-L314 HydrophobicContact CD1-CG 4.08Å; L280-V316 HydrophobicContact CB-CG2 4.35Å; L280-V316 HydrophobicContact CD2-CG2 3.78Å; L280-T653 HydrophobicContact CD2-CG2 3.93Å; L280-L680 HydrophobicContact CD1-CD2 4.18Å; L280-P684 HydrophobicContact CD1-CB 4.47Å; L280-P684 HydrophobicContact CD1-CG 4.11Å
281	P	92.8	Very high	92.3	Very high	63 Å²	63	52 Å²	52	41%	0.409	26%	0.262	S	S	.	.	H	α-helix	trans	-59.1	-39.3	175.5	-24.9	35.5	0	0	0	113.2	I277 Q285	I277-P281 WeakPolarHBondContact O-CD 3.15Å; P281-Q285 WeakPolarHBondContact O-CB 3.39Å; P281-Q285 PolarHBondContact O-N 2.86Å
282	T	93.7	Very high	92.4	Very high	72 Å²	72	51.3 Å²	51.3	44%	0.442	26%	0.262	S	S	.	.	H	α-helix	trans	-70.3	-43.1	177.7	-54.7	0	0	0	0	111	E279 L280 Q285 R286	E279-T282 WeakPolarHBondContact O-CB 3.49Å; E279-T282 PolarHBondContact O-N 3.45Å; L280-T282 VanDerWaalsContact C-N 3.29Å; L280-T282 PolarHBondContact O-N 3.19Å; T282-Q285 PolarHBondContact O-N 2.87Å; T282-R286 WeakPolarHBondContact O-CG 3.45Å; T282-R286 PolarHBondContact O-N 2.79Å
283	I	93.4	Very high	92.3	Very high	20 Å²	20	56.3 Å²	56.3	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-47.4	175.4	-64.5	167.8	0	0	0	110.2	E279 L280 Q285 R286 L287 A679 L680	E279-I283 HydrophobicContact CB-CD1 4.16Å; E279-I283 WeakPolarHBondContact O-CG1 2.99Å; E279-I283 PolarHBondContact O-N 3.4Å; L280-I283 PolarHBondContact O-N 3.45Å; I283-Q285 PolarHBondContact O-N 3.25Å; I283-R286 PolarHBondContact O-N 2.88Å; I283-L287 WeakPolarHBondContact O-CB 3.1Å; I283-L287 PolarHBondContact O-N 2.98Å; I283-A679 HydrophobicContact CD1-CB 3.95Å; I283-A679 HydrophobicContact CG1-CB 4.21Å; I283-L680 HydrophobicContact CG2-CD2 3.72Å; I283-L680 HydrophobicContact CG2-CG 3.91Å
284	R	94.7	Very high	92.1	Very high	48 Å²	48	58.1 Å²	58.1	18%	0.181	31%	0.311	C	S	.	.	H	α-helix	trans	-57.1	-48.9	176.6	178.7	-173.4	58.6	85.1	11	111.2	L280 L287 T288 A310 N311 L314	L280-R284 WeakPolarHBondContact O-CB 3.46Å; L280-R284 PolarHBondContact O-N 3.13Å; R284-L287 PolarHBondContact O-N 3.14Å; R284-T288 WeakPolarHBondContact O-CB 3.45Å; R284-T288 PolarHBondContact O-N 2.89Å; R284-T288 PolarHBondContact O-OG1 3.17Å; R284-A310 WeakPolarHBondContact CD-O 3.35Å; R284-N311 PolarHBondContact NH1-OD1 3.47Å; R284-L314 HydrophobicContact CB-CD2 4.19Å; R284-L314 WeakPolarHBondContact CD-O 3.46Å; R284-L314 HydrophobicContact CG-CB 4.49Å; R284-L314 HydrophobicContact CG-CD2 4.45Å
285	Q	94.2	Very high	92.1	Very high	87 Å²	87	55.9 Å²	55.9	41%	0.407	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-50.7	-178.5	-173.3	59.4	39.8	0	0	111.2	P281 T282 I283 L287 T288 D289	P281-Q285 WeakPolarHBondContact O-CB 3.39Å; P281-Q285 PolarHBondContact O-N 2.86Å; T282-Q285 PolarHBondContact O-N 2.87Å; I283-Q285 PolarHBondContact O-N 3.25Å; Q285-L287 VanDerWaalsContact C-N 3.32Å; Q285-L287 PolarHBondContact O-N 3.48Å; Q285-T288 PolarHBondContact O-N 2.74Å; Q285-D289 PolarHBondContact NE2-OD1 2.72Å; Q285-D289 PolarHBondContact NE2-OD2 3.48Å; Q285-D289 PolarHBondContact O-N 3.3Å
286	R	94	Very high	91.9	Very high	138 Å²	138	52.7 Å²	52.7	52%	0.521	29%	0.293	S	S	.	.	H	α-helix	trans	-62.9	-37.7	179.7	-69.1	177.9	65.8	-170.7	-2	112.8	T282 I283 T290	T282-R286 WeakPolarHBondContact O-CG 3.45Å; T282-R286 PolarHBondContact O-N 2.79Å; I283-R286 PolarHBondContact O-N 2.88Å; R286-T290 WeakPolarHBondContact O-CB 3.38Å; R286-T290 PolarHBondContact O-N 2.73Å; R286-T290 PolarHBondContact O-OG1 2.6Å
287	L	95	Very high	91.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.3	-48.1	175	177	63.3	0	0	0	111	I283 R284 Q285 T290 L291 A310 L314 F661 L665 L673 H676 L680	I283-L287 WeakPolarHBondContact O-CB 3.1Å; I283-L287 PolarHBondContact O-N 2.98Å; R284-L287 PolarHBondContact O-N 3.14Å; Q285-L287 VanDerWaalsContact C-N 3.32Å; Q285-L287 PolarHBondContact O-N 3.48Å; L287-T290 PolarHBondContact O-N 3.14Å; L287-L291 HydrophobicContact CD1-CD1 4.1Å; L287-L291 HydrophobicContact CD1-CG 4.32Å; L287-L291 HydrophobicContact CG-CD1 4.03Å; L287-L291 WeakPolarHBondContact O-CG 3.31Å; L287-L291 PolarHBondContact O-N 3.44Å; L287-A310 HydrophobicContact CD2-CB 4.15Å; L287-L314 HydrophobicContact CD2-CD2 4Å; L287-F661 HydrophobicContact CD2-CE1 4.13Å; L287-F661 HydrophobicContact CD2-CZ 4.05Å; L287-L665 HydrophobicContact CD1-CD1 4.13Å; L287-L665 HydrophobicContact CD1-CD2 3.97Å; L287-L665 HydrophobicContact CD2-CD1 3.95Å; L287-L673 HydrophobicContact CD1-CD2 3.59Å; L287-H676 HydrophobicContact CD1-CB 4.15Å; L287-L680 HydrophobicContact CD2-CD1 4.13Å
288	T	95	Very high	91.8	Very high	17 Å²	17	63.8 Å²	63.8	10%	0.104	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-44.9	-179.7	-49.4	0	0	0	0	110.7	R284 Q285 T290 L291 N292 M307 N311	R284-T288 WeakPolarHBondContact O-CB 3.45Å; R284-T288 PolarHBondContact O-N 2.89Å; R284-T288 PolarHBondContact O-OG1 3.17Å; Q285-T288 PolarHBondContact O-N 2.74Å; T288-T290 VanDerWaalsContact C-N 3.32Å; T288-T290 PolarHBondContact O-N 3.05Å; T288-L291 PolarHBondContact O-N 2.98Å; T288-N292 WeakPolarHBondContact O-CB 3.5Å; T288-N292 PolarHBondContact O-N 3.29Å; T288-M307 HydrophobicContact CG2-CG 3.45Å; T288-M307 VanDerWaalsContact CG2-CG 3.45Å; T288-M307 HydrophobicContact CG2-SD 4.18Å; T288-N311 HydrophobicContact CG2-CB 4.49Å
289	D	94	Very high	91.8	Very high	73 Å²	73	62.4 Å²	62.4	39%	0.39	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-39	177.8	-66.1	-25.4	0	0	0	111.9	Q285 N292 T293	Q285-D289 PolarHBondContact NE2-OD1 2.72Å; Q285-D289 PolarHBondContact NE2-OD2 3.48Å; Q285-D289 PolarHBondContact O-N 3.3Å; D289-N292 PolarHBondContact O-N 3.45Å; D289-T293 WeakPolarHBondContact O-CB 3.22Å; D289-T293 WeakPolarHBondContact O-CG2 3.18Å; D289-T293 PolarHBondContact O-N 3.5Å; D289-T293 PolarHBondContact O-OG1 3.37Å
290	T	93.9	Very high	91.7	Very high	22 Å²	22	62 Å²	62	14%	0.135	34%	0.335	C	S	.	.	H	α-helix	trans	-69.6	-40.8	177.9	-58.5	0	0	0	0	111.9	R286 L287 T288 N292 G294 L673 H676	R286-T290 WeakPolarHBondContact O-CB 3.38Å; R286-T290 PolarHBondContact O-N 2.73Å; R286-T290 PolarHBondContact O-OG1 2.6Å; L287-T290 PolarHBondContact O-N 3.14Å; T288-T290 VanDerWaalsContact C-N 3.32Å; T288-T290 PolarHBondContact O-N 3.05Å; T290-N292 VanDerWaalsContact C-N 3.31Å; T290-G294 WeakPolarHBondContact O-CA 3.3Å; T290-G294 PolarHBondContact O-N 2.79Å; T290-L673 HydrophobicContact CG2-CD2 3.78Å; T290-L673 HydrophobicContact CG2-CG 4.36Å; T290-H676 PolarHBondContact OG1-NE2 3.43Å; T290-H676 VanDerWaalsContact OG1-NE2 3.17Å
291	L	93.9	Very high	91.6	Very high	4 Å²	4	67.3 Å²	67.3	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-66.3	-34.5	174.8	-70.7	170.3	0	0	0	112	L287 T288 C295 C303 L306 M307 L665 L668 L673	L287-L291 HydrophobicContact CD1-CD1 4.1Å; L287-L291 HydrophobicContact CD1-CG 4.32Å; L287-L291 HydrophobicContact CG-CD1 4.03Å; L287-L291 WeakPolarHBondContact O-CG 3.31Å; L287-L291 PolarHBondContact O-N 3.44Å; T288-L291 PolarHBondContact O-N 2.98Å; L291-C295 WeakPolarHBondContact O-CB 3.49Å; L291-C303 HydrophobicContact CD2-CB 4.4Å; L291-L306 HydrophobicContact CD1-CB 4.3Å; L291-M307 HydrophobicContact CB-CB 3.95Å; L291-M307 HydrophobicContact CB-CG 4.23Å; L291-M307 HydrophobicContact CD1-CB 3.99Å; L291-L665 HydrophobicContact CD1-CD2 4.17Å; L291-L665 HydrophobicContact CD2-CD2 4.3Å; L291-L668 HydrophobicContact CD2-CD1 3.6Å; L291-L673 HydrophobicContact CD2-CD1 3.98Å; L291-L673 HydrophobicContact CD2-CD2 4.04Å; L291-L673 HydrophobicContact CG-CD2 4.23Å
292	N	90.7	Very high	91.6	Very high	114 Å²	114	68.7 Å²	68.7	61%	0.61	36%	0.364	S	S	*	.	H	α-helix	trans	-72.5	-39.9	178.3	-171	41.6	0	0	0	113	T288 D289 T290 M307	T288-N292 WeakPolarHBondContact O-CB 3.5Å; T288-N292 PolarHBondContact O-N 3.29Å; D289-N292 PolarHBondContact O-N 3.45Å; T290-N292 VanDerWaalsContact C-N 3.31Å; N292-M307 HydrophobicContact CB-SD 3.73Å
293	T	89	Confident	91.6	Very high	119 Å²	119	65.3 Å²	65.3	73%	0.73	34%	0.343	S	S	*	.	H	α-helix	trans	-100.1	-27.8	-171	57.1	0	0	0	0	114.5	D289	D289-T293 WeakPolarHBondContact O-CB 3.22Å; D289-T293 WeakPolarHBondContact O-CG2 3.18Å; D289-T293 PolarHBondContact O-N 3.5Å; D289-T293 PolarHBondContact O-OG1 3.37Å
294	G	85.4	Confident	91.5	Very high	39 Å²	39	71.8 Å²	71.8	40%	0.402	37%	0.366	S	S	.	.	S	Bend	trans	-108.7	4.9	-168.1	0	0	0	0	0	115.8	T290 M670	T290-G294 WeakPolarHBondContact O-CA 3.3Å; T290-G294 PolarHBondContact O-N 2.79Å; G294-M670 WeakPolarHBondContact O-CE 3.47Å
295	C	89	Confident	91.5	Very high	26 Å²	26	74 Å²	74	18%	0.176	38%	0.379	C	S	.	.			trans	-75.6	133.2	-170.8	-170.7	0	0	0	0	113.4	L291 K299 C303	L291-C295 WeakPolarHBondContact O-CB 3.49Å; C295-K299 PolarHBondContact SG-O 3.18Å; C295-C303 HydrophobicContact CB-CB 3.64Å; C295-C303 WeakPolarHBondContact CB-SG 3.32Å; C295-C303 WeakPolarHBondContact SG-CB 3.12Å; C295-C303 CovalentContact SG-SG 2.02Å; C295-C303 PolarHBondContact SG-SG 2.79Å
296	P	87.5	Confident	91.6	Very high	48 Å²	48	70 Å²	70	31%	0.312	36%	0.36	S	S	.	.			trans	-59.1	143.2	168.5	-22.3	33.5	0	0	0	112.5	D298 K299 I300 M670	P296-D298 WeakPolarHBondContact CB-OD1 3.2Å; P296-D298 PolarHBondContact O-N 2.91Å; P296-K299 PolarHBondContact O-N 3.04Å; P296-I300 PolarHBondContact O-N 2.84Å; P296-M670 HydrophobicContact CG-CG 4.24Å; P296-M670 HydrophobicContact CG-SD 4.49Å
297	I	86.3	Confident	91.6	Very high	153 Å²	153	65.1 Å²	65.1	79%	0.785	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-58.7	-35.4	-178	-62.9	172.7	0	0	0	111.5	K299 I300	I297-K299 VanDerWaalsContact C-N 3.28Å; I297-K299 PolarHBondContact O-N 2.62Å; I297-I300 WeakPolarHBondContact O-CG2 3.35Å
298	D	90.5	Very high	91.6	Very high	127 Å²	127	70.2 Å²	70.2	68%	0.679	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-72.1	-14.3	-179.9	61.3	-58.8	0	0	0	114.4	P296	P296-D298 WeakPolarHBondContact CB-OD1 3.2Å; P296-D298 PolarHBondContact O-N 2.91Å
299	K	89.9	Confident	91.5	Very high	42 Å²	42	71.1 Å²	71.1	18%	0.183	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-119	14.5	180	-58.2	-168.5	178.9	-174.7	0	113.6	C295 P296 I297 I301 E302 C303 A667 L668	C295-K299 PolarHBondContact SG-O 3.18Å; P296-K299 PolarHBondContact O-N 3.04Å; I297-K299 VanDerWaalsContact C-N 3.28Å; I297-K299 PolarHBondContact O-N 2.62Å; K299-I301 PolarHBondContact O-N 3Å; K299-E302 PolarHBondContact O-N 3.28Å; K299-C303 PolarHBondContact O-N 2.78Å; K299-C303 PolarHBondContact O-SG 3.18Å; K299-A667 PolarHBondContact NZ-O 3.49Å; K299-L668 HydrophobicContact CB-CD2 4.2Å; K299-L668 HydrophobicContact CD-CD2 4.02Å; K299-L668 PolarHBondContact NZ-O 3.46Å
300	I	89.6	Confident	91.6	Very high	87 Å²	87	67.7 Å²	67.7	45%	0.446	35%	0.353	S	S	.	.	H	α-helix	trans	-65	-27	-168.4	-158.8	154	0	0	0	113.2	P296 I297 R304	P296-I300 PolarHBondContact O-N 2.84Å; I297-I300 WeakPolarHBondContact O-CG2 3.35Å; I300-R304 WeakPolarHBondContact O-CB 3.2Å; I300-R304 PolarHBondContact O-N 2.99Å; I300-R304 VanDerWaalsContact O-N 3.13Å
301	I	90.7	Very high	91.6	Very high	115 Å²	115	69.9 Å²	69.9	59%	0.59	36%	0.364	S	S	*	.	H	α-helix	trans	-70.9	-53.6	176.3	-59.1	175.9	0	0	0	109.2	K299 C303 R304 E305	K299-I301 PolarHBondContact O-N 3Å; I301-C303 VanDerWaalsContact C-N 3.32Å; I301-C303 PolarHBondContact O-N 2.98Å; I301-R304 WeakPolarHBondContact O-CB 3.27Å; I301-R304 PolarHBondContact O-N 3.2Å; I301-R304 VanDerWaalsContact O-N 3.1Å; I301-E305 PolarHBondContact O-N 3.06Å
302	E	92.3	Very high	91.5	Very high	91 Å²	91	74.4 Å²	74.4	43%	0.425	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-39.3	178.7	-65.9	87	164.5	0	0	112.1	K299 E305 L306 L668	K299-E302 PolarHBondContact O-N 3.28Å; E302-E305 PolarHBondContact O-N 3.15Å; E302-L306 WeakPolarHBondContact O-CB 3.35Å; E302-L306 WeakPolarHBondContact O-CG 3.41Å; E302-L306 PolarHBondContact O-N 3.45Å; E302-L668 HydrophobicContact CB-CD2 3.98Å
303	C	93.8	Very high	91.8	Very high	2 Å²	2	72.7 Å²	72.7	1%	0.014	38%	0.377	C	S	.	.	H	α-helix	trans	-60.7	-43.7	173.5	-75	0	0	0	0	111.9	L291 C295 K299 I301 L306 M307	L291-C303 HydrophobicContact CD2-CB 4.4Å; C295-C303 HydrophobicContact CB-CB 3.64Å; C295-C303 WeakPolarHBondContact CB-SG 3.32Å; C295-C303 WeakPolarHBondContact SG-CB 3.12Å; C295-C303 CovalentContact SG-SG 2.02Å; C295-C303 PolarHBondContact SG-SG 2.79Å; K299-C303 PolarHBondContact O-N 2.78Å; K299-C303 PolarHBondContact O-SG 3.18Å; I301-C303 VanDerWaalsContact C-N 3.32Å; I301-C303 PolarHBondContact O-N 2.98Å; C303-L306 PolarHBondContact O-N 2.94Å; C303-M307 WeakPolarHBondContact O-CB 3.41Å; C303-M307 PolarHBondContact O-N 3.42Å
304	R	93	Very high	92	Very high	155 Å²	155	67 Å²	67	59%	0.585	34%	0.342	S	S	*	.	H	α-helix	trans	-64.6	-45.8	178.4	-175.7	-179.9	-62.8	-147.6	-1.5	111.2	I300 I301 M307 E308	I300-R304 WeakPolarHBondContact O-CB 3.2Å; I300-R304 PolarHBondContact O-N 2.99Å; I300-R304 VanDerWaalsContact O-N 3.13Å; I301-R304 WeakPolarHBondContact O-CB 3.27Å; I301-R304 PolarHBondContact O-N 3.2Å; I301-R304 VanDerWaalsContact O-N 3.1Å; R304-M307 HydrophobicContact CG-CE 4.45Å; R304-M307 WeakPolarHBondContact O-CB 3.21Å; R304-M307 PolarHBondContact O-N 3.35Å; R304-E308 WeakPolarHBondContact O-CB 3.49Å; R304-E308 WeakPolarHBondContact O-CG 3.42Å; R304-E308 PolarHBondContact O-N 3.26Å
305	E	94.8	Very high	92.3	Very high	96 Å²	96	69.4 Å²	69.4	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-59.9	-46.9	176.6	-72.1	-177.8	-178.8	0	0	112.2	I301 E302 M307 E308 L309 R664	I301-E305 PolarHBondContact O-N 3.06Å; E302-E305 PolarHBondContact O-N 3.15Å; E305-M307 VanDerWaalsContact C-N 3.31Å; E305-M307 PolarHBondContact O-N 3.4Å; E305-E308 PolarHBondContact O-N 3.25Å; E305-L309 VanDerWaalsContact O-CB 3.27Å; E305-L309 WeakPolarHBondContact O-CB 3.26Å; E305-L309 PolarHBondContact O-N 3.41Å; E305-R664 IonicContact OE2-NH2 3.17Å; E305-R664 PolarHBondContact OE2-NH2 2.9Å
306	L	95.2	Very high	92.3	Very high	2 Å²	2	70.2 Å²	70.2	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-68	-33.6	179.1	-73	168.3	0	0	0	112.1	L291 E302 C303 A310 F661 R664 L665 L668	L291-L306 HydrophobicContact CD1-CB 4.3Å; E302-L306 WeakPolarHBondContact O-CB 3.35Å; E302-L306 WeakPolarHBondContact O-CG 3.41Å; E302-L306 PolarHBondContact O-N 3.45Å; C303-L306 PolarHBondContact O-N 2.94Å; L306-A310 VanDerWaalsContact O-CB 3.22Å; L306-A310 WeakPolarHBondContact O-CB 3.39Å; L306-A310 PolarHBondContact O-N 3.37Å; L306-F661 HydrophobicContact CD2-CD2 3.88Å; L306-F661 HydrophobicContact CD2-CE2 3.74Å; L306-R664 HydrophobicContact CD1-CB 4.1Å; L306-R664 HydrophobicContact CD2-CB 3.7Å; L306-R664 HydrophobicContact CG-CB 4.5Å; L306-L665 HydrophobicContact CB-CD2 4.32Å; L306-L665 HydrophobicContact CD1-CD2 4.17Å; L306-L668 HydrophobicContact CD1-CD1 3.82Å; L306-L668 HydrophobicContact CD1-CD2 4.33Å; L306-L668 HydrophobicContact CD1-CG 4.1Å
307	M	94.4	Very high	92.4	Very high	36 Å²	36	72.6 Å²	72.6	18%	0.177	35%	0.348	C	S	.	.	H	α-helix	trans	-67.2	-46.5	174.8	-176.7	-173.1	70.5	0	0	111.3	T288 L291 N292 C303 R304 E305 A310 N311	T288-M307 HydrophobicContact CG2-CG 3.45Å; T288-M307 VanDerWaalsContact CG2-CG 3.45Å; T288-M307 HydrophobicContact CG2-SD 4.18Å; L291-M307 HydrophobicContact CB-CB 3.95Å; L291-M307 HydrophobicContact CB-CG 4.23Å; L291-M307 HydrophobicContact CD1-CB 3.99Å; N292-M307 HydrophobicContact CB-SD 3.73Å; C303-M307 WeakPolarHBondContact O-CB 3.41Å; C303-M307 PolarHBondContact O-N 3.42Å; R304-M307 HydrophobicContact CG-CE 4.45Å; R304-M307 WeakPolarHBondContact O-CB 3.21Å; R304-M307 PolarHBondContact O-N 3.35Å; E305-M307 VanDerWaalsContact C-N 3.31Å; E305-M307 PolarHBondContact O-N 3.4Å; M307-A310 PolarHBondContact O-N 3.28Å; M307-N311 WeakPolarHBondContact O-CB 3.25Å; M307-N311 PolarHBondContact O-N 2.65Å
308	E	94.1	Very high	92.3	Very high	106 Å²	106	65.6 Å²	65.6	50%	0.495	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-48.2	174.7	-75.9	177.2	-172.8	0	0	110.6	R304 E305 A310 N311 D312	R304-E308 WeakPolarHBondContact O-CB 3.49Å; R304-E308 WeakPolarHBondContact O-CG 3.42Å; R304-E308 PolarHBondContact O-N 3.26Å; E305-E308 PolarHBondContact O-N 3.25Å; E308-A310 VanDerWaalsContact C-N 3.34Å; E308-A310 PolarHBondContact O-N 2.94Å; E308-N311 PolarHBondContact O-N 3.13Å; E308-D312 WeakPolarHBondContact O-CB 3.46Å; E308-D312 PolarHBondContact O-N 3.35Å
309	L	94.2	Very high	91.7	Very high	37 Å²	37	62.4 Å²	62.4	19%	0.194	30%	0.298	C	S	.	.	H	α-helix	trans	-58.5	-43.6	176.4	-177.2	62.3	0	0	0	112.2	E305 Q313 I655 F661	E305-L309 VanDerWaalsContact O-CB 3.27Å; E305-L309 WeakPolarHBondContact O-CB 3.26Å; E305-L309 PolarHBondContact O-N 3.41Å; L309-Q313 HydrophobicContact CD1-CB 4.14Å; L309-Q313 VanDerWaalsContact CD1-CD 3.5Å; L309-Q313 HydrophobicContact CD1-CG 4.03Å; L309-Q313 WeakPolarHBondContact O-CA 3.42Å; L309-Q313 WeakPolarHBondContact O-CB 3.33Å; L309-Q313 PolarHBondContact O-N 2.92Å; L309-I655 HydrophobicContact CD1-CG1 4.47Å; L309-I655 HydrophobicContact CG-CD1 4.21Å; L309-F661 HydrophobicContact CB-CE2 4.49Å; L309-F661 HydrophobicContact CD2-CD2 3.65Å; L309-F661 HydrophobicContact CD2-CE2 3.99Å; L309-F661 HydrophobicContact CG-CD2 4.26Å; L309-F661 HydrophobicContact CG-CE2 4.23Å
310	A	94.5	Very high	90.6	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-47.3	175.7	0	0	0	0	0	111.4	R284 L287 L306 M307 E308 D312 L314 F661	R284-A310 WeakPolarHBondContact CD-O 3.35Å; L287-A310 HydrophobicContact CD2-CB 4.15Å; L306-A310 VanDerWaalsContact O-CB 3.22Å; L306-A310 WeakPolarHBondContact O-CB 3.39Å; L306-A310 PolarHBondContact O-N 3.37Å; M307-A310 PolarHBondContact O-N 3.28Å; E308-A310 VanDerWaalsContact C-N 3.34Å; E308-A310 PolarHBondContact O-N 2.94Å; A310-D312 VanDerWaalsContact C-N 3.31Å; A310-D312 PolarHBondContact O-N 3.13Å; A310-L314 HydrophobicContact CB-CB 4.37Å; A310-L314 HydrophobicContact CB-CD2 4.37Å; A310-L314 WeakPolarHBondContact O-CB 3.33Å; A310-L314 PolarHBondContact O-N 2.85Å; A310-F661 HydrophobicContact CB-CZ 3.9Å
311	N	93.8	Very high	89.7	Confident	68 Å²	68	66.1 Å²	66.1	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-66.8	-35.7	-176.9	-166.9	39.7	0	0	0	112.1	R284 T288 M307 E308 K315	R284-N311 PolarHBondContact NH1-OD1 3.47Å; T288-N311 HydrophobicContact CG2-CB 4.49Å; M307-N311 WeakPolarHBondContact O-CB 3.25Å; M307-N311 PolarHBondContact O-N 2.65Å; E308-N311 PolarHBondContact O-N 3.13Å; N311-K315 WeakPolarHBondContact O-CE 3.49Å; N311-K315 PolarHBondContact O-NZ 3.32Å
312	D	93.7	Very high	88.8	Confident	99 Å²	99	62.1 Å²	62.1	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-82.5	-47.9	-177.8	-72.3	-11.2	0	0	0	112.1	E308 A310 K315	E308-D312 WeakPolarHBondContact O-CB 3.46Å; E308-D312 PolarHBondContact O-N 3.35Å; A310-D312 VanDerWaalsContact C-N 3.31Å; A310-D312 PolarHBondContact O-N 3.13Å; D312-K315 PolarHBondContact O-NZ 3.39Å
313	Q	95.1	Very high	88	Confident	78 Å²	78	58 Å²	58	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-113.8	-18.9	-165.5	-60.5	-171.6	12.6	0	0	115.7	L309 K315 F654 I655	L309-Q313 HydrophobicContact CD1-CB 4.14Å; L309-Q313 VanDerWaalsContact CD1-CD 3.5Å; L309-Q313 HydrophobicContact CD1-CG 4.03Å; L309-Q313 WeakPolarHBondContact O-CA 3.42Å; L309-Q313 WeakPolarHBondContact O-CB 3.33Å; L309-Q313 PolarHBondContact O-N 2.92Å; Q313-K315 PolarHBondContact O-N 3.32Å; Q313-F654 HydrophobicContact CB-CB 3.9Å; Q313-F654 HydrophobicContact CG-CB 4.26Å; Q313-F654 WeakPolarHBondContact O-CB 3.39Å; Q313-F654 PolarHBondContact O-N 2.93Å; Q313-F654 VanDerWaalsContact O-N 3.14Å; Q313-F654 PolarHBondContact OE1-O 3.3Å; Q313-I655 HydrophobicContact CB-CD1 4.38Å; Q313-I655 HydrophobicContact CB-CG1 3.53Å
314	L	94.4	Very high	87.5	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	30%	0.298	C	S	.	.			trans	-78	53.8	175.9	-168.3	69.7	0	0	0	111.3	L280 R284 L287 A310 T653 I655 F661 L680	L280-L314 HydrophobicContact CD1-CD1 4.14Å; L280-L314 HydrophobicContact CD1-CG 4.08Å; R284-L314 HydrophobicContact CB-CD2 4.19Å; R284-L314 WeakPolarHBondContact CD-O 3.46Å; R284-L314 HydrophobicContact CG-CB 4.49Å; R284-L314 HydrophobicContact CG-CD2 4.45Å; L287-L314 HydrophobicContact CD2-CD2 4Å; A310-L314 HydrophobicContact CB-CB 4.37Å; A310-L314 HydrophobicContact CB-CD2 4.37Å; A310-L314 WeakPolarHBondContact O-CB 3.33Å; A310-L314 PolarHBondContact O-N 2.85Å; L314-T653 HydrophobicContact CD1-CG2 4.37Å; L314-I655 HydrophobicContact CB-CD1 4.07Å; L314-I655 HydrophobicContact CD1-CD1 4.1Å; L314-F661 HydrophobicContact CD1-CE1 4.31Å; L314-F661 HydrophobicContact CD2-CE1 4.16Å; L314-L680 HydrophobicContact CD1-CD2 4.17Å; L314-L680 HydrophobicContact CD2-CD2 4.1Å
315	K	91.1	Very high	87.1	Confident	88 Å²	88	53.9 Å²	53.9	38%	0.383	27%	0.274	S	S	.	.	S	Bend	trans	-118.6	146.8	177.8	-64.8	173.3	-177.1	134.9	0	108.3	N311 D312 Q313 R317 T653 F654	N311-K315 WeakPolarHBondContact O-CE 3.49Å; N311-K315 PolarHBondContact O-NZ 3.32Å; D312-K315 PolarHBondContact O-NZ 3.39Å; Q313-K315 PolarHBondContact O-N 3.32Å; K315-R317 PolarHBondContact O-N 2.99Å; K315-T653 VanDerWaalsContact O-CA 3.23Å; K315-T653 WeakPolarHBondContact O-CA 3.21Å; K315-T653 WeakPolarHBondContact O-CB 3.33Å; K315-F654 HydrophobicContact CB-CD2 4.11Å; K315-F654 HydrophobicContact CB-CE2 4.23Å
316	V	89.3	Confident	86.7	Confident	43 Å²	43	57.4 Å²	57.4	26%	0.261	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-58.1	122.5	173.7	-178.5	0	0	0	0	108.6	I277 L280 V318	I277-V316 HydrophobicContact CB-CG2 4.5Å; I277-V316 HydrophobicContact CD1-CG1 4.35Å; I277-V316 HydrophobicContact CG1-CG1 3.85Å; I277-V316 HydrophobicContact CG1-CG2 4.26Å; L280-V316 HydrophobicContact CB-CG2 4.35Å; L280-V316 HydrophobicContact CD2-CG2 3.78Å; V316-V318 WeakPolarHBondContact CG1-O 3.23Å
317	R	90.1	Very high	86.3	Confident	99 Å²	99	60.4 Å²	60.4	37%	0.374	30%	0.304	S	S	.	.			trans	-92.6	-28	176.9	-178.9	174.9	179.6	176.7	1.2	112.2	K315 T650 L652 T653 F654 D656	K315-R317 PolarHBondContact O-N 2.99Å; R317-T650 HydrophobicContact CG-CG2 3.93Å; R317-L652 PolarHBondContact N-O 2.81Å; R317-T653 WeakPolarHBondContact CD-O 3.24Å; R317-F654 HydrophobicContact CB-CD2 4.32Å; R317-F654 HydrophobicContact CB-CE1 4.46Å; R317-F654 HydrophobicContact CB-CE2 4.16Å; R317-F654 HydrophobicContact CB-CZ 4.23Å; R317-F654 HydrophobicContact CG-CD1 4.25Å; R317-F654 HydrophobicContact CG-CE1 3.95Å; R317-F654 HydrophobicContact CG-CE2 4.49Å; R317-F654 HydrophobicContact CG-CZ 4.08Å; R317-D656 IonicContact NH1-OD1 2.73Å; R317-D656 PolarHBondContact NH1-OD1 3.36Å
318	V	83.6	Confident	86	Confident	6 Å²	6	58.7 Å²	58.7	4%	0.036	30%	0.296	C	S	.	.	S	Bend	trans	-92.3	132.9	-175.3	-171.6	0	0	0	0	111	V316 F323 Q647 L652	V316-V318 WeakPolarHBondContact CG1-O 3.23Å; V318-F323 HydrophobicContact CG1-CE2 3.49Å; V318-F323 VanDerWaalsContact CG1-CE2 3.49Å; V318-F323 HydrophobicContact CG1-CZ 3.66Å; V318-Q647 HydrophobicContact CG1-CB 4.41Å; V318-L652 HydrophobicContact CG2-CD1 4.5Å
319	P	77.5	Confident	85.8	Confident	59 Å²	59	56.9 Å²	56.9	38%	0.383	29%	0.289	S	S	.	.			trans	-73.9	149.5	179.1	-6.1	22.4	0	0	0	111.8	N321 V322	P319-N321 PolarHBondContact O-N 3.11Å; P319-V322 HydrophobicContact CB-CG2 3.5Å; P319-V322 HydrophobicContact CG-CG2 3.66Å
320	P	67.7	Low	85.7	Confident	65 Å²	65	57.9 Å²	57.9	42%	0.422	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.8	-167.4	20.4	-30.9	0	0	0	116.2	H274 I277	H274-P320 PolarHBondContact CE1-O 3.07Å; H274-P320 VanDerWaalsContact CE1-O 3.28Å; I277-P320 HydrophobicContact CD1-CB 3.95Å
321	N	70	Confident	85.5	Confident	143 Å²	143	58.4 Å²	58.4	77%	0.765	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	30.7	-170	-73.2	1.1	0	0	0	114.5	P319	P319-N321 PolarHBondContact O-N 3.11Å
322	V	73	Confident	85.5	Confident	31 Å²	31	55.2 Å²	55.2	19%	0.188	29%	0.285	C	S	.	.			trans	-102.2	-9.5	-170.8	-155.8	0	0	0	0	114.4	P319 Q324 E643 Q647	P319-V322 HydrophobicContact CB-CG2 3.5Å; P319-V322 HydrophobicContact CG-CG2 3.66Å; V322-Q324 VanDerWaalsContact C-N 3.25Å; V322-Q324 PolarHBondContact O-N 3.09Å; V322-E643 HydrophobicContact CG1-CG 3.64Å; V322-Q647 HydrophobicContact CB-CG 3.92Å; V322-Q647 HydrophobicContact CG1-CG 3.52Å
323	F	75.5	Confident	85.5	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.018	28%	0.277	C	S	.	.	S	Bend	trans	-79.9	2.4	-174.1	-70.9	-79.3	0	0	0	115.4	F269 L273 V318 I325 Q647 V648 F698	F269-F323 HydrophobicContact CE1-CD1 4.16Å; F269-F323 AromaticContact CE1-CE1 3.77Å; F269-F323 HydrophobicContact CE1-CE1 3.77Å; F269-F323 AromaticContact CE1-CZ 3.95Å; F269-F323 HydrophobicContact CE1-CZ 3.95Å; F269-F323 HydrophobicContact CZ-CE1 4.42Å; F269-F323 HydrophobicContact CZ-CZ 4.42Å; L273-F323 HydrophobicContact CD2-CD2 3.39Å; L273-F323 HydrophobicContact CD2-CE2 3.1Å; L273-F323 HydrophobicContact CD2-CZ 4.01Å; L273-F323 HydrophobicContact CG-CE2 4.49Å; V318-F323 HydrophobicContact CG1-CE2 3.49Å; V318-F323 VanDerWaalsContact CG1-CE2 3.49Å; V318-F323 HydrophobicContact CG1-CZ 3.66Å; F323-I325 HydrophobicContact CB-CD1 4.04Å; F323-I325 HydrophobicContact CB-CG1 3.83Å; F323-I325 PolarHBondContact O-N 3.24Å; F323-Q647 HydrophobicContact CE1-CB 4.27Å; F323-Q647 HydrophobicContact CZ-CB 4.29Å; F323-V648 HydrophobicContact CD1-CB 4.44Å; F323-V648 HydrophobicContact CE1-CB 3.71Å; F323-V648 HydrophobicContact CE1-CG2 4.11Å; F323-F698 AromaticContact CD1-CE2 3.97Å; F323-F698 HydrophobicContact CD1-CE2 3.97Å; F323-F698 HydrophobicContact CD1-CZ 4.48Å
324	Q	82.4	Confident	85.5	Confident	55 Å²	55	52.6 Å²	52.6	26%	0.257	27%	0.271	S	S	.	.			trans	49.3	32.4	175.1	-63.3	172.6	-85	0	0	113.9	V322 E326 E327 V328 D640 I641	V322-Q324 VanDerWaalsContact C-N 3.25Å; V322-Q324 PolarHBondContact O-N 3.09Å; Q324-E326 VanDerWaalsContact C-N 3.32Å; Q324-E326 PolarHBondContact O-N 3.47Å; Q324-E327 HydrophobicContact CB-CB 4.24Å; Q324-E327 PolarHBondContact NE2-OE2 2.94Å; Q324-E327 VanDerWaalsContact O-CB 3.27Å; Q324-E327 WeakPolarHBondContact O-CB 3.36Å; Q324-E327 PolarHBondContact O-N 2.88Å; Q324-V328 PolarHBondContact O-N 3.29Å; Q324-V328 VanDerWaalsContact O-N 3.11Å; Q324-D640 PolarHBondContact NE2-O 2.91Å; Q324-I641 HydrophobicContact CB-CG2 4.47Å
325	I	85.1	Confident	85.5	Confident	15 Å²	15	52.6 Å²	52.6	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-37.2	-172.1	-58.8	-72	0	0	0	111.9	I266 N270 F323 E327 V328 I329 F698	I266-I325 HydrophobicContact CG2-CD1 3.27Å; N270-I325 HydrophobicContact CB-CD1 4.03Å; N270-I325 HydrophobicContact CB-CG1 3.8Å; F323-I325 HydrophobicContact CB-CD1 4.04Å; F323-I325 HydrophobicContact CB-CG1 3.83Å; F323-I325 PolarHBondContact O-N 3.24Å; I325-E327 PolarHBondContact O-N 2.96Å; I325-V328 PolarHBondContact O-N 3.5Å; I325-I329 HydrophobicContact CG2-CD1 3.78Å; I325-I329 HydrophobicContact CG2-CG1 4.3Å; I325-I329 WeakPolarHBondContact O-CG1 3.27Å; I325-I329 PolarHBondContact O-N 2.99Å; I325-F698 HydrophobicContact CD1-CE1 4.44Å; I325-F698 HydrophobicContact CD1-CZ 3.95Å
326	E	85.8	Confident	85.8	Confident	171 Å²	171	53.2 Å²	53.2	80%	0.799	28%	0.276	S	S	*	.	H	α-helix	trans	-60.6	-36.4	175	-64.5	-174.4	165.3	0	0	111.8	Q324 S330	Q324-E326 VanDerWaalsContact C-N 3.32Å; Q324-E326 PolarHBondContact O-N 3.47Å; E326-S330 WeakPolarHBondContact O-CB 3.33Å; E326-S330 PolarHBondContact O-N 3.42Å
327	E	86.1	Confident	86.1	Confident	65 Å²	65	59.6 Å²	59.6	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-66.9	-47.4	175.9	-165.9	179.9	170.7	0	0	110.5	Q324 I325 I329 S330 I331	Q324-E327 HydrophobicContact CB-CB 4.24Å; Q324-E327 PolarHBondContact NE2-OE2 2.94Å; Q324-E327 VanDerWaalsContact O-CB 3.27Å; Q324-E327 WeakPolarHBondContact O-CB 3.36Å; Q324-E327 PolarHBondContact O-N 2.88Å; I325-E327 PolarHBondContact O-N 2.96Å; E327-I329 VanDerWaalsContact C-N 3.35Å; E327-I329 PolarHBondContact O-N 3.25Å; E327-S330 WeakPolarHBondContact O-CB 3.41Å; E327-S330 PolarHBondContact O-N 3.32Å; E327-I331 HydrophobicContact CG-CD1 3.87Å; E327-I331 WeakPolarHBondContact O-CB 3.34Å; E327-I331 WeakPolarHBondContact O-CD1 3.32Å; E327-I331 VanDerWaalsContact O-CG1 3.28Å; E327-I331 WeakPolarHBondContact O-CG1 3.41Å; E327-I331 PolarHBondContact O-N 2.86Å
328	V	89.2	Confident	86.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.3	-44.9	176.1	176.9	0	0	0	0	111.4	I263 I266 Q324 I325 S332 I641 F698 F701	I263-V328 HydrophobicContact CD1-CG1 3.82Å; I266-V328 HydrophobicContact CD1-CG1 4.4Å; Q324-V328 PolarHBondContact O-N 3.29Å; Q324-V328 VanDerWaalsContact O-N 3.11Å; I325-V328 PolarHBondContact O-N 3.5Å; V328-S332 WeakPolarHBondContact O-CB 3.09Å; V328-S332 PolarHBondContact O-N 2.83Å; V328-I641 HydrophobicContact CG2-CG2 4.33Å; V328-F698 HydrophobicContact CG2-CE1 4.2Å; V328-F701 HydrophobicContact CB-CE1 4.47Å; V328-F701 HydrophobicContact CB-CZ 4.34Å; V328-F701 HydrophobicContact CG1-CE1 4.46Å; V328-F701 HydrophobicContact CG1-CE2 4.15Å; V328-F701 HydrophobicContact CG1-CZ 4.09Å; V328-F701 HydrophobicContact CG2-CD1 4.35Å; V328-F701 HydrophobicContact CG2-CE1 3.96Å; V328-F701 HydrophobicContact CG2-CZ 4.32Å
329	I	90.4	Very high	87	Confident	68 Å²	68	59.4 Å²	59.4	35%	0.349	30%	0.299	S	S	.	.	H	α-helix	trans	-66.9	-41.7	177.8	-67.6	170.4	0	0	0	111.1	I325 E327 S332 N333	I325-I329 HydrophobicContact CG2-CD1 3.78Å; I325-I329 HydrophobicContact CG2-CG1 4.3Å; I325-I329 WeakPolarHBondContact O-CG1 3.27Å; I325-I329 PolarHBondContact O-N 2.99Å; E327-I329 VanDerWaalsContact C-N 3.35Å; E327-I329 PolarHBondContact O-N 3.25Å; I329-S332 WeakPolarHBondContact O-CB 3.47Å; I329-S332 PolarHBondContact O-N 3.11Å; I329-N333 PolarHBondContact O-N 2.97Å; I329-N333 PolarHBondContact O-ND2 2.03Å; I329-N333 VanDerWaalsContact O-ND2 3.14Å
330	S	91.2	Very high	87.9	Confident	58 Å²	58	61 Å²	61	41%	0.406	31%	0.309	S	S	.	.	H	α-helix	trans	-59.5	-48.3	176.9	-179.1	0	0	0	0	111.3	E326 E327 N333 Q334	E326-S330 WeakPolarHBondContact O-CB 3.33Å; E326-S330 PolarHBondContact O-N 3.42Å; E327-S330 WeakPolarHBondContact O-CB 3.41Å; E327-S330 PolarHBondContact O-N 3.32Å; S330-N333 PolarHBondContact O-N 2.65Å; S330-Q334 WeakPolarHBondContact O-CG 3.49Å; S330-Q334 PolarHBondContact O-N 3.48Å
331	I	91.6	Very high	89.3	Confident	10 Å²	10	58.9 Å²	58.9	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-65.1	-42.5	176.6	-65.9	155.9	0	0	0	110.6	E327 N333 Q334 I335 L636 V639 F701	E327-I331 HydrophobicContact CG-CD1 3.87Å; E327-I331 WeakPolarHBondContact O-CB 3.34Å; E327-I331 WeakPolarHBondContact O-CD1 3.32Å; E327-I331 VanDerWaalsContact O-CG1 3.28Å; E327-I331 WeakPolarHBondContact O-CG1 3.41Å; E327-I331 PolarHBondContact O-N 2.86Å; I331-N333 VanDerWaalsContact C-N 3.32Å; I331-N333 PolarHBondContact O-N 2.74Å; I331-Q334 CarbonylContact O-C 3.47Å; I331-Q334 WeakPolarHBondContact O-CA 3.36Å; I331-Q334 WeakPolarHBondContact O-CB 3.26Å; I331-Q334 PolarHBondContact O-N 3.45Å; I331-I335 HydrophobicContact CG2-CD1 4.05Å; I331-I335 HydrophobicContact CG2-CG1 4.29Å; I331-I335 WeakPolarHBondContact O-CG1 3.43Å; I331-I335 PolarHBondContact O-N 3.49Å; I331-L636 HydrophobicContact CG2-CD2 3.68Å; I331-V639 HydrophobicContact CD1-CB 4.12Å; I331-V639 HydrophobicContact CD1-CG1 3.81Å; I331-V639 HydrophobicContact CD1-CG2 3.4Å; I331-V639 HydrophobicContact CG1-CG2 4Å; I331-V639 HydrophobicContact CG2-CG2 4.19Å; I331-F701 HydrophobicContact CB-CZ 3.81Å; I331-F701 HydrophobicContact CD1-CE1 3.87Å; I331-F701 HydrophobicContact CD1-CZ 3.72Å; I331-F701 HydrophobicContact CG1-CZ 4.41Å; I331-F701 HydrophobicContact CG2-CE2 4.07Å; I331-F701 HydrophobicContact CG2-CZ 3.61Å
332	S	92.8	Very high	90.6	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.014	26%	0.258	C	S	.	.	H	α-helix	trans	-54.6	-47.1	175.5	-178.8	0	0	0	0	111.7	F256 P258 V328 I329 Q334 I335 Q336	F256-S332 VanDerWaalsContact O-CB 3.26Å; F256-S332 WeakPolarHBondContact O-CB 3.22Å; F256-S332 PolarHBondContact O-OG 2.67Å; P258-S332 WeakPolarHBondContact CD-O 3.39Å; P258-S332 VanDerWaalsContact CD-OG 3.28Å; P258-S332 WeakPolarHBondContact CD-OG 3.28Å; P258-S332 WeakPolarHBondContact CG-OG 3.29Å; V328-S332 WeakPolarHBondContact O-CB 3.09Å; V328-S332 PolarHBondContact O-N 2.83Å; I329-S332 WeakPolarHBondContact O-CB 3.47Å; I329-S332 PolarHBondContact O-N 3.11Å; S332-Q334 VanDerWaalsContact C-N 3.32Å; S332-Q334 PolarHBondContact O-N 3.49Å; S332-I335 PolarHBondContact O-N 3.39Å; S332-Q336 PolarHBondContact O-N 2.85Å
333	N	94.6	Very high	91.7	Very high	67 Å²	67	53.8 Å²	53.8	36%	0.358	27%	0.266	S	S	.	.	H	α-helix	trans	-65.8	-32.6	174.5	-71.4	-39.1	0	0	0	112.7	P258 I329 S330 I331 R337	P258-N333 VanDerWaalsContact CG-OD1 3.31Å; P258-N333 WeakPolarHBondContact CG-OD1 3.35Å; I329-N333 PolarHBondContact O-N 2.97Å; I329-N333 PolarHBondContact O-ND2 2.03Å; I329-N333 VanDerWaalsContact O-ND2 3.14Å; S330-N333 PolarHBondContact O-N 2.65Å; I331-N333 VanDerWaalsContact C-N 3.32Å; I331-N333 PolarHBondContact O-N 2.74Å; N333-R337 WeakPolarHBondContact O-CG 3.45Å; N333-R337 PolarHBondContact O-N 3.49Å; N333-R337 VanDerWaalsContact O-N 3.14Å
334	Q	94.7	Very high	92.6	Very high	54 Å²	54	58 Å²	58	25%	0.252	28%	0.282	S	S	.	.	H	α-helix	trans	-68.5	-42.3	172.4	-72.3	-177.6	3.3	0	0	112	S330 I331 S332 Q336 R337 H338 F635	S330-Q334 WeakPolarHBondContact O-CG 3.49Å; S330-Q334 PolarHBondContact O-N 3.48Å; I331-Q334 CarbonylContact O-C 3.47Å; I331-Q334 WeakPolarHBondContact O-CA 3.36Å; I331-Q334 WeakPolarHBondContact O-CB 3.26Å; I331-Q334 PolarHBondContact O-N 3.45Å; S332-Q334 VanDerWaalsContact C-N 3.32Å; S332-Q334 PolarHBondContact O-N 3.49Å; Q334-Q336 VanDerWaalsContact C-N 3.28Å; Q334-Q336 PolarHBondContact O-N 2.83Å; Q334-R337 VanDerWaalsContact CG-NH2 3.35Å; Q334-R337 PolarHBondContact O-N 3.04Å; Q334-H338 PolarHBondContact O-CD2 3.37Å; Q334-H338 PolarHBondContact O-N 3.27Å; Q334-F635 HydrophobicContact CB-CD2 3.78Å; Q334-F635 HydrophobicContact CB-CE2 3.4Å; Q334-F635 VanDerWaalsContact CB-CE2 3.4Å; Q334-F635 HydrophobicContact CB-CG 4.48Å; Q334-F635 HydrophobicContact CB-CZ 3.84Å; Q334-F635 HydrophobicContact CG-CD2 4.5Å; Q334-F635 VanDerWaalsContact OE1-CG 3.31Å
335	I	94.5	Very high	93.3	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-57.5	-44.6	173.4	-65.5	168.9	0	0	0	109.8	A253 L257 I331 S332 R337 H338 L339 F635 L636	A253-I335 HydrophobicContact CB-CG2 4.24Å; L257-I335 HydrophobicContact CD2-CB 4.46Å; L257-I335 HydrophobicContact CD2-CG2 3.79Å; L257-I335 HydrophobicContact CG-CG2 4.46Å; I331-I335 HydrophobicContact CG2-CD1 4.05Å; I331-I335 HydrophobicContact CG2-CG1 4.29Å; I331-I335 WeakPolarHBondContact O-CG1 3.43Å; I331-I335 PolarHBondContact O-N 3.49Å; S332-I335 PolarHBondContact O-N 3.39Å; I335-R337 PolarHBondContact O-N 2.88Å; I335-H338 CarbonylContact O-C 3.51Å; I335-H338 VanDerWaalsContact O-C 3.31Å; I335-H338 PolarHBondContact O-N 3.34Å; I335-L339 PolarHBondContact O-N 2.94Å; I335-F635 HydrophobicContact CG1-CE2 4.26Å; I335-F635 HydrophobicContact CG1-CZ 4.5Å; I335-L636 HydrophobicContact CD1-CD2 4.06Å; I335-L636 HydrophobicContact CG1-CD2 3.83Å
336	Q	96.7	Very high	93.8	Very high	102 Å²	102	57.2 Å²	57.2	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-61.1	-43.7	177.9	-170.7	176.3	23.7	0	0	112.6	L257 P258 S332 Q334 H338 L339	L257-Q336 HydrophobicContact CD2-CB 3.93Å; L257-Q336 HydrophobicContact CD2-CG 4.37Å; P258-Q336 HydrophobicContact CG-CB 4.12Å; P258-Q336 VanDerWaalsContact CG-OE1 3.31Å; S332-Q336 PolarHBondContact O-N 2.85Å; Q334-Q336 VanDerWaalsContact C-N 3.28Å; Q334-Q336 PolarHBondContact O-N 2.83Å; Q336-H338 PolarHBondContact O-N 2.71Å; Q336-L339 VanDerWaalsContact O-CB 3.31Å; Q336-L339 WeakPolarHBondContact O-CB 3.39Å; Q336-L339 PolarHBondContact O-N 3.45Å
337	R	96.5	Very high	94.2	Very high	177 Å²	177	51.9 Å²	51.9	67%	0.668	26%	0.256	S	S	*	.	H	α-helix	trans	-62.8	-31.4	177.1	-76.1	-173.9	-72.7	-175.7	-3.4	112.9	N333 Q334 I335	N333-R337 WeakPolarHBondContact O-CG 3.45Å; N333-R337 PolarHBondContact O-N 3.49Å; N333-R337 VanDerWaalsContact O-N 3.14Å; Q334-R337 VanDerWaalsContact CG-NH2 3.35Å; Q334-R337 PolarHBondContact O-N 3.04Å; I335-R337 PolarHBondContact O-N 2.88Å
338	H	96.3	Very high	94.6	Very high	59 Å²	59	48.8 Å²	48.8	27%	0.273	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	16.7	178.5	-70.2	-80.6	0	0	0	113.6	Q334 I335 Q336 P340 D341 V342 L633 F635	Q334-H338 PolarHBondContact O-CD2 3.37Å; Q334-H338 PolarHBondContact O-N 3.27Å; I335-H338 CarbonylContact O-C 3.51Å; I335-H338 VanDerWaalsContact O-C 3.31Å; I335-H338 PolarHBondContact O-N 3.34Å; Q336-H338 PolarHBondContact O-N 2.71Å; H338-P340 VanDerWaalsContact C-CD 3.41Å; H338-P340 VanDerWaalsContact C-N 3.31Å; H338-D341 IonicContact ND1-OD2 2.92Å; H338-D341 PolarHBondContact ND1-OD2 2.97Å; H338-D341 WeakPolarHBondContact O-CB 3.42Å; H338-D341 PolarHBondContact O-N 2.81Å; H338-V342 PolarHBondContact O-N 2.83Å; H338-L633 HydrophobicContact CB-CD2 3.64Å; H338-F635 HydrophobicContact CB-CE1 4.1Å; H338-F635 HydrophobicContact CB-CZ 4.31Å; H338-F635 AromaticContact CD2-CE1 3.46Å; H338-F635 VanDerWaalsContact CD2-CE1 3.46Å; H338-F635 WeakPolarHBondContact CD2-CE1 3.48Å; H338-F635 AromaticContact CG-CE1 3.81Å
339	L	96.2	Very high	94.8	Very high	42 Å²	42	50.4 Å²	50.4	22%	0.22	25%	0.25	C	C	.	.	H	α-helix	trans	-56.8	-38	178.8	-175.3	61.8	0	0	0	113.1	R254 L257 I335 Q336 D341 V342 D343	R254-L339 HydrophobicContact CG-CD1 4.37Å; L257-L339 HydrophobicContact CD1-CD1 4.09Å; L257-L339 HydrophobicContact CD1-CD2 4.25Å; L257-L339 HydrophobicContact CD2-CD1 4.38Å; I335-L339 PolarHBondContact O-N 2.94Å; Q336-L339 VanDerWaalsContact O-CB 3.31Å; Q336-L339 WeakPolarHBondContact O-CB 3.39Å; Q336-L339 PolarHBondContact O-N 3.45Å; L339-D341 VanDerWaalsContact C-N 3.25Å; L339-D341 PolarHBondContact O-N 2.84Å; L339-V342 HydrophobicContact CD1-CB 4.37Å; L339-V342 WeakPolarHBondContact O-CB 3.44Å; L339-V342 PolarHBondContact O-N 3.2Å; L339-V342 VanDerWaalsContact O-N 3.09Å; L339-D343 PolarHBondContact O-N 2.76Å
340	P	96.6	Very high	95	Very high	91 Å²	91	52.2 Å²	52.2	59%	0.591	26%	0.255	S	S	*	.	H	α-helix	trans	-58.4	-34.5	173.8	-26.3	36.3	0	0	0	113.8	H338 D343 Y344	H338-P340 VanDerWaalsContact C-CD 3.41Å; H338-P340 VanDerWaalsContact C-N 3.31Å; P340-D343 PolarHBondContact O-N 2.94Å; P340-Y344 VanDerWaalsContact O-CB 3.27Å; P340-Y344 WeakPolarHBondContact O-CB 3.43Å; P340-Y344 PolarHBondContact O-N 3.33Å
341	D	96.8	Very high	95.1	Very high	22 Å²	22	50.2 Å²	50.2	12%	0.118	24%	0.241	C	C	.	.	H	α-helix	trans	-68.3	-41.1	175.3	-70.8	-60.4	0	0	0	111	H338 L339 Y344 A629 R632 L633	H338-D341 IonicContact ND1-OD2 2.92Å; H338-D341 PolarHBondContact ND1-OD2 2.97Å; H338-D341 WeakPolarHBondContact O-CB 3.42Å; H338-D341 PolarHBondContact O-N 2.81Å; L339-D341 VanDerWaalsContact C-N 3.25Å; L339-D341 PolarHBondContact O-N 2.84Å; D341-Y344 PolarHBondContact O-N 3.17Å; D341-A629 HydrophobicContact CB-CB 4.16Å; D341-R632 IonicContact OD1-CZ 3.69Å; D341-R632 IonicContact OD1-NE 2.99Å; D341-R632 PolarHBondContact OD1-NE 3.17Å; D341-R632 IonicContact OD1-NH2 3.11Å; D341-R632 PolarHBondContact OD1-NH2 3.12Å; D341-R632 IonicContact OD2-NE 2.83Å; D341-L633 HydrophobicContact CB-CD1 4.27Å; D341-L633 HydrophobicContact CB-CD2 4.42Å; D341-L633 HydrophobicContact CB-CG 4.25Å
342	V	96.4	Very high	95	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-43.7	174.5	179	0	0	0	0	110.8	F249 Q250 A253 H338 L339 L345 L633	F249-V342 HydrophobicContact CE1-CG2 4.35Å; Q250-V342 HydrophobicContact CB-CG1 4.18Å; Q250-V342 HydrophobicContact CG-CG1 3.87Å; Q250-V342 PolarHBondContact NE2-O 3.5Å; A253-V342 HydrophobicContact CB-CG1 4.32Å; H338-V342 PolarHBondContact O-N 2.83Å; L339-V342 HydrophobicContact CD1-CB 4.37Å; L339-V342 WeakPolarHBondContact O-CB 3.44Å; L339-V342 PolarHBondContact O-N 3.2Å; L339-V342 VanDerWaalsContact O-N 3.09Å; V342-L345 WeakPolarHBondContact O-CB 3.48Å; V342-L345 PolarHBondContact O-N 3.14Å; V342-L633 HydrophobicContact CG2-CD1 4.07Å; V342-L633 HydrophobicContact CG2-CD2 3.96Å
343	D	95.7	Very high	94.8	Very high	66 Å²	66	55.2 Å²	55.2	35%	0.353	27%	0.267	S	S	.	.	H	α-helix	trans	-69.2	-36.3	179.7	-71.3	-21.5	0	0	0	112.4	R254 L339 P340 L345 N346	R254-D343 IonicContact CZ-OD1 3.56Å; R254-D343 IonicContact NE-OD1 3.1Å; R254-D343 PolarHBondContact NE-OD1 3.16Å; R254-D343 IonicContact NH2-OD1 3.64Å; R254-D343 PolarHBondContact NH2-OD1 3.11Å; L339-D343 PolarHBondContact O-N 2.76Å; P340-D343 PolarHBondContact O-N 2.94Å; D343-L345 PolarHBondContact O-N 3.38Å; D343-N346 VanDerWaalsContact O-CB 3.3Å; D343-N346 WeakPolarHBondContact O-CB 3.44Å; D343-N346 PolarHBondContact O-N 3.45Å; D343-N346 VanDerWaalsContact O-N 3.12Å; D343-N346 PolarHBondContact O-ND2 3.38Å
344	Y	95.6	Very high	94.6	Very high	92 Å²	92	55.6 Å²	55.6	36%	0.361	27%	0.269	S	S	.	.	H	α-helix	trans	-60.5	-27.3	178.1	-174.1	-87.6	0	0	0	112.5	P340 D341 N346 E347 S625	P340-Y344 VanDerWaalsContact O-CB 3.27Å; P340-Y344 WeakPolarHBondContact O-CB 3.43Å; P340-Y344 PolarHBondContact O-N 3.33Å; D341-Y344 PolarHBondContact O-N 3.17Å; Y344-N346 PolarHBondContact O-N 2.9Å; Y344-E347 HydrophobicContact CE1-CB 4.22Å; Y344-E347 HydrophobicContact CE2-CG 4.46Å; Y344-E347 WeakPolarHBondContact O-CB 3.37Å; Y344-E347 PolarHBondContact O-N 2.77Å; Y344-S625 WeakPolarHBondContact OH-CB 3.27Å; Y344-S625 PolarHBondContact OH-OG 3.24Å
345	L	96.3	Very high	94.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.4	176.6	-59.2	174.4	0	0	0	113.5	I246 F249 Q250 V342 D343 E347 F348 C626 A629 F630	I246-L345 HydrophobicContact CG2-CB 3.57Å; I246-L345 HydrophobicContact CG2-CD1 4.42Å; F249-L345 HydrophobicContact CD1-CD1 3.73Å; F249-L345 HydrophobicContact CE1-CD1 3.78Å; Q250-L345 HydrophobicContact CG-CB 4.48Å; Q250-L345 HydrophobicContact CG-CD1 4.23Å; V342-L345 WeakPolarHBondContact O-CB 3.48Å; V342-L345 PolarHBondContact O-N 3.14Å; D343-L345 PolarHBondContact O-N 3.38Å; L345-E347 PolarHBondContact O-N 2.95Å; L345-F348 PolarHBondContact O-N 2.9Å; L345-C626 HydrophobicContact CD2-CB 3.96Å; L345-A629 HydrophobicContact CD2-CB 4.11Å; L345-F630 HydrophobicContact CD1-CD1 4.47Å; L345-F630 HydrophobicContact CD1-CE1 3.66Å; L345-F630 HydrophobicContact CD1-CE2 4.15Å; L345-F630 HydrophobicContact CD1-CZ 3.47Å; L345-F630 VanDerWaalsContact CD1-CZ 3.47Å; L345-F630 HydrophobicContact CD2-CD2 4Å; L345-F630 HydrophobicContact CD2-CE1 4.4Å; L345-F630 HydrophobicContact CD2-CE2 3.62Å; L345-F630 HydrophobicContact CD2-CZ 3.85Å; L345-F630 HydrophobicContact CG-CZ 4.3Å
346	N	94.9	Very high	94.1	Very high	55 Å²	55	53.9 Å²	53.9	29%	0.294	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.1	172.4	-70	-35.3	0	0	0	113.4	Q250 D343 Y344 F348 N349 K350	Q250-N346 VanDerWaalsContact NE2-CG 3.27Å; Q250-N346 PolarHBondContact NE2-ND2 3.13Å; Q250-N346 PolarHBondContact NE2-OD1 3.25Å; Q250-N346 PolarHBondContact OE1-OD1 2.97Å; Q250-N346 VanDerWaalsContact OE1-OD1 3.07Å; D343-N346 VanDerWaalsContact O-CB 3.3Å; D343-N346 WeakPolarHBondContact O-CB 3.44Å; D343-N346 PolarHBondContact O-N 3.45Å; D343-N346 VanDerWaalsContact O-N 3.12Å; D343-N346 PolarHBondContact O-ND2 3.38Å; Y344-N346 PolarHBondContact O-N 2.9Å; N346-F348 PolarHBondContact O-N 3.23Å; N346-N349 PolarHBondContact O-N 2.97Å; N346-N349 VanDerWaalsContact O-N 3.14Å; N346-K350 PolarHBondContact O-N 2.97Å; N346-K350 VanDerWaalsContact O-N 3.1Å
347	E	95.1	Very high	93.7	Very high	59 Å²	59	52.3 Å²	52.3	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-61	-27.5	178.3	-159.6	61.9	-153.3	0	0	111.9	Y344 L345 K350 T351 T622	Y344-E347 HydrophobicContact CE1-CB 4.22Å; Y344-E347 HydrophobicContact CE2-CG 4.46Å; Y344-E347 WeakPolarHBondContact O-CB 3.37Å; Y344-E347 PolarHBondContact O-N 2.77Å; L345-E347 PolarHBondContact O-N 2.95Å; E347-K350 PolarHBondContact O-N 2.59Å; E347-K350 WeakPolarHBondContact OE2-CD 3.46Å; E347-K350 IonicContact OE2-NZ 3.12Å; E347-K350 PolarHBondContact OE2-NZ 3.32Å; E347-T351 WeakPolarHBondContact O-CB 3.46Å; E347-T351 PolarHBondContact O-N 2.66Å; E347-T351 PolarHBondContact O-OG1 2.63Å; E347-T622 HydrophobicContact CB-CG2 4.23Å; E347-T622 HydrophobicContact CG-CG2 4.27Å
348	F	95.2	Very high	93.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-51.8	171.9	-175.5	-97.9	0	0	0	111.7	A239 V242 I246 L345 N346 K350 T351 I352 T622 L715 Y718	A239-F348 HydrophobicContact CB-CZ 4.49Å; V242-F348 HydrophobicContact CB-CD1 4.27Å; V242-F348 HydrophobicContact CB-CE1 3.45Å; V242-F348 VanDerWaalsContact CB-CE1 3.45Å; V242-F348 HydrophobicContact CB-CE2 4.4Å; V242-F348 HydrophobicContact CB-CZ 3.55Å; V242-F348 HydrophobicContact CG1-CD1 3.82Å; V242-F348 HydrophobicContact CG1-CD2 4.21Å; V242-F348 HydrophobicContact CG1-CE1 3.42Å; V242-F348 VanDerWaalsContact CG1-CE1 3.42Å; V242-F348 HydrophobicContact CG1-CE2 3.86Å; V242-F348 HydrophobicContact CG1-CG 4.2Å; V242-F348 HydrophobicContact CG1-CZ 3.46Å; V242-F348 VanDerWaalsContact CG1-CZ 3.46Å; V242-F348 HydrophobicContact CG2-CE1 4.39Å; V242-F348 HydrophobicContact CG2-CZ 4.01Å; I246-F348 HydrophobicContact CD1-CB 3.95Å; I246-F348 HydrophobicContact CD1-CD1 4.25Å; I246-F348 HydrophobicContact CD1-CG 4.12Å; L345-F348 PolarHBondContact O-N 2.9Å; N346-F348 PolarHBondContact O-N 3.23Å; F348-K350 VanDerWaalsContact C-N 3.34Å; F348-K350 PolarHBondContact O-N 3.19Å; F348-T351 WeakPolarHBondContact O-CB 3.16Å; F348-T351 PolarHBondContact O-N 3.48Å; F348-T351 VanDerWaalsContact O-N 3.12Å; F348-I352 HydrophobicContact CD1-CD1 3.76Å; F348-I352 HydrophobicContact CE1-CD1 3.33Å; F348-I352 HydrophobicContact CE1-CG1 4.42Å; F348-I352 HydrophobicContact CZ-CD1 3.88Å; F348-I352 PolarHBondContact O-N 3.38Å; F348-T622 HydrophobicContact CB-CG2 4.25Å; F348-L715 HydrophobicContact CD2-CD2 4.14Å; F348-L715 HydrophobicContact CE2-CD2 4.28Å; F348-Y718 HydrophobicContact CE2-CD1 4.1Å; F348-Y718 AromaticContact CE2-CE1 3.93Å; F348-Y718 HydrophobicContact CE2-CE1 3.93Å; F348-Y718 HydrophobicContact CZ-CD1 4.34Å; F348-Y718 HydrophobicContact CZ-CD2 4.32Å; F348-Y718 HydrophobicContact CZ-CE1 4.14Å; F348-Y718 HydrophobicContact CZ-CE2 4.11Å; F348-Y718 HydrophobicContact CZ-CG 4.44Å
349	N	93.7	Very high	92.9	Very high	34 Å²	34	44.2 Å²	44.2	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-36.9	178.4	-75	-3	0	0	0	112.3	S243 N346 T351 I352 N353	S243-N349 WeakPolarHBondContact CB-OD1 3.48Å; S243-N349 PolarHBondContact OG-ND2 3.45Å; S243-N349 PolarHBondContact OG-OD1 3.39Å; S243-N349 VanDerWaalsContact OG-OD1 3.04Å; N346-N349 PolarHBondContact O-N 2.97Å; N346-N349 VanDerWaalsContact O-N 3.14Å; N349-T351 VanDerWaalsContact C-N 3.3Å; N349-T351 PolarHBondContact O-N 3.25Å; N349-I352 PolarHBondContact O-N 3.05Å; N349-N353 WeakPolarHBondContact O-CB 3.49Å; N349-N353 VanDerWaalsContact O-CG 3.25Å; N349-N353 PolarHBondContact O-N 3.4Å; N349-N353 PolarHBondContact O-ND2 3.13Å
350	K	93.8	Very high	92.6	Very high	105 Å²	105	46 Å²	46	46%	0.457	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-35.2	173.1	-66.6	-179.8	-162.9	159.7	0	112.7	N346 E347 F348 I352 N354	N346-K350 PolarHBondContact O-N 2.97Å; N346-K350 VanDerWaalsContact O-N 3.1Å; E347-K350 PolarHBondContact O-N 2.59Å; E347-K350 WeakPolarHBondContact OE2-CD 3.46Å; E347-K350 IonicContact OE2-NZ 3.12Å; E347-K350 PolarHBondContact OE2-NZ 3.32Å; F348-K350 VanDerWaalsContact C-N 3.34Å; F348-K350 PolarHBondContact O-N 3.19Å; K350-I352 VanDerWaalsContact C-N 3.32Å; K350-N354 WeakPolarHBondContact O-CB 3.23Å; K350-N354 PolarHBondContact O-N 2.79Å; K350-N354 VanDerWaalsContact O-N 3.15Å; K350-N354 PolarHBondContact O-ND2 3.22Å
351	T	92.7	Very high	92.3	Very high	17 Å²	17	49.2 Å²	49.2	10%	0.104	24%	0.239	C	C	.	.	H	α-helix	trans	-66.1	-39.1	178	-55.7	0	0	0	0	110.5	E347 F348 N349 P618 F619 T622	E347-T351 WeakPolarHBondContact O-CB 3.46Å; E347-T351 PolarHBondContact O-N 2.66Å; E347-T351 PolarHBondContact O-OG1 2.63Å; F348-T351 WeakPolarHBondContact O-CB 3.16Å; F348-T351 PolarHBondContact O-N 3.48Å; F348-T351 VanDerWaalsContact O-N 3.12Å; N349-T351 VanDerWaalsContact C-N 3.3Å; N349-T351 PolarHBondContact O-N 3.25Å; T351-P618 HydrophobicContact CG2-CB 4.46Å; T351-F619 HydrophobicContact CG2-CD1 3.89Å; T351-F619 HydrophobicContact CG2-CD2 4.08Å; T351-F619 HydrophobicContact CG2-CE1 3.83Å; T351-F619 HydrophobicContact CG2-CE2 4.05Å; T351-F619 HydrophobicContact CG2-CG 4.03Å; T351-F619 HydrophobicContact CG2-CZ 3.92Å; T351-T622 PolarHBondContact OG1-OG1 3.15Å
352	I	89.8	Confident	91.8	Very high	8 Å²	8	51.6 Å²	51.6	4%	0.041	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-53.6	175.1	-62.7	161.3	0	0	0	111.1	A239 F348 N349 K350 N354 L355 F619	A239-I352 HydrophobicContact CB-CD1 3.62Å; A239-I352 HydrophobicContact CB-CG1 4.29Å; F348-I352 HydrophobicContact CD1-CD1 3.76Å; F348-I352 HydrophobicContact CE1-CD1 3.33Å; F348-I352 HydrophobicContact CE1-CG1 4.42Å; F348-I352 HydrophobicContact CZ-CD1 3.88Å; F348-I352 PolarHBondContact O-N 3.38Å; N349-I352 PolarHBondContact O-N 3.05Å; K350-I352 VanDerWaalsContact C-N 3.32Å; I352-N354 PolarHBondContact O-N 3Å; I352-N354 VanDerWaalsContact O-N 3.15Å; I352-L355 WeakPolarHBondContact O-CB 3.16Å; I352-L355 PolarHBondContact O-N 3.39Å; I352-F619 HydrophobicContact CG1-CE1 3.73Å; I352-F619 HydrophobicContact CG1-CZ 4.19Å
353	N	89.4	Confident	91.4	Very high	108 Å²	108	52.1 Å²	52.1	58%	0.578	26%	0.26	S	S	*	.	H	α-helix	trans	-69.2	-15.1	-173.3	-65.5	-11.4	0	0	0	113.9	N349	N349-N353 WeakPolarHBondContact O-CB 3.49Å; N349-N353 VanDerWaalsContact O-CG 3.25Å; N349-N353 PolarHBondContact O-N 3.4Å; N349-N353 PolarHBondContact O-ND2 3.13Å
354	N	89.4	Confident	91	Very high	76 Å²	76	50.7 Å²	50.7	41%	0.406	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	4.6	174.1	-71.7	-50.5	0	0	0	112.6	K350 I352 V357 N358	K350-N354 WeakPolarHBondContact O-CB 3.23Å; K350-N354 PolarHBondContact O-N 2.79Å; K350-N354 VanDerWaalsContact O-N 3.15Å; K350-N354 PolarHBondContact O-ND2 3.22Å; I352-N354 PolarHBondContact O-N 3Å; I352-N354 VanDerWaalsContact O-N 3.15Å; N354-V357 PolarHBondContact O-N 2.8Å; N354-N358 VanDerWaalsContact O-CB 3.29Å; N354-N358 WeakPolarHBondContact O-CB 3.41Å; N354-N358 PolarHBondContact O-N 3.48Å; N354-N358 PolarHBondContact O-ND2 2.99Å
355	L	89.6	Confident	90.7	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-55.2	-175.9	177.2	58.7	0	0	0	111.3	F229 E230 F233 I352 V357 N358 V359 L615 F619	F229-L355 HydrophobicContact CE1-CD1 4.28Å; F229-L355 HydrophobicContact CE1-CD2 3.92Å; F229-L355 HydrophobicContact CE1-CG 4.05Å; E230-L355 HydrophobicContact CG-CB 4.31Å; E230-L355 HydrophobicContact CG-CD2 4.49Å; F233-L355 HydrophobicContact CB-CD2 3.95Å; F233-L355 HydrophobicContact CD1-CD2 3.33Å; F233-L355 HydrophobicContact CE1-CD2 3.95Å; F233-L355 HydrophobicContact CG-CD2 3.68Å; I352-L355 WeakPolarHBondContact O-CB 3.16Å; I352-L355 PolarHBondContact O-N 3.39Å; L355-V357 VanDerWaalsContact C-N 3.26Å; L355-V357 PolarHBondContact O-N 2.89Å; L355-N358 PolarHBondContact O-N 2.83Å; L355-V359 HydrophobicContact CD1-CG2 3.93Å; L355-V359 HydrophobicContact CG-CG2 4.42Å; L355-V359 WeakPolarHBondContact O-CB 3.26Å; L355-V359 WeakPolarHBondContact O-CG2 3.46Å; L355-V359 PolarHBondContact O-N 3.43Å; L355-L615 HydrophobicContact CD1-CD1 4.36Å; L355-L615 HydrophobicContact CD1-CD2 3.69Å; L355-F619 HydrophobicContact CD1-CE2 4.22Å
356	A	88.8	Confident	90.2	Very high	13 Å²	13	53.5 Å²	53.5	11%	0.107	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-41.8	179.4	0	0	0	0	0	111.7	L226 E230 K360	L226-A356 HydrophobicContact CB-CB 4.32Å; E230-A356 HydrophobicContact CB-CB 4.2Å; E230-A356 VanDerWaalsContact OE2-CB 3.25Å; E230-A356 WeakPolarHBondContact OE2-CB 3.48Å; E230-A356 PolarHBondContact OE2-N 2.97Å; A356-K360 WeakPolarHBondContact O-CB 3.38Å; A356-K360 PolarHBondContact O-N 3.36Å
357	V	89.2	Confident	89.8	Confident	70 Å²	70	51 Å²	51	42%	0.424	26%	0.263	S	S	.	.	H	α-helix	trans	-65	-43.5	179.1	179.6	0	0	0	0	111.7	N354 L355 K360 R361	N354-V357 PolarHBondContact O-N 2.8Å; L355-V357 VanDerWaalsContact C-N 3.26Å; L355-V357 PolarHBondContact O-N 2.89Å; V357-K360 PolarHBondContact O-N 3.31Å; V357-R361 WeakPolarHBondContact O-CB 3.49Å; V357-R361 PolarHBondContact O-N 3.2Å
358	N	87.9	Confident	89.3	Confident	66 Å²	66	50.5 Å²	50.5	35%	0.353	26%	0.263	S	S	.	.	H	α-helix	trans	-70.5	-38.8	-179.4	-71.2	-22.5	0	0	0	112.1	N354 L355 R361 S362	N354-N358 VanDerWaalsContact O-CB 3.29Å; N354-N358 WeakPolarHBondContact O-CB 3.41Å; N354-N358 PolarHBondContact O-N 3.48Å; N354-N358 PolarHBondContact O-ND2 2.99Å; L355-N358 PolarHBondContact O-N 2.83Å; N358-R361 PolarHBondContact O-N 2.95Å; N358-R361 PolarHBondContact OD1-NH1 2.9Å; N358-S362 PolarHBondContact O-N 3.05Å; N358-S362 PolarHBondContact O-OG 2.77Å
359	V	88.9	Confident	88.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-52.9	172.7	173.9	0	0	0	0	109.5	L226 F229 L355 R361 S362 I363 F610 I613 L615	L226-V359 HydrophobicContact CD1-CG1 4.41Å; L226-V359 HydrophobicContact CD2-CB 4.2Å; L226-V359 HydrophobicContact CD2-CG1 3.36Å; F229-V359 HydrophobicContact CE1-CG2 4.12Å; L355-V359 HydrophobicContact CD1-CG2 3.93Å; L355-V359 HydrophobicContact CG-CG2 4.42Å; L355-V359 WeakPolarHBondContact O-CB 3.26Å; L355-V359 WeakPolarHBondContact O-CG2 3.46Å; L355-V359 PolarHBondContact O-N 3.43Å; V359-R361 VanDerWaalsContact C-N 3.3Å; V359-R361 PolarHBondContact O-N 3.18Å; V359-S362 WeakPolarHBondContact O-CB 3.48Å; V359-S362 PolarHBondContact O-N 3.15Å; V359-I363 WeakPolarHBondContact O-CG1 3.42Å; V359-I363 PolarHBondContact O-N 3.42Å; V359-F610 HydrophobicContact CG1-CD2 4.07Å; V359-F610 HydrophobicContact CG1-CE2 3.6Å; V359-I613 HydrophobicContact CB-CD1 4.41Å; V359-I613 HydrophobicContact CG1-CD1 3.69Å; V359-L615 HydrophobicContact CG2-CD1 4.46Å; V359-L615 HydrophobicContact CG2-CD2 3.73Å
360	K	89.9	Confident	88	Confident	79 Å²	79	55.3 Å²	55.3	34%	0.343	28%	0.28	S	S	.	.	H	α-helix	trans	-52.5	-48.3	177.6	-173.8	173.6	177	169.4	0	111.7	D223 L226 A356 V357 S362 I363 S364	D223-K360 VanDerWaalsContact OD1-CD 3.27Å; D223-K360 WeakPolarHBondContact OD1-CD 3.43Å; D223-K360 WeakPolarHBondContact OD1-CE 3.31Å; D223-K360 IonicContact OD1-NZ 2.84Å; D223-K360 PolarHBondContact OD1-NZ 3.07Å; D223-K360 IonicContact OD2-NZ 3.13Å; D223-K360 PolarHBondContact OD2-NZ 3.29Å; L226-K360 HydrophobicContact CD1-CB 3.52Å; L226-K360 HydrophobicContact CD1-CG 4.07Å; A356-K360 WeakPolarHBondContact O-CB 3.38Å; A356-K360 PolarHBondContact O-N 3.36Å; V357-K360 PolarHBondContact O-N 3.31Å; K360-S362 VanDerWaalsContact C-N 3.27Å; K360-S362 PolarHBondContact O-N 3.33Å; K360-I363 PolarHBondContact O-N 3.11Å; K360-S364 PolarHBondContact O-N 3.44Å
361	R	88.9	Confident	87.2	Confident	159 Å²	159	50.7 Å²	50.7	60%	0.6	26%	0.26	S	S	*	.	H	α-helix	trans	-61.1	-36.9	179.5	-167.7	-177.3	-61	105.4	-1.3	112.3	V357 N358 V359 I363	V357-R361 WeakPolarHBondContact O-CB 3.49Å; V357-R361 PolarHBondContact O-N 3.2Å; N358-R361 PolarHBondContact O-N 2.95Å; N358-R361 PolarHBondContact OD1-NH1 2.9Å; V359-R361 VanDerWaalsContact C-N 3.3Å; V359-R361 PolarHBondContact O-N 3.18Å; R361-I363 VanDerWaalsContact C-N 3.34Å
362	S	87.1	Confident	86.5	Confident	72 Å²	72	52.9 Å²	52.9	50%	0.503	27%	0.271	S	S	.	.	H	α-helix	trans	-71.9	-28	-178.3	-56.3	0	0	0	0	113.1	N358 V359 K360	N358-S362 PolarHBondContact O-N 3.05Å; N358-S362 PolarHBondContact O-OG 2.77Å; V359-S362 WeakPolarHBondContact O-CB 3.48Å; V359-S362 PolarHBondContact O-N 3.15Å; K360-S362 VanDerWaalsContact C-N 3.27Å; K360-S362 PolarHBondContact O-N 3.33Å
363	I	87.5	Confident	85.7	Confident	11 Å²	11	57.2 Å²	57.2	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-106.9	-1	-178.9	64.6	175	0	0	0	113.7	I222 V359 K360 R361 D365 D366 L367 F610 I613	I222-I363 HydrophobicContact CG2-CD1 4.49Å; V359-I363 WeakPolarHBondContact O-CG1 3.42Å; V359-I363 PolarHBondContact O-N 3.42Å; K360-I363 PolarHBondContact O-N 3.11Å; R361-I363 VanDerWaalsContact C-N 3.34Å; I363-D365 VanDerWaalsContact C-N 3.33Å; I363-D365 PolarHBondContact O-N 3.32Å; I363-D366 WeakPolarHBondContact O-CB 3.39Å; I363-D366 PolarHBondContact O-N 3.41Å; I363-D366 VanDerWaalsContact O-N 3.09Å; I363-L367 HydrophobicContact CB-CD1 4.49Å; I363-L367 HydrophobicContact CD1-CD1 3.86Å; I363-L367 HydrophobicContact CD1-CG 4.38Å; I363-L367 HydrophobicContact CG1-CD1 3.72Å; I363-L367 HydrophobicContact CG1-CG 4.27Å; I363-L367 WeakPolarHBondContact O-CG 2.97Å; I363-L367 PolarHBondContact O-N 3.25Å; I363-F610 HydrophobicContact CD1-CD2 4.44Å; I363-I613 HydrophobicContact CG2-CD1 3.49Å; I363-I613 VanDerWaalsContact CG2-CD1 3.49Å; I363-I613 HydrophobicContact CG2-CG1 4.06Å
364	S	88.4	Confident	84.9	Confident	36 Å²	36	52.4 Å²	52.4	25%	0.252	27%	0.268	S	S	.	.	H	α-helix	trans	-56.1	-47.1	-174.7	-168	0	0	0	0	112	K360 D366 L367 D368	K360-S364 PolarHBondContact O-N 3.44Å; S364-D366 VanDerWaalsContact C-N 3.32Å; S364-D366 PolarHBondContact O-N 3.04Å; S364-L367 WeakPolarHBondContact O-CB 2.95Å; S364-L367 PolarHBondContact O-N 3.5Å; S364-D368 PolarHBondContact O-N 2.79Å
365	D	88.6	Confident	83.9	Confident	108 Å²	108	49.5 Å²	49.5	58%	0.578	26%	0.255	S	S	*	.	H	α-helix	trans	-68.6	-32.8	-179.9	-63	-10.9	0	0	0	112.1	I363 R369	I363-D365 VanDerWaalsContact C-N 3.33Å; I363-D365 PolarHBondContact O-N 3.32Å; D365-R369 WeakPolarHBondContact O-CB 2.98Å; D365-R369 VanDerWaalsContact O-CG 3.3Å; D365-R369 WeakPolarHBondContact O-CG 3.4Å; D365-R369 PolarHBondContact O-N 3.45Å
366	D	86.1	Confident	82.8	Confident	43 Å²	43	55.6 Å²	55.6	23%	0.23	28%	0.283	C	S	.	.	H	α-helix	trans	-69.3	-38.7	174.6	-78.8	-42.7	0	0	0	111.7	I363 S364 R369 A370 S609	I363-D366 WeakPolarHBondContact O-CB 3.39Å; I363-D366 PolarHBondContact O-N 3.41Å; I363-D366 VanDerWaalsContact O-N 3.09Å; S364-D366 VanDerWaalsContact C-N 3.32Å; S364-D366 PolarHBondContact O-N 3.04Å; D366-R369 PolarHBondContact O-N 3.36Å; D366-R369 IonicContact OD1-CZ 3.71Å; D366-R369 IonicContact OD1-NE 2.8Å; D366-R369 IonicContact OD1-NH2 3.26Å; D366-R369 PolarHBondContact OD1-NH2 3Å; D366-A370 WeakPolarHBondContact O-CB 3.19Å; D366-A370 PolarHBondContact O-N 2.97Å; D366-S609 PolarHBondContact OD1-OG 3.11Å; D366-S609 WeakPolarHBondContact OD2-CB 3.36Å; D366-S609 PolarHBondContact OD2-OG 2.8Å
367	L	85.7	Confident	81.8	Confident	3 Å²	3	56 Å²	56	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-45	174.1	-71.4	165.1	0	0	0	111.2	F218 M219 I222 I363 S364 A370 W371 L606	F218-L367 HydrophobicContact CE1-CD2 3.77Å; F218-L367 HydrophobicContact CZ-CD2 4.02Å; M219-L367 HydrophobicContact CE-CB 4.41Å; M219-L367 HydrophobicContact SD-CB 4.23Å; M219-L367 HydrophobicContact SD-CD1 4.49Å; I222-L367 HydrophobicContact CD1-CD2 3.75Å; I222-L367 HydrophobicContact CG1-CD2 3.78Å; I222-L367 HydrophobicContact CG2-CD1 3.78Å; I222-L367 HydrophobicContact CG2-CD2 4.41Å; I363-L367 HydrophobicContact CB-CD1 4.49Å; I363-L367 HydrophobicContact CD1-CD1 3.86Å; I363-L367 HydrophobicContact CD1-CG 4.38Å; I363-L367 HydrophobicContact CG1-CD1 3.72Å; I363-L367 HydrophobicContact CG1-CG 4.27Å; I363-L367 WeakPolarHBondContact O-CG 2.97Å; I363-L367 PolarHBondContact O-N 3.25Å; S364-L367 WeakPolarHBondContact O-CB 2.95Å; S364-L367 PolarHBondContact O-N 3.5Å; L367-A370 PolarHBondContact O-N 3.37Å; L367-W371 WeakPolarHBondContact O-CB 3.39Å; L367-W371 PolarHBondContact O-N 3.27Å; L367-L606 HydrophobicContact CD2-CD1 4.44Å; L367-L606 HydrophobicContact CD2-CD2 3.67Å; L367-L606 HydrophobicContact CG-CD2 4.23Å
368	D	84.6	Confident	80.6	Confident	48 Å²	48	56.6 Å²	56.6	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-65.3	-40.7	176.8	-83.7	-42.1	0	0	0	111.6	K215 S364 W371 N372	K215-D368 VanDerWaalsContact CE-OD1 3.3Å; K215-D368 WeakPolarHBondContact CE-OD1 3.25Å; K215-D368 IonicContact NZ-OD1 3.8Å; K215-D368 PolarHBondContact NZ-OD1 2.88Å; S364-D368 PolarHBondContact O-N 2.79Å; D368-W371 PolarHBondContact O-N 3.46Å; D368-N372 VanDerWaalsContact O-CB 3.28Å; D368-N372 WeakPolarHBondContact O-CB 3.38Å; D368-N372 PolarHBondContact O-N 3.39Å; D368-N372 PolarHBondContact O-ND2 3.32Å; D368-N372 VanDerWaalsContact O-ND2 3.15Å
369	R	82.4	Confident	79.4	Confident	125 Å²	125	61.2 Å²	61.2	47%	0.472	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-51	172.6	-80.2	-169.9	-65.7	-88.5	8.9	111.9	D365 D366 W371 N372 D373	D365-R369 WeakPolarHBondContact O-CB 2.98Å; D365-R369 VanDerWaalsContact O-CG 3.3Å; D365-R369 WeakPolarHBondContact O-CG 3.4Å; D365-R369 PolarHBondContact O-N 3.45Å; D366-R369 PolarHBondContact O-N 3.36Å; D366-R369 IonicContact OD1-CZ 3.71Å; D366-R369 IonicContact OD1-NE 2.8Å; D366-R369 IonicContact OD1-NH2 3.26Å; D366-R369 PolarHBondContact OD1-NH2 3Å; R369-W371 PolarHBondContact O-N 3Å; R369-N372 PolarHBondContact O-N 2.86Å; R369-N372 VanDerWaalsContact O-N 3.13Å; R369-D373 WeakPolarHBondContact O-CB 3.33Å; R369-D373 VanDerWaalsContact O-CG 3.27Å; R369-D373 PolarHBondContact O-N 3.48Å
370	A	78.9	Confident	78.2	Confident	9 Å²	9	62.1 Å²	62.1	7%	0.074	31%	0.313	C	S	.	.	H	α-helix	trans	-55.4	-42.3	178	0	0	0	0	0	111.9	D366 L367 L374 I602 L606	D366-A370 WeakPolarHBondContact O-CB 3.19Å; D366-A370 PolarHBondContact O-N 2.97Å; L367-A370 PolarHBondContact O-N 3.37Å; A370-L374 PolarHBondContact O-N 2.9Å; A370-I602 HydrophobicContact CB-CG2 3.85Å; A370-L606 HydrophobicContact CB-CD1 4.08Å; A370-L606 HydrophobicContact CB-CD2 3.7Å; A370-L606 HydrophobicContact CB-CG 3.92Å
371	W	77.8	Confident	77	Confident	8 Å²	8	60.3 Å²	60.3	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-66.8	-47.5	175.8	-172.6	-92.6	0	0	0	112.4	L211 Q214 K215 F218 L367 D368 R369 D373 L374 A375 A748	L211-W371 HydrophobicContact CB-CZ2 3.95Å; L211-W371 HydrophobicContact CD2-CZ2 4.01Å; L211-W371 HydrophobicContact CG-CZ2 4.4Å; L211-W371 WeakPolarHBondContact O-CZ2 3.2Å; Q214-W371 HydrophobicContact CB-CH2 3.77Å; Q214-W371 HydrophobicContact CB-CZ2 3.99Å; Q214-W371 WeakPolarHBondContact O-CH2 3.23Å; K215-W371 HydrophobicContact CB-CD2 3.99Å; K215-W371 HydrophobicContact CB-CG 4.43Å; K215-W371 HydrophobicContact CB-CH2 4.33Å; K215-W371 HydrophobicContact CB-CZ2 3.56Å; K215-W371 HydrophobicContact CD-CD2 4.45Å; K215-W371 HydrophobicContact CD-CG 4.01Å; K215-W371 HydrophobicContact CG-CD2 3.78Å; K215-W371 HydrophobicContact CG-CG 3.81Å; K215-W371 HydrophobicContact CG-CZ2 4.31Å; K215-W371 VanDerWaalsContact N-CH2 3.32Å; F218-W371 HydrophobicContact CB-CE3 3.87Å; F218-W371 HydrophobicContact CB-CH2 4.23Å; F218-W371 HydrophobicContact CB-CZ3 3.46Å; F218-W371 VanDerWaalsContact CB-CZ3 3.46Å; F218-W371 AromaticContact CD1-CE3 3.77Å; F218-W371 HydrophobicContact CD1-CE3 3.77Å; F218-W371 HydrophobicContact CD1-CZ3 4.22Å; F218-W371 HydrophobicContact CD2-CE3 4.14Å; F218-W371 AromaticContact CD2-CZ3 3.97Å; F218-W371 HydrophobicContact CD2-CZ3 3.97Å; F218-W371 HydrophobicContact CE1-CE3 4.34Å; F218-W371 AromaticContact CG-CE3 3.66Å; F218-W371 HydrophobicContact CG-CE3 3.66Å; F218-W371 AromaticContact CG-CZ3 3.63Å; F218-W371 HydrophobicContact CG-CZ3 3.63Å; L367-W371 WeakPolarHBondContact O-CB 3.39Å; L367-W371 PolarHBondContact O-N 3.27Å; D368-W371 PolarHBondContact O-N 3.46Å; R369-W371 PolarHBondContact O-N 3Å; W371-D373 VanDerWaalsContact C-N 3.31Å; W371-D373 PolarHBondContact O-N 2.77Å; W371-L374 PolarHBondContact O-N 2.97Å; W371-L374 VanDerWaalsContact O-N 3.17Å; W371-A375 VanDerWaalsContact O-CB 3.27Å; W371-A375 WeakPolarHBondContact O-CB 3.3Å; W371-A375 PolarHBondContact O-N 2.9Å; W371-A748 HydrophobicContact CH2-CB 3.98Å
372	N	77.5	Confident	76	Confident	64 Å²	64	58.5 Å²	58.5	34%	0.342	30%	0.302	S	S	.	.	H	α-helix	trans	-65.3	-38.1	-179.9	-69.5	-21	0	0	0	111.1	D368 R369 A375 Q376	D368-N372 VanDerWaalsContact O-CB 3.28Å; D368-N372 WeakPolarHBondContact O-CB 3.38Å; D368-N372 PolarHBondContact O-N 3.39Å; D368-N372 PolarHBondContact O-ND2 3.32Å; D368-N372 VanDerWaalsContact O-ND2 3.15Å; R369-N372 PolarHBondContact O-N 2.86Å; R369-N372 VanDerWaalsContact O-N 3.13Å; N372-A375 PolarHBondContact O-N 2.99Å; N372-Q376 WeakPolarHBondContact O-CA 3.32Å; N372-Q376 WeakPolarHBondContact O-CB 3.41Å; N372-Q376 PolarHBondContact O-N 3.38Å
373	D	73.9	Confident	75	Confident	99 Å²	99	58.8 Å²	58.8	53%	0.529	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-45.2	171.7	-73.2	-15.1	0	0	0	109.8	R369 W371 S377	R369-D373 WeakPolarHBondContact O-CB 3.33Å; R369-D373 VanDerWaalsContact O-CG 3.27Å; R369-D373 PolarHBondContact O-N 3.48Å; W371-D373 VanDerWaalsContact C-N 3.31Å; W371-D373 PolarHBondContact O-N 2.77Å; D373-S377 WeakPolarHBondContact O-CA 3.44Å; D373-S377 WeakPolarHBondContact O-CB 3.12Å; D373-S377 PolarHBondContact O-N 3.09Å
374	L	71.5	Confident	73.9	Confident	6 Å²	6	59 Å²	59	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-63.9	-52.2	175.1	-169.1	77.7	0	0	0	112.6	A370 W371 Q376 I602 L745 A748 V749	A370-L374 PolarHBondContact O-N 2.9Å; W371-L374 PolarHBondContact O-N 2.97Å; W371-L374 VanDerWaalsContact O-N 3.17Å; L374-Q376 PolarHBondContact O-N 2.88Å; L374-I602 HydrophobicContact CB-CD1 3.82Å; L374-I602 HydrophobicContact CD1-CD1 3.39Å; L374-I602 HydrophobicContact CG-CD1 4.2Å; L374-L745 HydrophobicContact CD1-CD2 4.48Å; L374-L745 HydrophobicContact CD2-CB 4.41Å; L374-L745 HydrophobicContact CD2-CD2 3.45Å; L374-L745 VanDerWaalsContact CD2-CD2 3.45Å; L374-L745 HydrophobicContact CG-CD2 4.42Å; L374-A748 HydrophobicContact CD2-CB 3.71Å; L374-V749 HydrophobicContact CD1-CG2 3.71Å; L374-V749 HydrophobicContact CD2-CG2 4.35Å; L374-V749 HydrophobicContact CG-CG2 4.15Å
375	A	68	Low	73	Confident	15 Å²	15	57.3 Å²	57.3	12%	0.124	28%	0.284	C	S	.	.	H	α-helix	trans	-74.3	-26.6	-169.5	0	0	0	0	0	112.6	L211 W371 N372 R381	L211-A375 HydrophobicContact CB-CB 4.5Å; L211-A375 HydrophobicContact CD2-CB 3.88Å; W371-A375 VanDerWaalsContact O-CB 3.27Å; W371-A375 WeakPolarHBondContact O-CB 3.3Å; W371-A375 PolarHBondContact O-N 2.9Å; N372-A375 PolarHBondContact O-N 2.99Å; A375-R381 PolarHBondContact O-NH2 2.81Å
376	Q	68.1	Low	72.1	Confident	133 Å²	133	53.8 Å²	53.8	62%	0.621	27%	0.268	S	S	*	.	H	α-helix	trans	-120	-10.5	-174.6	-57.4	-177.2	-3.7	0	0	113.8	N372 L374 P378 R381	N372-Q376 WeakPolarHBondContact O-CA 3.32Å; N372-Q376 WeakPolarHBondContact O-CB 3.41Å; N372-Q376 PolarHBondContact O-N 3.38Å; L374-Q376 PolarHBondContact O-N 2.88Å; Q376-P378 WeakPolarHBondContact O-CD 3.46Å; Q376-P378 VanDerWaalsContact O-N 3.15Å; Q376-R381 PolarHBondContact O-NH1 3.31Å
377	S	66.1	Low	71	Confident	23 Å²	23	53.3 Å²	53.3	16%	0.161	27%	0.266	C	S	.	.			trans	-59.9	118.6	-179.3	171	0	0	0	0	112.1	D373 K379 T380 R381	D373-S377 WeakPolarHBondContact O-CA 3.44Å; D373-S377 WeakPolarHBondContact O-CB 3.12Å; D373-S377 PolarHBondContact O-N 3.09Å; S377-K379 PolarHBondContact O-N 2.71Å; S377-K379 WeakPolarHBondContact OG-CB 3.46Å; S377-K379 PolarHBondContact OG-N 3.49Å; S377-K379 VanDerWaalsContact OG-N 3.08Å; S377-T380 WeakPolarHBondContact CB-OG1 3.43Å; S377-T380 PolarHBondContact O-N 3.41Å; S377-T380 PolarHBondContact OG-N 3Å; S377-T380 PolarHBondContact OG-OG1 2.62Å; S377-R381 PolarHBondContact O-N 2.67Å; S377-R381 PolarHBondContact O-NH1 3.14Å
378	P	65.1	Low	70.1	Confident	82 Å²	82	54.1 Å²	54.1	53%	0.532	27%	0.27	S	S	.	.	H	α-helix	trans	-59.2	-36.4	166.5	-21.3	34.2	0	0	0	110.9	Q376 T380 R381 E382	Q376-P378 WeakPolarHBondContact O-CD 3.46Å; Q376-P378 VanDerWaalsContact O-N 3.15Å; P378-T380 PolarHBondContact O-N 2.79Å; P378-R381 WeakPolarHBondContact O-CB 3.4Å; P378-R381 PolarHBondContact O-N 2.88Å; P378-E382 WeakPolarHBondContact O-CB 3.45Å; P378-E382 VanDerWaalsContact O-CG 3.28Å; P378-E382 WeakPolarHBondContact O-CG 3.29Å; P378-E382 PolarHBondContact O-N 2.95Å
379	K	62.7	Low	69.5	Low	163 Å²	163	55.2 Å²	55.2	71%	0.709	27%	0.273	S	S	*	.	H	α-helix	trans	-63.5	-38.8	-178	-60.7	-179.6	178.1	177.7	0	112.9	S377 K383	S377-K379 PolarHBondContact O-N 2.71Å; S377-K379 WeakPolarHBondContact OG-CB 3.46Å; S377-K379 PolarHBondContact OG-N 3.49Å; S377-K379 VanDerWaalsContact OG-N 3.08Å; K379-K383 WeakPolarHBondContact O-CB 3.31Å; K379-K383 PolarHBondContact O-N 3.38Å
380	T	63.4	Low	68.9	Low	19 Å²	19	55.3 Å²	55.3	12%	0.117	28%	0.279	C	S	.	.	H	α-helix	trans	-67.4	-41.4	178.1	-52.4	0	0	0	0	110.2	S377 P378 L384 L595 A598	S377-T380 WeakPolarHBondContact CB-OG1 3.43Å; S377-T380 PolarHBondContact O-N 3.41Å; S377-T380 PolarHBondContact OG-N 3Å; S377-T380 PolarHBondContact OG-OG1 2.62Å; P378-T380 PolarHBondContact O-N 2.79Å; T380-L384 WeakPolarHBondContact O-CB 3.24Å; T380-L384 PolarHBondContact O-N 3.22Å; T380-L595 HydrophobicContact CG2-CD1 4.32Å; T380-A598 HydrophobicContact CG2-CB 4.15Å
381	R	65.3	Low	68.3	Low	40 Å²	40	58.2 Å²	58.2	15%	0.151	29%	0.293	C	S	.	.	H	α-helix	trans	-65.4	-47.3	174.7	-64.9	-177	-177.6	87.4	2.1	112	T206 A375 Q376 S377 P378 K383 L384 A385	T206-R381 PolarHBondContact O-NE 3.18Å; A375-R381 PolarHBondContact O-NH2 2.81Å; Q376-R381 PolarHBondContact O-NH1 3.31Å; S377-R381 PolarHBondContact O-N 2.67Å; S377-R381 PolarHBondContact O-NH1 3.14Å; P378-R381 WeakPolarHBondContact O-CB 3.4Å; P378-R381 PolarHBondContact O-N 2.88Å; R381-K383 VanDerWaalsContact C-N 3.31Å; R381-K383 PolarHBondContact O-N 2.88Å; R381-L384 PolarHBondContact O-N 2.72Å; R381-A385 WeakPolarHBondContact O-CB 3.29Å; R381-A385 PolarHBondContact O-N 2.79Å
382	E	67	Low	67.9	Low	121 Å²	121	58.8 Å²	58.8	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-59	-43.2	176.7	-77.1	170.1	-175.2	0	0	111.1	P378 A385 S386	P378-E382 WeakPolarHBondContact O-CB 3.45Å; P378-E382 VanDerWaalsContact O-CG 3.28Å; P378-E382 WeakPolarHBondContact O-CG 3.29Å; P378-E382 PolarHBondContact O-N 2.95Å; E382-A385 PolarHBondContact O-N 2.97Å; E382-S386 WeakPolarHBondContact O-CB 3.28Å; E382-S386 PolarHBondContact O-N 2.93Å
383	K	66.5	Low	67.8	Low	79 Å²	79	59.7 Å²	59.7	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-67	-42.1	178.4	-166.7	160.9	-175	160	0	111.8	K379 R381 S386 E597	K379-K383 WeakPolarHBondContact O-CB 3.31Å; K379-K383 PolarHBondContact O-N 3.38Å; R381-K383 VanDerWaalsContact C-N 3.31Å; R381-K383 PolarHBondContact O-N 2.88Å; K383-S386 PolarHBondContact O-N 3.43Å; K383-S386 PolarHBondContact O-OG 3.13Å; K383-E597 WeakPolarHBondContact CE-OE2 3.17Å; K383-E597 IonicContact NZ-OE1 3.59Å; K383-E597 PolarHBondContact NZ-OE1 2.97Å; K383-E597 IonicContact NZ-OE2 2.76Å; K383-E597 PolarHBondContact NZ-OE2 3.38Å
384	L	64.7	Low	67.6	Low	15 Å²	15	60.2 Å²	60.2	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-42.2	174.3	-170.8	60.5	0	0	0	111.7	T380 R381 S386 V387 V591 V594 V749 W753	T380-L384 WeakPolarHBondContact O-CB 3.24Å; T380-L384 PolarHBondContact O-N 3.22Å; R381-L384 PolarHBondContact O-N 2.72Å; L384-S386 VanDerWaalsContact C-N 3.34Å; L384-S386 PolarHBondContact O-N 3.29Å; L384-V387 PolarHBondContact O-N 3.13Å; L384-V591 HydrophobicContact CD1-CG1 4.37Å; L384-V594 HydrophobicContact CD1-CG1 4.31Å; L384-V749 HydrophobicContact CD2-CG1 3.58Å; L384-W753 HydrophobicContact CB-CZ2 3.99Å; L384-W753 HydrophobicContact CD2-CD2 4.04Å; L384-W753 VanDerWaalsContact CD2-CE2 3.49Å; L384-W753 HydrophobicContact CD2-CG 4.18Å; L384-W753 HydrophobicContact CD2-CZ2 3.9Å; L384-W753 HydrophobicContact CG-CD2 4.43Å; L384-W753 HydrophobicContact CG-CH2 4.26Å; L384-W753 HydrophobicContact CG-CZ2 3.54Å
385	A	69.5	Low	67.7	Low	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.5	-37.6	175.6	0	0	0	0	0	112	K204 R381 E382 V387 F388 E389 W753	K204-A385 HydrophobicContact CG-CB 3.66Å; R381-A385 WeakPolarHBondContact O-CB 3.29Å; R381-A385 PolarHBondContact O-N 2.79Å; E382-A385 PolarHBondContact O-N 2.97Å; A385-V387 PolarHBondContact O-N 3.24Å; A385-F388 CarbonylContact O-C 3.57Å; A385-F388 WeakPolarHBondContact O-CA 3.3Å; A385-F388 WeakPolarHBondContact O-CB 3.34Å; A385-F388 PolarHBondContact O-N 3.34Å; A385-F388 VanDerWaalsContact O-N 3.11Å; A385-E389 WeakPolarHBondContact O-CG 3.05Å; A385-E389 PolarHBondContact O-N 3.44Å; A385-W753 HydrophobicContact CB-CZ2 4.25Å
386	S	69.3	Low	68.2	Low	34 Å²	34	62.1 Å²	62.1	24%	0.238	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-29.6	179.5	74.2	0	0	0	0	113	E382 K383 L384 E389 H390	E382-S386 WeakPolarHBondContact O-CB 3.28Å; E382-S386 PolarHBondContact O-N 2.93Å; K383-S386 PolarHBondContact O-N 3.43Å; K383-S386 PolarHBondContact O-OG 3.13Å; L384-S386 VanDerWaalsContact C-N 3.34Å; L384-S386 PolarHBondContact O-N 3.29Å; S386-E389 WeakPolarHBondContact O-CB 3.37Å; S386-E389 PolarHBondContact O-N 3.13Å; S386-H390 PolarHBondContact O-CD2 3.17Å; S386-H390 PolarHBondContact O-N 2.94Å
387	V	62.4	Low	68.6	Low	33 Å²	33	59.9 Å²	59.9	20%	0.2	31%	0.313	C	S	.	.	H	α-helix	trans	-71.7	-43.4	174.4	172.1	0	0	0	0	111.3	L384 A385 E389 H390 I391 V594	L384-V387 PolarHBondContact O-N 3.13Å; A385-V387 PolarHBondContact O-N 3.24Å; V387-E389 PolarHBondContact O-N 2.92Å; V387-H390 PolarHBondContact O-N 2.99Å; V387-H390 VanDerWaalsContact O-N 3.17Å; V387-I391 HydrophobicContact CG1-CD1 4.16Å; V387-I391 WeakPolarHBondContact O-CG1 3.31Å; V387-I391 PolarHBondContact O-N 2.61Å; V387-V594 HydrophobicContact CB-CG1 4.21Å; V387-V594 HydrophobicContact CB-CG2 4.34Å; V387-V594 HydrophobicContact CG1-CG2 3.98Å; V387-V594 HydrophobicContact CG2-CB 4.19Å; V387-V594 HydrophobicContact CG2-CG1 3.37Å; V387-V594 HydrophobicContact CG2-CG2 3.75Å
388	F	68.5	Low	69	Low	21 Å²	21	62.6 Å²	62.6	9%	0.092	33%	0.329	C	S	.	.	H	α-helix	trans	-57.5	-43.3	170.3	-90	-101.5	0	0	0	110.4	V200 A385 H390 I391 M392 F581 I585 F590 W753	V200-F388 HydrophobicContact CG2-CB 4.27Å; A385-F388 CarbonylContact O-C 3.57Å; A385-F388 WeakPolarHBondContact O-CA 3.3Å; A385-F388 WeakPolarHBondContact O-CB 3.34Å; A385-F388 PolarHBondContact O-N 3.34Å; A385-F388 VanDerWaalsContact O-N 3.11Å; F388-H390 PolarHBondContact O-N 3.05Å; F388-I391 PolarHBondContact O-N 3.49Å; F388-M392 WeakPolarHBondContact O-CB 3.37Å; F388-M392 WeakPolarHBondContact O-CG 3.25Å; F388-M392 PolarHBondContact O-N 3.45Å; F388-F581 HydrophobicContact CD1-CE1 4.33Å; F388-F581 AromaticContact CE1-CD1 3.48Å; F388-F581 HydrophobicContact CE1-CD1 3.48Å; F388-F581 VanDerWaalsContact CE1-CD1 3.48Å; F388-F581 AromaticContact CE1-CE1 3.17Å; F388-F581 HydrophobicContact CE1-CE1 3.17Å; F388-F581 HydrophobicContact CE1-CZ 4.26Å; F388-F581 AromaticContact CZ-CD1 3.71Å; F388-F581 HydrophobicContact CZ-CD1 3.71Å; F388-F581 AromaticContact CZ-CE1 3.52Å; F388-F581 HydrophobicContact CZ-CE1 3.52Å; F388-I585 HydrophobicContact CZ-CD1 4.13Å; F388-F590 AromaticContact CE2-CE1 3.9Å; F388-F590 HydrophobicContact CE2-CE1 3.9Å; F388-F590 HydrophobicContact CZ-CE1 4.18Å; F388-W753 HydrophobicContact CB-CH2 3.95Å; F388-W753 HydrophobicContact CB-CZ3 4.3Å; F388-W753 HydrophobicContact CD1-CH2 4.22Å; F388-W753 AromaticContact CD1-CZ3 3.71Å; F388-W753 HydrophobicContact CD1-CZ3 3.71Å; F388-W753 HydrophobicContact CD2-CE3 4.13Å; F388-W753 AromaticContact CD2-CH2 3.12Å; F388-W753 HydrophobicContact CD2-CH2 3.12Å; F388-W753 HydrophobicContact CD2-CZ2 4.28Å; F388-W753 AromaticContact CD2-CZ3 3.07Å; F388-W753 HydrophobicContact CD2-CZ3 3.07Å; F388-W753 HydrophobicContact CE1-CE3 4.35Å; F388-W753 HydrophobicContact CE1-CH2 4.5Å; F388-W753 AromaticContact CE1-CZ3 3.6Å; F388-W753 HydrophobicContact CE1-CZ3 3.6Å; F388-W753 AromaticContact CE2-CE3 3.65Å; F388-W753 HydrophobicContact CE2-CE3 3.65Å; F388-W753 AromaticContact CE2-CH2 3.55Å; F388-W753 HydrophobicContact CE2-CH2 3.55Å; F388-W753 AromaticContact CE2-CZ3 3Å; F388-W753 HydrophobicContact CE2-CZ3 3Å; F388-W753 AromaticContact CG-CH2 3.5Å; F388-W753 HydrophobicContact CG-CH2 3.5Å; F388-W753 AromaticContact CG-CZ3 3.42Å; F388-W753 HydrophobicContact CG-CZ3 3.42Å; F388-W753 VanDerWaalsContact CG-CZ3 3.42Å; F388-W753 AromaticContact CZ-CE3 3.77Å; F388-W753 HydrophobicContact CZ-CE3 3.77Å; F388-W753 HydrophobicContact CZ-CH2 4.22Å; F388-W753 AromaticContact CZ-CZ3 3.28Å; F388-W753 HydrophobicContact CZ-CZ3 3.28Å
389	E	70.8	Confident	69.8	Low	70 Å²	70	59.5 Å²	59.5	33%	0.327	31%	0.307	S	S	.	.	H	α-helix	trans	-59.2	-41.1	173.7	-70.8	-177.7	138.7	0	0	113.5	V200 K204 A385 S386 V387 M392 V393	V200-E389 HydrophobicContact CG1-CG 3.6Å; K204-E389 WeakPolarHBondContact CE-OE1 3.48Å; K204-E389 IonicContact NZ-OE1 3.15Å; K204-E389 PolarHBondContact NZ-OE1 3.44Å; A385-E389 WeakPolarHBondContact O-CG 3.05Å; A385-E389 PolarHBondContact O-N 3.44Å; S386-E389 WeakPolarHBondContact O-CB 3.37Å; S386-E389 PolarHBondContact O-N 3.13Å; V387-E389 PolarHBondContact O-N 2.92Å; E389-M392 CarbonylContact O-C 3.59Å; E389-M392 VanDerWaalsContact O-CB 3.31Å; E389-M392 WeakPolarHBondContact O-CB 3.26Å; E389-M392 PolarHBondContact O-N 2.91Å; E389-V393 WeakPolarHBondContact O-CB 3.22Å; E389-V393 VanDerWaalsContact O-CG2 3.22Å; E389-V393 WeakPolarHBondContact O-CG2 3.45Å; E389-V393 PolarHBondContact O-N 3.19Å
390	H	69	Low	70.6	Confident	128 Å²	128	56.4 Å²	56.4	59%	0.593	29%	0.294	S	S	*	.	H	α-helix	trans	-64.4	-44.1	176.9	-79.2	-58.9	0	0	0	112.2	S386 V387 F388 M392 V393 N394	S386-H390 PolarHBondContact O-CD2 3.17Å; S386-H390 PolarHBondContact O-N 2.94Å; V387-H390 PolarHBondContact O-N 2.99Å; V387-H390 VanDerWaalsContact O-N 3.17Å; F388-H390 PolarHBondContact O-N 3.05Å; H390-M392 VanDerWaalsContact C-N 3.31Å; H390-V393 PolarHBondContact O-N 2.91Å; H390-N394 PolarHBondContact O-N 3.42Å; H390-N394 VanDerWaalsContact O-N 3.15Å
391	I	66.3	Low	71.4	Confident	70 Å²	70	61.3 Å²	61.3	36%	0.359	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-44	175.2	-65.8	168	0	0	0	109.7	V387 F388 V393 N394 V395 F590	V387-I391 HydrophobicContact CG1-CD1 4.16Å; V387-I391 WeakPolarHBondContact O-CG1 3.31Å; V387-I391 PolarHBondContact O-N 2.61Å; F388-I391 PolarHBondContact O-N 3.49Å; I391-V393 VanDerWaalsContact C-N 3.33Å; I391-V393 PolarHBondContact O-N 3.38Å; I391-N394 PolarHBondContact O-N 3.03Å; I391-V395 HydrophobicContact CG2-CG2 4.07Å; I391-V395 WeakPolarHBondContact O-CB 3.35Å; I391-V395 VanDerWaalsContact O-CG2 3.25Å; I391-V395 WeakPolarHBondContact O-CG2 3.38Å; I391-V395 PolarHBondContact O-N 3.06Å; I391-F590 HydrophobicContact CD1-CE2 3.79Å; I391-F590 HydrophobicContact CD1-CZ 3.5Å; I391-F590 VanDerWaalsContact CD1-CZ 3.5Å
392	M	71.2	Confident	72	Confident	19 Å²	19	62.8 Å²	62.8	9%	0.094	32%	0.324	C	S	.	.	H	α-helix	trans	-59.2	-39.7	176.3	-77.6	-82.3	-47.9	0	0	113.4	L196 K197 V200 F388 E389 H390 S396	L196-M392 VanDerWaalsContact C-SD 3.52Å; L196-M392 HydrophobicContact CB-CE 3.55Å; L196-M392 HydrophobicContact CB-SD 3.24Å; L196-M392 WeakPolarHBondContact CB-SD 3.35Å; L196-M392 HydrophobicContact CD1-CE 4.47Å; L196-M392 HydrophobicContact CD1-SD 3.64Å; L196-M392 HydrophobicContact CD2-SD 3.62Å; L196-M392 HydrophobicContact CG-SD 3.64Å; L196-M392 WeakPolarHBondContact O-CE 3.44Å; L196-M392 VanDerWaalsContact O-SD 3.38Å; K197-M392 HydrophobicContact CG-CE 3.98Å; V200-M392 HydrophobicContact CG2-CB 4.49Å; V200-M392 HydrophobicContact CG2-CE 4.1Å; V200-M392 HydrophobicContact CG2-CG 3.49Å; V200-M392 VanDerWaalsContact CG2-CG 3.49Å; V200-M392 HydrophobicContact CG2-SD 3.87Å; F388-M392 WeakPolarHBondContact O-CB 3.37Å; F388-M392 WeakPolarHBondContact O-CG 3.25Å; F388-M392 PolarHBondContact O-N 3.45Å; E389-M392 CarbonylContact O-C 3.59Å; E389-M392 VanDerWaalsContact O-CB 3.31Å; E389-M392 WeakPolarHBondContact O-CB 3.26Å; E389-M392 PolarHBondContact O-N 2.91Å; H390-M392 VanDerWaalsContact C-N 3.31Å; M392-S396 WeakPolarHBondContact O-CA 3.31Å; M392-S396 WeakPolarHBondContact O-CB 3.1Å; M392-S396 PolarHBondContact O-N 3.09Å
393	V	74.4	Confident	72.7	Confident	84 Å²	84	58.9 Å²	58.9	51%	0.509	30%	0.304	S	S	.	.	H	α-helix	trans	-66	-44.3	175.9	167.1	0	0	0	0	109.6	E389 H390 I391 T397	E389-V393 WeakPolarHBondContact O-CB 3.22Å; E389-V393 VanDerWaalsContact O-CG2 3.22Å; E389-V393 WeakPolarHBondContact O-CG2 3.45Å; E389-V393 PolarHBondContact O-N 3.19Å; H390-V393 PolarHBondContact O-N 2.91Å; I391-V393 VanDerWaalsContact C-N 3.33Å; I391-V393 PolarHBondContact O-N 3.38Å; V393-T397 VanDerWaalsContact O-CB 3.31Å; V393-T397 WeakPolarHBondContact O-CB 3.39Å; V393-T397 PolarHBondContact O-N 2.97Å; V393-T397 PolarHBondContact O-OG1 3.08Å
394	N	69.8	Low	73.2	Confident	110 Å²	110	59.3 Å²	59.3	59%	0.588	31%	0.31	S	S	*	.	H	α-helix	trans	-64.5	-44.9	177.6	-69.8	-11.1	0	0	0	111.9	H390 I391 T397 T398	H390-N394 PolarHBondContact O-N 3.42Å; H390-N394 VanDerWaalsContact O-N 3.15Å; I391-N394 PolarHBondContact O-N 3.03Å; N394-T397 PolarHBondContact O-N 2.58Å; N394-T398 WeakPolarHBondContact O-CB 3.47Å; N394-T398 PolarHBondContact O-N 3.06Å; N394-T398 PolarHBondContact O-OG1 3.33Å
395	V	74	Confident	73.6	Confident	44 Å²	44	65.5 Å²	65.5	27%	0.267	33%	0.332	S	S	.	.	H	α-helix	trans	-66.6	-47.6	177.8	172.3	0	0	0	0	110.2	F192 L196 I391 T397 T398 L399	F192-V395 HydrophobicContact CE1-CG1 3.93Å; L196-V395 HydrophobicContact CD1-CB 4.31Å; L196-V395 HydrophobicContact CD1-CG1 3.54Å; I391-V395 HydrophobicContact CG2-CG2 4.07Å; I391-V395 WeakPolarHBondContact O-CB 3.35Å; I391-V395 VanDerWaalsContact O-CG2 3.25Å; I391-V395 WeakPolarHBondContact O-CG2 3.38Å; I391-V395 PolarHBondContact O-N 3.06Å; V395-T397 VanDerWaalsContact C-N 3.3Å; V395-T397 PolarHBondContact O-N 2.93Å; V395-T398 CarbonylContact O-C 3.43Å; V395-T398 WeakPolarHBondContact O-CB 3.47Å; V395-T398 PolarHBondContact O-N 3.23Å; V395-T398 VanDerWaalsContact O-N 3.11Å; V395-L399 HydrophobicContact CG1-CD1 3.61Å; V395-L399 HydrophobicContact CG1-CG 4Å; V395-L399 WeakPolarHBondContact O-CB 3.24Å; V395-L399 WeakPolarHBondContact O-CG 3.31Å; V395-L399 PolarHBondContact O-N 3.29Å
396	S	78.5	Confident	73.7	Confident	17 Å²	17	66.9 Å²	66.9	12%	0.119	34%	0.339	C	S	.	.	H	α-helix	trans	-58.6	-40.6	175.7	179.3	0	0	0	0	111.7	M392 L399 K400	M392-S396 WeakPolarHBondContact O-CA 3.31Å; M392-S396 WeakPolarHBondContact O-CB 3.1Å; M392-S396 PolarHBondContact O-N 3.09Å; S396-L399 PolarHBondContact O-N 3.01Å; S396-K400 VanDerWaalsContact O-CB 3.27Å; S396-K400 WeakPolarHBondContact O-CB 3.48Å; S396-K400 VanDerWaalsContact O-CG 3.23Å; S396-K400 WeakPolarHBondContact O-CG 3.12Å; S396-K400 PolarHBondContact O-N 3.28Å
397	T	76.5	Confident	73.6	Confident	85 Å²	85	66.8 Å²	66.8	52%	0.521	34%	0.339	S	S	.	.	H	α-helix	trans	-65.3	-41.3	176.2	-53.2	0	0	0	0	111.1	V393 N394 V395 K400 F401	V393-T397 VanDerWaalsContact O-CB 3.31Å; V393-T397 WeakPolarHBondContact O-CB 3.39Å; V393-T397 PolarHBondContact O-N 2.97Å; V393-T397 PolarHBondContact O-OG1 3.08Å; N394-T397 PolarHBondContact O-N 2.58Å; V395-T397 VanDerWaalsContact C-N 3.3Å; V395-T397 PolarHBondContact O-N 2.93Å; T397-K400 PolarHBondContact O-N 2.88Å; T397-F401 WeakPolarHBondContact O-CB 3.48Å; T397-F401 PolarHBondContact O-N 3.21Å
398	T	75.2	Confident	73.3	Confident	81 Å²	81	68.4 Å²	68.4	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-67.3	-43.9	176.4	-54.9	0	0	0	0	111.6	N394 V395 F401 I402	N394-T398 WeakPolarHBondContact O-CB 3.47Å; N394-T398 PolarHBondContact O-N 3.06Å; N394-T398 PolarHBondContact O-OG1 3.33Å; V395-T398 CarbonylContact O-C 3.43Å; V395-T398 WeakPolarHBondContact O-CB 3.47Å; V395-T398 PolarHBondContact O-N 3.23Å; V395-T398 VanDerWaalsContact O-N 3.11Å; T398-F401 WeakPolarHBondContact O-CB 3.2Å; T398-F401 PolarHBondContact O-N 3.42Å; T398-I402 HydrophobicContact CG2-CD1 3.95Å; T398-I402 VanDerWaalsContact O-CG1 3.26Å; T398-I402 WeakPolarHBondContact O-CG1 3.45Å; T398-I402 PolarHBondContact O-N 2.62Å
399	L	80.3	Confident	72.5	Confident	17 Å²	17	70.1 Å²	70.1	9%	0.089	35%	0.354	C	S	.	.	H	α-helix	trans	-64.1	-41	176.5	-68.4	169.9	0	0	0	111	L189 F192 E193 V395 S396 I402 R403	L189-L399 HydrophobicContact CD2-CD2 3.36Å; F192-L399 HydrophobicContact CD1-CD1 3.57Å; F192-L399 HydrophobicContact CD1-CD2 4.2Å; F192-L399 HydrophobicContact CE1-CD1 4.09Å; E193-L399 HydrophobicContact CB-CD1 4.37Å; V395-L399 HydrophobicContact CG1-CD1 3.61Å; V395-L399 HydrophobicContact CG1-CG 4Å; V395-L399 WeakPolarHBondContact O-CB 3.24Å; V395-L399 WeakPolarHBondContact O-CG 3.31Å; V395-L399 PolarHBondContact O-N 3.29Å; S396-L399 PolarHBondContact O-N 3.01Å; L399-I402 PolarHBondContact O-N 3.09Å; L399-R403 WeakPolarHBondContact O-CA 3.38Å; L399-R403 WeakPolarHBondContact O-CB 3.47Å; L399-R403 PolarHBondContact O-N 3.28Å
400	K	80.7	Confident	71.6	Confident	98 Å²	98	72 Å²	72	43%	0.426	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-44.4	172.7	-78.2	174.9	-177	174.7	0	111	S396 T397 I402 R403 D404	S396-K400 VanDerWaalsContact O-CB 3.27Å; S396-K400 WeakPolarHBondContact O-CB 3.48Å; S396-K400 VanDerWaalsContact O-CG 3.23Å; S396-K400 WeakPolarHBondContact O-CG 3.12Å; S396-K400 PolarHBondContact O-N 3.28Å; T397-K400 PolarHBondContact O-N 2.88Å; K400-I402 PolarHBondContact O-N 2.92Å; K400-R403 PolarHBondContact O-N 2.92Å; K400-D404 WeakPolarHBondContact O-CB 3.46Å; K400-D404 PolarHBondContact O-N 3.29Å
401	F	79.6	Confident	70.8	Confident	121 Å²	121	70.1 Å²	70.1	53%	0.531	36%	0.36	S	S	.	.	H	α-helix	trans	-60	-45.2	175	175.6	-95.3	0	0	0	112.3	T397 T398 R405	T397-F401 WeakPolarHBondContact O-CB 3.48Å; T397-F401 PolarHBondContact O-N 3.21Å; T398-F401 WeakPolarHBondContact O-CB 3.2Å; T398-F401 PolarHBondContact O-N 3.42Å; F401-R405 HydrophobicContact CE1-CG 4.29Å; F401-R405 HydrophobicContact CZ-CG 4.32Å; F401-R405 WeakPolarHBondContact O-CG 3.37Å; F401-R405 PolarHBondContact O-N 3.26Å
402	I	77.2	Confident	70.2	Confident	71 Å²	71	75.5 Å²	75.5	36%	0.364	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-43.3	177.3	-65	166.2	0	0	0	110.4	L189 T398 L399 K400 R405 I406	L189-I402 HydrophobicContact CD1-CB 4.41Å; L189-I402 HydrophobicContact CD1-CG2 3.87Å; L189-I402 HydrophobicContact CD2-CG2 4.46Å; T398-I402 HydrophobicContact CG2-CD1 3.95Å; T398-I402 VanDerWaalsContact O-CG1 3.26Å; T398-I402 WeakPolarHBondContact O-CG1 3.45Å; T398-I402 PolarHBondContact O-N 2.62Å; L399-I402 PolarHBondContact O-N 3.09Å; K400-I402 PolarHBondContact O-N 2.92Å; I402-R405 WeakPolarHBondContact O-CB 3.36Å; I402-R405 PolarHBondContact O-N 2.94Å; I402-R405 VanDerWaalsContact O-N 3.11Å; I402-I406 HydrophobicContact CG2-CD1 3.8Å; I402-I406 HydrophobicContact CG2-CG1 4.47Å; I402-I406 WeakPolarHBondContact O-CG1 3.49Å; I402-I406 PolarHBondContact O-N 3.04Å
403	R	81.7	Confident	69.4	Low	40 Å²	40	83.3 Å²	83.3	15%	0.151	42%	0.42	C	S	.	.	H	α-helix	trans	-60.4	-47.6	176.7	-176.1	-176.9	-62.5	141.9	5	110.4	N186 L189 E193 L399 K400 R405 I406 S407	N186-R403 WeakPolarHBondContact OD1-CG 3.29Å; L189-R403 VanDerWaalsContact C-NH2 3.33Å; L189-R403 HydrophobicContact CD1-CB 4.02Å; L189-R403 PolarHBondContact O-NH2 3.08Å; E193-R403 IonicContact OE2-CZ 2.68Å; E193-R403 VanDerWaalsContact OE2-CZ 3.27Å; E193-R403 IonicContact OE2-NH1 3.81Å; E193-R403 PolarHBondContact OE2-NH1 3.11Å; E193-R403 IonicContact OE2-NH2 3.32Å; E193-R403 PolarHBondContact OE2-NH2 2.92Å; L399-R403 WeakPolarHBondContact O-CA 3.38Å; L399-R403 WeakPolarHBondContact O-CB 3.47Å; L399-R403 PolarHBondContact O-N 3.28Å; K400-R403 PolarHBondContact O-N 2.92Å; R403-R405 PolarHBondContact O-N 3.33Å; R403-I406 CarbonylContact O-C 3.39Å; R403-I406 PolarHBondContact O-N 3.5Å; R403-I406 VanDerWaalsContact O-N 3.13Å; R403-S407 WeakPolarHBondContact O-CA 3.42Å; R403-S407 WeakPolarHBondContact O-CB 3.42Å; R403-S407 PolarHBondContact O-N 2.9Å; R403-S407 PolarHBondContact O-OG 3.05Å; R403-S407 VanDerWaalsContact O-OG 3.05Å
404	D	76.8	Confident	68.5	Low	87 Å²	87	83 Å²	83	47%	0.465	41%	0.414	S	S	.	.	H	α-helix	trans	-61.3	-31.8	176.4	-70.7	-12.9	0	0	0	110.5	K400 S407 L408	K400-D404 WeakPolarHBondContact O-CB 3.46Å; K400-D404 PolarHBondContact O-N 3.29Å; D404-S407 VanDerWaalsContact CA-OG 3.28Å; D404-S407 WeakPolarHBondContact CA-OG 3.37Å; D404-S407 CarbonylContact O-C 3.42Å; D404-S407 PolarHBondContact O-OG 3.05Å; D404-L408 WeakPolarHBondContact O-CA 3.48Å; D404-L408 WeakPolarHBondContact O-CB 3.49Å; D404-L408 WeakPolarHBondContact O-CD1 2.94Å; D404-L408 WeakPolarHBondContact O-CG 3.19Å; D404-L408 PolarHBondContact O-N 2.9Å
405	R	74.1	Confident	68.2	Low	146 Å²	146	80 Å²	80	55%	0.551	40%	0.398	S	S	*	.	H	α-helix	trans	-73.6	-40	173.9	-68.3	-73	-79	-95.3	-0.1	112.5	F401 I402 R403 S407	F401-R405 HydrophobicContact CE1-CG 4.29Å; F401-R405 HydrophobicContact CZ-CG 4.32Å; F401-R405 WeakPolarHBondContact O-CG 3.37Å; F401-R405 PolarHBondContact O-N 3.26Å; I402-R405 WeakPolarHBondContact O-CB 3.36Å; I402-R405 PolarHBondContact O-N 2.94Å; I402-R405 VanDerWaalsContact O-N 3.11Å; R403-R405 PolarHBondContact O-N 3.33Å; R405-S407 VanDerWaalsContact C-N 3.31Å
406	I	72	Confident	68.1	Low	29 Å²	29	81.8 Å²	81.8	15%	0.149	41%	0.406	C	S	.	.	H	α-helix	trans	-70	-29.3	173.7	-67.7	167.6	0	0	0	111.5	F182 A185 N186 L189 I402 R403 E409	F182-I406 HydrophobicContact CB-CG2 4.26Å; F182-I406 HydrophobicContact CD1-CG2 4.22Å; A185-I406 HydrophobicContact CB-CD1 4.07Å; N186-I406 HydrophobicContact CB-CG2 4.18Å; L189-I406 HydrophobicContact CD1-CD1 3.66Å; I402-I406 HydrophobicContact CG2-CD1 3.8Å; I402-I406 HydrophobicContact CG2-CG1 4.47Å; I402-I406 WeakPolarHBondContact O-CG1 3.49Å; I402-I406 PolarHBondContact O-N 3.04Å; R403-I406 CarbonylContact O-C 3.39Å; R403-I406 PolarHBondContact O-N 3.5Å; R403-I406 VanDerWaalsContact O-N 3.13Å; I406-E409 WeakPolarHBondContact O-CB 3.34Å
407	S	67.4	Low	68.2	Low	32 Å²	32	87.6 Å²	87.6	22%	0.224	43%	0.431	C	S	.	.	H	α-helix	trans	-97.5	-14.6	-179.7	76.5	0	0	0	0	113	R403 D404 R405 E409 I410	R403-S407 WeakPolarHBondContact O-CA 3.42Å; R403-S407 WeakPolarHBondContact O-CB 3.42Å; R403-S407 PolarHBondContact O-N 2.9Å; R403-S407 PolarHBondContact O-OG 3.05Å; R403-S407 VanDerWaalsContact O-OG 3.05Å; D404-S407 VanDerWaalsContact CA-OG 3.28Å; D404-S407 WeakPolarHBondContact CA-OG 3.37Å; D404-S407 CarbonylContact O-C 3.42Å; D404-S407 PolarHBondContact O-OG 3.05Å; R405-S407 VanDerWaalsContact C-N 3.31Å; S407-E409 PolarHBondContact O-N 3.28Å; S407-I410 VanDerWaalsContact O-CA 3.24Å; S407-I410 WeakPolarHBondContact O-CA 3.4Å; S407-I410 WeakPolarHBondContact O-CB 3.5Å; S407-I410 PolarHBondContact O-N 3.43Å
408	L	55.4	Low	68.2	Low	67 Å²	67	85.5 Å²	85.5	35%	0.351	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-25.4	166.3	-91.4	158.8	0	0	0	109.6	D404 I410 N411 I414	D404-L408 WeakPolarHBondContact O-CA 3.48Å; D404-L408 WeakPolarHBondContact O-CB 3.49Å; D404-L408 WeakPolarHBondContact O-CD1 2.94Å; D404-L408 WeakPolarHBondContact O-CG 3.19Å; D404-L408 PolarHBondContact O-N 2.9Å; L408-I410 PolarHBondContact O-N 2.61Å; L408-N411 PolarHBondContact O-N 3.32Å; L408-I414 HydrophobicContact CD2-CD1 3.89Å; L408-I414 WeakPolarHBondContact O-CB 3.32Å; L408-I414 WeakPolarHBondContact O-CG2 3.44Å
409	E	52.6	Low	68.5	Low	57 Å²	57	84 Å²	84	27%	0.266	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-10.6	162.7	-108.1	104.7	-145	0	0	113.8	I406 S407 N415 Y418	I406-E409 WeakPolarHBondContact O-CB 3.34Å; S407-E409 PolarHBondContact O-N 3.28Å; E409-N415 WeakPolarHBondContact O-CB 3.49Å; E409-N415 PolarHBondContact O-OD1 2.94Å; E409-Y418 HydrophobicContact CG-CD1 3.72Å; E409-Y418 HydrophobicContact CG-CD2 3.61Å; E409-Y418 HydrophobicContact CG-CE1 4.07Å; E409-Y418 HydrophobicContact CG-CE2 3.97Å; E409-Y418 HydrophobicContact CG-CG 3.49Å; E409-Y418 VanDerWaalsContact CG-CG 3.49Å; E409-Y418 VanDerWaalsContact OE1-CD2 3.31Å; E409-Y418 WeakPolarHBondContact OE1-CD2 3.09Å
410	I	51.8	Low	68.7	Low	108 Å²	108	88 Å²	88	55%	0.554	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-11.4	178.2	-52.4	172	0	0	0	112.4	S407 L408 E412	S407-I410 VanDerWaalsContact O-CA 3.24Å; S407-I410 WeakPolarHBondContact O-CA 3.4Å; S407-I410 WeakPolarHBondContact O-CB 3.5Å; S407-I410 PolarHBondContact O-N 3.43Å; L408-I410 PolarHBondContact O-N 2.61Å; I410-E412 PolarHBondContact O-N 3.45Å
411	N	50.8	Low	68.9	Low	90 Å²	90	85.3 Å²	85.3	48%	0.481	41%	0.413	S	S	.	.	S	Bend	trans	-65.1	127.5	170.7	-81.3	-11.2	0	0	0	109.6	L408 E413 I414 N415	L408-N411 PolarHBondContact O-N 3.32Å; N411-E413 VanDerWaalsContact C-N 3.28Å; N411-E413 PolarHBondContact O-N 3.29Å; N411-I414 PolarHBondContact O-N 2.91Å; N411-N415 VanDerWaalsContact O-CB 3.31Å; N411-N415 WeakPolarHBondContact O-CB 3.14Å; N411-N415 PolarHBondContact O-N 2.86Å
412	E	54.5	Low	69.2	Low	183 Å²	183	80 Å²	80	86%	0.855	39%	0.391	S	S	*	.	H	α-helix	trans	-48	-42.7	-170.9	-77.6	-176.8	157.5	0	0	114.3	I410 D416	I410-E412 PolarHBondContact O-N 3.45Å; E412-D416 PolarHBondContact O-N 3.42Å
413	E	53.3	Low	69.7	Low	183 Å²	183	80.1 Å²	80.1	86%	0.855	39%	0.389	S	S	*	.	H	α-helix	trans	-72.7	-39.7	179.3	-88.1	-175	157.4	0	0	114.1	N411	N411-E413 VanDerWaalsContact C-N 3.28Å; N411-E413 PolarHBondContact O-N 3.29Å
414	I	55.7	Low	70.1	Confident	76 Å²	76	85.6 Å²	85.6	39%	0.39	41%	0.411	S	S	.	.	H	α-helix	trans	-74.2	-35.7	179.6	-63.2	176	0	0	0	109.9	L408 N411 D416 H417 Y418	L408-I414 HydrophobicContact CD2-CD1 3.89Å; L408-I414 WeakPolarHBondContact O-CB 3.32Å; L408-I414 WeakPolarHBondContact O-CG2 3.44Å; N411-I414 PolarHBondContact O-N 2.91Å; I414-D416 VanDerWaalsContact C-N 3.26Å; I414-D416 PolarHBondContact O-N 3.17Å; I414-H417 PolarHBondContact O-N 2.78Å; I414-H417 VanDerWaalsContact O-N 3.11Å; I414-Y418 PolarHBondContact O-N 3.46Å
415	N	63.3	Low	70.7	Confident	47 Å²	47	85.2 Å²	85.2	25%	0.251	41%	0.412	S	S	.	.	H	α-helix	trans	-57.3	-39	176.7	-167.2	17	0	0	0	111.2	E409 N411 H417 Y418 L419	E409-N415 WeakPolarHBondContact O-CB 3.49Å; E409-N415 PolarHBondContact O-OD1 2.94Å; N411-N415 VanDerWaalsContact O-CB 3.31Å; N411-N415 WeakPolarHBondContact O-CB 3.14Å; N411-N415 PolarHBondContact O-N 2.86Å; N415-H417 PolarHBondContact O-N 3.29Å; N415-Y418 PolarHBondContact O-N 3.41Å; N415-L419 WeakPolarHBondContact O-CB 3.42Å; N415-L419 PolarHBondContact O-N 2.87Å
416	D	72.7	Confident	71.5	Confident	82 Å²	82	79.8 Å²	79.8	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-40.8	175.9	-177.8	48.8	0	0	0	112.4	E412 I414 R420	E412-D416 PolarHBondContact O-N 3.42Å; I414-D416 VanDerWaalsContact C-N 3.26Å; I414-D416 PolarHBondContact O-N 3.17Å; D416-R420 WeakPolarHBondContact O-CB 3.38Å; D416-R420 PolarHBondContact O-N 3.33Å; D416-R420 IonicContact OD1-CZ 3.73Å; D416-R420 IonicContact OD1-NE 4Å; D416-R420 IonicContact OD1-NH2 2.85Å; D416-R420 PolarHBondContact OD1-NH2 3.26Å; D416-R420 IonicContact OD2-CZ 3.44Å; D416-R420 IonicContact OD2-NH1 3.9Å; D416-R420 IonicContact OD2-NH2 2.64Å; D416-R420 PolarHBondContact OD2-NH2 3.13Å
417	H	79.7	Confident	72.4	Confident	139 Å²	139	85.3 Å²	85.3	64%	0.644	41%	0.414	S	S	*	.	H	α-helix	trans	-70.9	-43.1	178	-167.4	71.1	0	0	0	112.6	I414 N415 A421	I414-H417 PolarHBondContact O-N 2.78Å; I414-H417 VanDerWaalsContact O-N 3.11Å; N415-H417 PolarHBondContact O-N 3.29Å; H417-A421 WeakPolarHBondContact O-CB 3.49Å; H417-A421 PolarHBondContact O-N 3.02Å
418	Y	78.2	Confident	73.5	Confident	41 Å²	41	85.3 Å²	85.3	16%	0.161	42%	0.419	C	S	.	.	H	α-helix	trans	-64.8	-51.7	177.5	170.4	-95.7	0	0	0	111.2	L172 F182 E409 I414 N415 R420 A421 V422	L172-Y418 PolarHBondContact O-OH 2.82Å; F182-Y418 WeakPolarHBondContact CD2-OH 3.32Å; F182-Y418 HydrophobicContact CE2-CE2 4.5Å; F182-Y418 AromaticContact CE2-CZ 3.98Å; F182-Y418 WeakPolarHBondContact CE2-OH 3.44Å; E409-Y418 HydrophobicContact CG-CD1 3.72Å; E409-Y418 HydrophobicContact CG-CD2 3.61Å; E409-Y418 HydrophobicContact CG-CE1 4.07Å; E409-Y418 HydrophobicContact CG-CE2 3.97Å; E409-Y418 HydrophobicContact CG-CG 3.49Å; E409-Y418 VanDerWaalsContact CG-CG 3.49Å; E409-Y418 VanDerWaalsContact OE1-CD2 3.31Å; E409-Y418 WeakPolarHBondContact OE1-CD2 3.09Å; I414-Y418 PolarHBondContact O-N 3.46Å; N415-Y418 PolarHBondContact O-N 3.41Å; Y418-R420 VanDerWaalsContact C-N 3.27Å; Y418-R420 PolarHBondContact O-N 2.59Å; Y418-A421 WeakPolarHBondContact O-CA 3.37Å; Y418-A421 WeakPolarHBondContact O-CB 3.21Å; Y418-A421 PolarHBondContact O-N 2.84Å; Y418-V422 HydrophobicContact CD1-CG2 4.3Å; Y418-V422 HydrophobicContact CD2-CG2 4.39Å; Y418-V422 HydrophobicContact CE1-CG2 3.79Å; Y418-V422 HydrophobicContact CE2-CG2 3.89Å; Y418-V422 WeakPolarHBondContact O-CG2 3.36Å; Y418-V422 PolarHBondContact O-N 3.38Å
419	L	80	Confident	75.2	Confident	51 Å²	51	82.4 Å²	82.4	27%	0.267	41%	0.405	S	S	.	.	H	α-helix	trans	-59.4	-42.2	179.3	-174.5	61.6	0	0	0	110.5	V173 N415 A421 V422 E423	V173-L419 HydrophobicContact CB-CD1 4.49Å; V173-L419 HydrophobicContact CG1-CD1 3.8Å; V173-L419 HydrophobicContact CG2-CD1 3.86Å; N415-L419 WeakPolarHBondContact O-CB 3.42Å; N415-L419 PolarHBondContact O-N 2.87Å; L419-A421 PolarHBondContact O-N 3.49Å; L419-V422 PolarHBondContact O-N 2.93Å; L419-E423 WeakPolarHBondContact O-CB 3.11Å; L419-E423 WeakPolarHBondContact O-CG 3.24Å; L419-E423 PolarHBondContact O-N 2.9Å
420	R	85.3	Confident	77.2	Confident	99 Å²	99	81.8 Å²	81.8	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-37.7	174.9	-169.9	179	-60.8	161.4	8.7	112.9	D416 Y418 E423 Y424	D416-R420 WeakPolarHBondContact O-CB 3.38Å; D416-R420 PolarHBondContact O-N 3.33Å; D416-R420 IonicContact OD1-CZ 3.73Å; D416-R420 IonicContact OD1-NE 4Å; D416-R420 IonicContact OD1-NH2 2.85Å; D416-R420 PolarHBondContact OD1-NH2 3.26Å; D416-R420 IonicContact OD2-CZ 3.44Å; D416-R420 IonicContact OD2-NH1 3.9Å; D416-R420 IonicContact OD2-NH2 2.64Å; D416-R420 PolarHBondContact OD2-NH2 3.13Å; Y418-R420 VanDerWaalsContact C-N 3.27Å; Y418-R420 PolarHBondContact O-N 2.59Å; R420-E423 PolarHBondContact O-N 3.45Å; R420-Y424 HydrophobicContact CG-CD2 4.06Å; R420-Y424 HydrophobicContact CG-CE2 3.48Å; R420-Y424 VanDerWaalsContact CG-CE2 3.48Å; R420-Y424 WeakPolarHBondContact O-CD2 3.11Å; R420-Y424 PolarHBondContact O-N 3.18Å
421	A	84.6	Confident	79.1	Confident	43 Å²	43	79.4 Å²	79.4	36%	0.355	40%	0.402	S	S	.	.	H	α-helix	trans	-64.3	-42.6	174	0	0	0	0	0	111.4	H417 Y418 L419 Y424 V425	H417-A421 WeakPolarHBondContact O-CB 3.49Å; H417-A421 PolarHBondContact O-N 3.02Å; Y418-A421 WeakPolarHBondContact O-CA 3.37Å; Y418-A421 WeakPolarHBondContact O-CB 3.21Å; Y418-A421 PolarHBondContact O-N 2.84Å; L419-A421 PolarHBondContact O-N 3.49Å; A421-Y424 PolarHBondContact O-N 3.43Å; A421-V425 WeakPolarHBondContact O-CG2 3.43Å; A421-V425 PolarHBondContact O-N 2.78Å
422	V	86.7	Confident	81.1	Confident	10 Å²	10	77 Å²	77	6%	0.061	39%	0.388	C	S	.	.	H	α-helix	trans	-64.2	-41.6	175.2	174.6	0	0	0	0	111.3	L172 V173 Y418 L419 V425 L426	L172-V422 HydrophobicContact CB-CG1 3.9Å; L172-V422 HydrophobicContact CB-CG2 4.36Å; L172-V422 HydrophobicContact CD1-CG1 3.92Å; L172-V422 HydrophobicContact CD1-CG2 4.23Å; V173-V422 HydrophobicContact CG2-CG1 3.61Å; Y418-V422 HydrophobicContact CD1-CG2 4.3Å; Y418-V422 HydrophobicContact CD2-CG2 4.39Å; Y418-V422 HydrophobicContact CE1-CG2 3.79Å; Y418-V422 HydrophobicContact CE2-CG2 3.89Å; Y418-V422 WeakPolarHBondContact O-CG2 3.36Å; Y418-V422 PolarHBondContact O-N 3.38Å; L419-V422 PolarHBondContact O-N 2.93Å; V422-V425 WeakPolarHBondContact O-CB 3.44Å; V422-V425 PolarHBondContact O-N 3.34Å; V422-L426 PolarHBondContact O-N 2.96Å
423	E	87.8	Confident	83.1	Confident	72 Å²	72	68.3 Å²	68.3	34%	0.336	35%	0.348	S	S	.	.	H	α-helix	trans	-62.3	-41.4	173.5	-76.5	176.9	177.3	0	0	112	L419 R420 V425 L426 Y427	L419-E423 WeakPolarHBondContact O-CB 3.11Å; L419-E423 WeakPolarHBondContact O-CG 3.24Å; L419-E423 PolarHBondContact O-N 2.9Å; R420-E423 PolarHBondContact O-N 3.45Å; E423-V425 VanDerWaalsContact C-N 3.31Å; E423-V425 PolarHBondContact O-N 3.03Å; E423-L426 WeakPolarHBondContact O-CB 3.13Å; E423-L426 PolarHBondContact O-N 3.48Å; E423-L426 VanDerWaalsContact O-N 3.15Å; E423-Y427 HydrophobicContact CB-CD2 4.43Å; E423-Y427 HydrophobicContact CB-CE2 4.12Å; E423-Y427 WeakPolarHBondContact O-CD2 3.4Å; E423-Y427 PolarHBondContact O-N 3.29Å
424	Y	90.3	Very high	85.1	Confident	156 Å²	156	62.5 Å²	62.5	61%	0.612	33%	0.327	S	S	*	.	H	α-helix	trans	-63.8	-36.7	174.1	-71.9	-44.1	0	0	0	112.5	R420 A421 L426 G428	R420-Y424 HydrophobicContact CG-CD2 4.06Å; R420-Y424 HydrophobicContact CG-CE2 3.48Å; R420-Y424 VanDerWaalsContact CG-CE2 3.48Å; R420-Y424 WeakPolarHBondContact O-CD2 3.11Å; R420-Y424 PolarHBondContact O-N 3.18Å; A421-Y424 PolarHBondContact O-N 3.43Å; Y424-L426 VanDerWaalsContact C-N 3.34Å; Y424-G428 PolarHBondContact O-N 2.95Å
425	V	88.5	Confident	87	Confident	78 Å²	78	60.4 Å²	60.4	47%	0.473	32%	0.316	S	S	.	.	H	α-helix	trans	-64.4	-40.9	172.2	172.1	0	0	0	0	110.5	H165 F168 A421 V422 E423 G429	H165-V425 PolarHBondContact CE1-O 2.83Å; F168-V425 HydrophobicContact CE1-CG1 4.4Å; A421-V425 WeakPolarHBondContact O-CG2 3.43Å; A421-V425 PolarHBondContact O-N 2.78Å; V422-V425 WeakPolarHBondContact O-CB 3.44Å; V422-V425 PolarHBondContact O-N 3.34Å; E423-V425 VanDerWaalsContact C-N 3.31Å; E423-V425 PolarHBondContact O-N 3.03Å; V425-G429 PolarHBondContact O-N 2.94Å
426	L	90.8	Very high	88.6	Confident	33 Å²	33	58.1 Å²	58.1	17%	0.173	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-58.2	174.3	178.1	66.8	0	0	0	111	H165 H169 V422 E423 Y424 G428 G429 V430	H165-L426 WeakPolarHBondContact NE2-CA 3.38Å; H165-L426 PolarHBondContact NE2-O 3.09Å; H169-L426 HydrophobicContact CB-CD1 3.88Å; V422-L426 PolarHBondContact O-N 2.96Å; E423-L426 WeakPolarHBondContact O-CB 3.13Å; E423-L426 PolarHBondContact O-N 3.48Å; E423-L426 VanDerWaalsContact O-N 3.15Å; Y424-L426 VanDerWaalsContact C-N 3.34Å; L426-G428 VanDerWaalsContact C-N 3.32Å; L426-G428 PolarHBondContact O-N 3.16Å; L426-G429 PolarHBondContact O-N 2.75Å; L426-V430 HydrophobicContact CD1-CG2 4.29Å; L426-V430 WeakPolarHBondContact O-CG2 3.23Å; L426-V430 PolarHBondContact O-N 3.43Å
427	Y	92.1	Very high	89.7	Confident	145 Å²	145	57.7 Å²	57.7	57%	0.569	30%	0.301	S	S	*	.	H	α-helix	trans	-62.2	-39	-178.3	-66	-50.4	0	0	0	112.4	E423 V430 A431	E423-Y427 HydrophobicContact CB-CD2 4.43Å; E423-Y427 HydrophobicContact CB-CE2 4.12Å; E423-Y427 WeakPolarHBondContact O-CD2 3.4Å; E423-Y427 PolarHBondContact O-N 3.29Å; Y427-V430 PolarHBondContact O-N 3.28Å; Y427-A431 WeakPolarHBondContact O-CB 3.4Å; Y427-A431 PolarHBondContact O-N 2.84Å
428	G	90.4	Very high	90.5	Very high	32 Å²	32	55 Å²	55	33%	0.33	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-47.4	174.7	0	0	0	0	0	112	Y424 L426 A431 L432	Y424-G428 PolarHBondContact O-N 2.95Å; L426-G428 VanDerWaalsContact C-N 3.32Å; L426-G428 PolarHBondContact O-N 3.16Å; G428-A431 PolarHBondContact O-N 3.07Å; G428-L432 VanDerWaalsContact O-CG 3.27Å; G428-L432 WeakPolarHBondContact O-CG 3.46Å; G428-L432 PolarHBondContact O-N 3.11Å
429	G	90.6	Very high	91.3	Very high	6 Å²	6	53.2 Å²	53.2	6%	0.062	28%	0.284	C	S	.	.	H	α-helix	trans	-66.7	-40	176.8	0	0	0	0	0	113.2	H165 V425 L426 L432 L433	H165-G429 WeakPolarHBondContact NE2-CA 3.01Å; V425-G429 PolarHBondContact O-N 2.94Å; L426-G429 PolarHBondContact O-N 2.75Å; G429-L432 PolarHBondContact O-N 3.27Å; G429-L433 WeakPolarHBondContact O-CB 3.19Å; G429-L433 VanDerWaalsContact O-CG 3.3Å; G429-L433 WeakPolarHBondContact O-CG 3.26Å; G429-L433 PolarHBondContact O-N 3.39Å
430	V	93.6	Very high	92.1	Very high	43 Å²	43	50.9 Å²	50.9	26%	0.261	27%	0.271	S	S	.	.	H	α-helix	trans	-60.3	-47.4	173.7	170.2	0	0	0	0	110.6	F162 L426 Y427 L432 L433 C434	F162-V430 HydrophobicContact CE2-CG1 4.3Å; F162-V430 HydrophobicContact CE2-CG2 4.25Å; F162-V430 HydrophobicContact CZ-CG2 4.41Å; L426-V430 HydrophobicContact CD1-CG2 4.29Å; L426-V430 WeakPolarHBondContact O-CG2 3.23Å; L426-V430 PolarHBondContact O-N 3.43Å; Y427-V430 PolarHBondContact O-N 3.28Å; V430-L432 VanDerWaalsContact C-N 3.32Å; V430-L432 PolarHBondContact O-N 3.36Å; V430-L433 PolarHBondContact O-N 3.31Å; V430-L433 VanDerWaalsContact O-N 3.16Å; V430-C434 PolarHBondContact O-N 3.42Å; V430-C434 PolarHBondContact O-SG 3.48Å
431	A	93	Very high	92.7	Very high	59 Å²	59	50.8 Å²	50.8	49%	0.488	28%	0.278	S	S	.	.	H	α-helix	trans	-59.5	-42.4	177.4	0	0	0	0	0	112	Y427 G428 L433 C434	Y427-A431 WeakPolarHBondContact O-CB 3.4Å; Y427-A431 PolarHBondContact O-N 2.84Å; G428-A431 PolarHBondContact O-N 3.07Å; A431-L433 PolarHBondContact O-N 3.49Å; A431-C434 PolarHBondContact O-N 3.36Å
432	L	92.9	Very high	93.3	Very high	39 Å²	39	49.7 Å²	49.7	20%	0.204	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-38	176.2	-72.9	167.1	0	0	0	112.4	G428 G429 V430 P436 I485 L486 S489	G428-L432 VanDerWaalsContact O-CG 3.27Å; G428-L432 WeakPolarHBondContact O-CG 3.46Å; G428-L432 PolarHBondContact O-N 3.11Å; G429-L432 PolarHBondContact O-N 3.27Å; V430-L432 VanDerWaalsContact C-N 3.32Å; V430-L432 PolarHBondContact O-N 3.36Å; L432-P436 WeakPolarHBondContact O-CD 3.13Å; L432-I485 HydrophobicContact CD2-CG2 3.81Å; L432-L486 HydrophobicContact CD2-CD2 4.39Å; L432-L486 WeakPolarHBondContact O-CD2 3.29Å; L432-S489 WeakPolarHBondContact CD1-OG 3.41Å
433	L	94.9	Very high	93.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-78.5	-24.1	178.1	-67.8	172.3	0	0	0	113.5	V158 A161 F162 H165 G429 V430 A431 I435 P436 I437 F783 L787	V158-L433 HydrophobicContact CG1-CD2 4.25Å; A161-L433 HydrophobicContact CB-CD2 3.8Å; F162-L433 HydrophobicContact CB-CD1 4.01Å; F162-L433 HydrophobicContact CD2-CB 4.17Å; F162-L433 HydrophobicContact CD2-CD1 3.86Å; F162-L433 HydrophobicContact CG-CD1 4.29Å; H165-L433 HydrophobicContact CB-CD1 4.18Å; G429-L433 WeakPolarHBondContact O-CB 3.19Å; G429-L433 VanDerWaalsContact O-CG 3.3Å; G429-L433 WeakPolarHBondContact O-CG 3.26Å; G429-L433 PolarHBondContact O-N 3.39Å; V430-L433 PolarHBondContact O-N 3.31Å; V430-L433 VanDerWaalsContact O-N 3.16Å; A431-L433 PolarHBondContact O-N 3.49Å; L433-I435 VanDerWaalsContact C-N 3.28Å; L433-I435 PolarHBondContact O-N 3.11Å; L433-P436 WeakPolarHBondContact O-CD 3.29Å; L433-P436 VanDerWaalsContact O-CG 3.23Å; L433-P436 WeakPolarHBondContact O-CG 3.47Å; L433-I437 WeakPolarHBondContact O-CG1 3.5Å; L433-I437 PolarHBondContact O-N 3.11Å; L433-F783 HydrophobicContact CD1-CD2 4.4Å; L433-F783 HydrophobicContact CD1-CE2 3.96Å; L433-F783 HydrophobicContact CD2-CE2 4.03Å; L433-F783 HydrophobicContact CG-CE2 4.08Å; L433-L787 HydrophobicContact CD2-CD1 4.39Å
434	C	95.8	Very high	94.1	Very high	61 Å²	61	48.7 Å²	48.7	41%	0.412	26%	0.258	S	S	.	.	H	α-helix	trans	-67	-28.5	172	-72.7	0	0	0	0	112.7	V430 A431 I437 L438	V430-C434 PolarHBondContact O-N 3.42Å; V430-C434 PolarHBondContact O-SG 3.48Å; A431-C434 PolarHBondContact O-N 3.36Å; C434-I437 PolarHBondContact O-N 3.5Å; C434-L438 WeakPolarHBondContact O-CB 3.31Å; C434-L438 PolarHBondContact O-N 3.17Å
435	I	96	Very high	94.4	Very high	32 Å²	32	44.2 Å²	44.2	16%	0.164	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-55.9	177.3	-63.9	168.5	0	0	0	112	L433 I437 L438 I439 F482 L486	L433-I435 VanDerWaalsContact C-N 3.28Å; L433-I435 PolarHBondContact O-N 3.11Å; I435-I437 VanDerWaalsContact C-N 3.32Å; I435-I437 PolarHBondContact O-N 3.43Å; I435-L438 PolarHBondContact O-N 2.87Å; I435-I439 HydrophobicContact CG2-CD1 4.19Å; I435-I439 WeakPolarHBondContact O-CG1 3.2Å; I435-I439 PolarHBondContact O-N 3.48Å; I435-F482 HydrophobicContact CD1-CD1 4.08Å; I435-F482 HydrophobicContact CD1-CE1 4.39Å; I435-F482 HydrophobicContact CD1-CG 4.45Å; I435-F482 HydrophobicContact CG2-CB 3.62Å; I435-F482 HydrophobicContact CG2-CD1 4.19Å; I435-F482 HydrophobicContact CG2-CD2 3.49Å; I435-F482 VanDerWaalsContact CG2-CD2 3.49Å; I435-F482 HydrophobicContact CG2-CE2 4.13Å; I435-F482 HydrophobicContact CG2-CG 3.52Å; I435-L486 HydrophobicContact CB-CD2 4.49Å; I435-L486 HydrophobicContact CD1-CD2 4.47Å; I435-L486 HydrophobicContact CG2-CD1 4.21Å
436	P	96	Very high	94.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-33.3	177.3	24.9	-33.8	0	0	0	112.7	V158 L432 L433 L438 I439 F440 T790	V158-P436 HydrophobicContact CG1-CG 4.12Å; V158-P436 HydrophobicContact CG2-CB 4.01Å; V158-P436 HydrophobicContact CG2-CG 4Å; L432-P436 WeakPolarHBondContact O-CD 3.13Å; L433-P436 WeakPolarHBondContact O-CD 3.29Å; L433-P436 VanDerWaalsContact O-CG 3.23Å; L433-P436 WeakPolarHBondContact O-CG 3.47Å; P436-L438 VanDerWaalsContact C-N 3.34Å; P436-L438 PolarHBondContact O-N 2.87Å; P436-I439 WeakPolarHBondContact O-CB 3.38Å; P436-I439 PolarHBondContact O-N 2.99Å; P436-F440 HydrophobicContact CB-CE1 4.48Å; P436-F440 HydrophobicContact CB-CE2 4.02Å; P436-F440 HydrophobicContact CB-CZ 3.81Å; P436-F440 WeakPolarHBondContact O-CD1 3.44Å; P436-F440 WeakPolarHBondContact O-CD2 3.46Å; P436-F440 WeakPolarHBondContact O-CG 3.38Å; P436-F440 PolarHBondContact O-N 3.33Å; P436-T790 HydrophobicContact CB-CG2 4.28Å
437	I	96.4	Very high	94.9	Very high	73 Å²	73	39.2 Å²	39.2	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-60.3	-44.3	173.8	-66.4	171.3	0	0	0	111	V158 L433 C434 I435 I439 F440 L441	V158-I437 HydrophobicContact CG1-CD1 4.36Å; V158-I437 HydrophobicContact CG1-CG1 3.97Å; L433-I437 WeakPolarHBondContact O-CG1 3.5Å; L433-I437 PolarHBondContact O-N 3.11Å; C434-I437 PolarHBondContact O-N 3.5Å; I435-I437 VanDerWaalsContact C-N 3.32Å; I435-I437 PolarHBondContact O-N 3.43Å; I437-I439 VanDerWaalsContact C-N 3.34Å; I437-I439 PolarHBondContact O-N 2.99Å; I437-F440 PolarHBondContact O-N 3.32Å; I437-L441 PolarHBondContact O-N 2.89Å
438	L	96.1	Very high	94.9	Very high	83 Å²	83	35.5 Å²	35.5	44%	0.435	21%	0.21	S	C	.	.	H	α-helix	trans	-62	-41.7	175.2	178.6	63.5	0	0	0	111.6	C434 I435 P436 F440 L441 I442	C434-L438 WeakPolarHBondContact O-CB 3.31Å; C434-L438 PolarHBondContact O-N 3.17Å; I435-L438 PolarHBondContact O-N 2.87Å; P436-L438 VanDerWaalsContact C-N 3.34Å; P436-L438 PolarHBondContact O-N 2.87Å; L438-F440 VanDerWaalsContact C-N 3.33Å; L438-F440 PolarHBondContact O-N 3.01Å; L438-L441 PolarHBondContact O-N 2.98Å; L438-I442 HydrophobicContact CD1-CD1 4.29Å; L438-I442 HydrophobicContact CG-CD1 4.13Å; L438-I442 VanDerWaalsContact O-CG1 3.3Å; L438-I442 WeakPolarHBondContact O-CG1 3.39Å; L438-I442 PolarHBondContact O-N 3.28Å
439	I	96.6	Very high	94.8	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-58.7	-46.3	174.3	-68.3	168.9	0	0	0	110.3	I435 P436 I437 I442 L443 F478 M479 F794	I435-I439 HydrophobicContact CG2-CD1 4.19Å; I435-I439 WeakPolarHBondContact O-CG1 3.2Å; I435-I439 PolarHBondContact O-N 3.48Å; P436-I439 WeakPolarHBondContact O-CB 3.38Å; P436-I439 PolarHBondContact O-N 2.99Å; I437-I439 VanDerWaalsContact C-N 3.34Å; I437-I439 PolarHBondContact O-N 2.99Å; I439-I442 PolarHBondContact O-N 2.71Å; I439-L443 HydrophobicContact CG2-CD1 4.06Å; I439-L443 HydrophobicContact CG2-CG 4.43Å; I439-L443 WeakPolarHBondContact O-CG 3.49Å; I439-L443 PolarHBondContact O-N 2.96Å; I439-F478 HydrophobicContact CD1-CB 4.13Å; I439-F478 HydrophobicContact CG1-CB 3.71Å; I439-M479 HydrophobicContact CD1-CG 4.16Å; I439-M479 HydrophobicContact CG2-CG 3.55Å; I439-M479 HydrophobicContact CG2-SD 4.26Å; I439-F794 HydrophobicContact CD1-CZ 4.11Å
440	F	96.2	Very high	94.7	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-66.8	-39.6	-180	-53.7	-29.7	0	0	0	112.3	V151 Q154 L155 V158 P436 I437 L438 I442 L443 Y444 T790 F794	V151-F440 HydrophobicContact CG1-CB 4.07Å; V151-F440 HydrophobicContact CG1-CD1 4.14Å; V151-F440 HydrophobicContact CG1-CG 4.26Å; Q154-F440 HydrophobicContact CB-CD1 4.5Å; Q154-F440 HydrophobicContact CB-CE1 3.68Å; Q154-F440 HydrophobicContact CB-CE2 4.21Å; Q154-F440 HydrophobicContact CB-CZ 3.52Å; Q154-F440 HydrophobicContact CG-CE1 4.43Å; L155-F440 HydrophobicContact CB-CD2 4.32Å; L155-F440 HydrophobicContact CD1-CD2 4.05Å; V158-F440 HydrophobicContact CB-CE2 4.05Å; V158-F440 HydrophobicContact CG2-CE2 3.57Å; V158-F440 HydrophobicContact CG2-CZ 3.86Å; P436-F440 HydrophobicContact CB-CE1 4.48Å; P436-F440 HydrophobicContact CB-CE2 4.02Å; P436-F440 HydrophobicContact CB-CZ 3.81Å; P436-F440 WeakPolarHBondContact O-CD1 3.44Å; P436-F440 WeakPolarHBondContact O-CD2 3.46Å; P436-F440 WeakPolarHBondContact O-CG 3.38Å; P436-F440 PolarHBondContact O-N 3.33Å; I437-F440 PolarHBondContact O-N 3.32Å; L438-F440 VanDerWaalsContact C-N 3.33Å; L438-F440 PolarHBondContact O-N 3.01Å; F440-I442 VanDerWaalsContact C-N 3.3Å; F440-I442 PolarHBondContact O-N 2.84Å; F440-L443 PolarHBondContact O-N 3.32Å; F440-Y444 HydrophobicContact CB-CD2 4.39Å; F440-Y444 HydrophobicContact CB-CE2 4.39Å; F440-Y444 WeakPolarHBondContact O-CB 3.35Å; F440-Y444 WeakPolarHBondContact O-CD2 3.37Å; F440-Y444 PolarHBondContact O-N 2.8Å; F440-T790 HydrophobicContact CE1-CG2 4.39Å; F440-T790 HydrophobicContact CZ-CG2 3.65Å; F440-F794 HydrophobicContact CE1-CE1 4.18Å
441	L	96.6	Very high	94.5	Very high	98 Å²	98	37.3 Å²	37.3	51%	0.513	21%	0.209	S	C	.	.	H	α-helix	trans	-56.9	-46.8	173.5	-177.6	71.4	0	0	0	110.6	I437 L438 L443 Y444 L445	I437-L441 PolarHBondContact O-N 2.89Å; L438-L441 PolarHBondContact O-N 2.98Å; L441-L443 PolarHBondContact O-N 3.46Å; L441-Y444 PolarHBondContact O-N 3.06Å; L441-L445 HydrophobicContact CG-CD1 4.29Å; L441-L445 WeakPolarHBondContact O-CB 3.17Å; L441-L445 VanDerWaalsContact O-CG 3.3Å; L441-L445 WeakPolarHBondContact O-CG 3.12Å; L441-L445 PolarHBondContact O-N 3.24Å
442	I	97.2	Very high	94.1	Very high	19 Å²	19	39.9 Å²	39.9	10%	0.097	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-42.2	177	-70.5	168.3	0	0	0	111.2	L438 I439 F440 G446 F471 A474 F478	L438-I442 HydrophobicContact CD1-CD1 4.29Å; L438-I442 HydrophobicContact CG-CD1 4.13Å; L438-I442 VanDerWaalsContact O-CG1 3.3Å; L438-I442 WeakPolarHBondContact O-CG1 3.39Å; L438-I442 PolarHBondContact O-N 3.28Å; I439-I442 PolarHBondContact O-N 2.71Å; F440-I442 VanDerWaalsContact C-N 3.3Å; F440-I442 PolarHBondContact O-N 2.84Å; I442-G446 PolarHBondContact O-N 3.43Å; I442-F471 HydrophobicContact CG2-CB 4.4Å; I442-F471 HydrophobicContact CG2-CD1 4.23Å; I442-F471 WeakPolarHBondContact CG2-O 3.43Å; I442-A474 HydrophobicContact CG2-CB 4.17Å; I442-F478 HydrophobicContact CD1-CD2 3.53Å; I442-F478 HydrophobicContact CD1-CE2 3.55Å
443	L	96.9	Very high	93.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.7	-40.9	177.3	-69.1	175.7	0	0	0	112.3	V151 I439 F440 L441 G446 L447 L472 M479 A801	V151-L443 HydrophobicContact CG2-CB 4.27Å; V151-L443 HydrophobicContact CG2-CD1 3.77Å; I439-L443 HydrophobicContact CG2-CD1 4.06Å; I439-L443 HydrophobicContact CG2-CG 4.43Å; I439-L443 WeakPolarHBondContact O-CG 3.49Å; I439-L443 PolarHBondContact O-N 2.96Å; F440-L443 PolarHBondContact O-N 3.32Å; L441-L443 PolarHBondContact O-N 3.46Å; L443-G446 CarbonylContact O-C 3.57Å; L443-G446 PolarHBondContact O-N 2.9Å; L443-L447 WeakPolarHBondContact O-CG 2.87Å; L443-L447 PolarHBondContact O-N 2.95Å; L443-L472 HydrophobicContact CD2-CD2 3.88Å; L443-M479 HydrophobicContact CD1-CE 4.13Å; L443-M479 HydrophobicContact CD2-CE 4.32Å; L443-A801 HydrophobicContact CD2-CB 4.32Å
444	Y	96.4	Very high	92.8	Very high	61 Å²	61	43.2 Å²	43.2	24%	0.239	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-42.4	175.9	-80.6	-58.5	0	0	0	112	V151 T152 L155 F440 L441 G446 L447 C448	V151-Y444 HydrophobicContact CG1-CD2 4.09Å; V151-Y444 HydrophobicContact CG1-CE1 4.17Å; V151-Y444 HydrophobicContact CG1-CE2 3.53Å; T152-Y444 WeakPolarHBondContact CA-OH 3.3Å; T152-Y444 WeakPolarHBondContact CG2-OH 3.48Å; T152-Y444 PolarHBondContact N-OH 2.88Å; L155-Y444 HydrophobicContact CD2-CE2 4.3Å; F440-Y444 HydrophobicContact CB-CD2 4.39Å; F440-Y444 HydrophobicContact CB-CE2 4.39Å; F440-Y444 WeakPolarHBondContact O-CB 3.35Å; F440-Y444 WeakPolarHBondContact O-CD2 3.37Å; F440-Y444 PolarHBondContact O-N 2.8Å; L441-Y444 PolarHBondContact O-N 3.06Å; Y444-G446 VanDerWaalsContact C-N 3.27Å; Y444-G446 PolarHBondContact O-N 2.8Å; Y444-L447 HydrophobicContact CD1-CD1 4.18Å; Y444-L447 WeakPolarHBondContact O-CB 3.48Å; Y444-L447 PolarHBondContact O-N 3.07Å; Y444-C448 WeakPolarHBondContact O-CB 3.27Å; Y444-C448 PolarHBondContact O-N 3.36Å; Y444-C448 PolarHBondContact O-SG 3.12Å
445	L	94.8	Very high	92	Very high	62 Å²	62	42.5 Å²	42.5	33%	0.325	23%	0.23	S	C	.	.	H	α-helix	trans	-60.4	-40.6	171.8	-70.8	173	0	0	0	111.2	L441 L447 C448 F449 F471	L441-L445 HydrophobicContact CG-CD1 4.29Å; L441-L445 WeakPolarHBondContact O-CB 3.17Å; L441-L445 VanDerWaalsContact O-CG 3.3Å; L441-L445 WeakPolarHBondContact O-CG 3.12Å; L441-L445 PolarHBondContact O-N 3.24Å; L445-L447 PolarHBondContact O-N 3.14Å; L445-C448 PolarHBondContact O-N 3.43Å; L445-F449 HydrophobicContact CB-CD2 4.45Å; L445-F449 HydrophobicContact CB-CE2 4.24Å; L445-F449 HydrophobicContact CD2-CE2 4.25Å; L445-F449 HydrophobicContact CD2-CZ 4.45Å; L445-F449 WeakPolarHBondContact O-CD2 3.15Å; L445-F449 WeakPolarHBondContact O-CG 3.09Å; L445-F449 PolarHBondContact O-N 3.3Å; L445-F471 HydrophobicContact CB-CD1 4.38Å; L445-F471 HydrophobicContact CB-CG 4.36Å; L445-F471 HydrophobicContact CD1-CE1 4.32Å
446	G	94.6	Very high	90.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-41.6	173.6	0	0	0	0	0	113.5	I442 L443 Y444 G450 G468	I442-G446 PolarHBondContact O-N 3.43Å; L443-G446 CarbonylContact O-C 3.57Å; L443-G446 PolarHBondContact O-N 2.9Å; Y444-G446 VanDerWaalsContact C-N 3.27Å; Y444-G446 PolarHBondContact O-N 2.8Å; G446-G450 WeakPolarHBondContact O-CA 3.35Å; G446-G450 PolarHBondContact O-N 3.46Å; G446-G468 WeakPolarHBondContact CA-O 3.43Å; G446-G468 WeakPolarHBondContact O-CA 3.34Å
447	L	95	Very high	89.6	Confident	7 Å²	7	48.4 Å²	48.4	4%	0.037	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-48.4	174.1	-75.9	163.8	0	0	0	111.4	T144 L147 V148 L443 Y444 L445 G450 T451 L472 L804	T144-L447 HydrophobicContact CG2-CD2 3.93Å; L147-L447 HydrophobicContact CB-CD2 4.4Å; L147-L447 HydrophobicContact CD2-CD1 4.49Å; L147-L447 HydrophobicContact CD2-CD2 3.99Å; L147-L447 HydrophobicContact CD2-CG 4.29Å; L147-L447 HydrophobicContact CG-CD1 4.36Å; L147-L447 HydrophobicContact CG-CD2 4.37Å; V148-L447 HydrophobicContact CG2-CD1 3.8Å; V148-L447 HydrophobicContact CG2-CD2 4.08Å; V148-L447 HydrophobicContact CG2-CG 4.49Å; L443-L447 WeakPolarHBondContact O-CG 2.87Å; L443-L447 PolarHBondContact O-N 2.95Å; Y444-L447 HydrophobicContact CD1-CD1 4.18Å; Y444-L447 WeakPolarHBondContact O-CB 3.48Å; Y444-L447 PolarHBondContact O-N 3.07Å; L445-L447 PolarHBondContact O-N 3.14Å; L447-G450 PolarHBondContact O-N 2.97Å; L447-T451 WeakPolarHBondContact O-CB 3.42Å; L447-T451 WeakPolarHBondContact O-CG2 3.32Å; L447-T451 PolarHBondContact O-N 3.49Å; L447-T451 PolarHBondContact O-OG1 2.89Å; L447-L472 HydrophobicContact CG-CD2 4.44Å; L447-L804 HydrophobicContact CD2-CD2 3.9Å
448	C	92.1	Very high	87.9	Confident	67 Å²	67	53 Å²	53	45%	0.453	28%	0.275	S	S	.	.	H	α-helix	trans	-60.6	-52.5	-179.7	-70.1	0	0	0	0	112.1	Y444 L445 G450 T451 C452	Y444-C448 WeakPolarHBondContact O-CB 3.27Å; Y444-C448 PolarHBondContact O-N 3.36Å; Y444-C448 PolarHBondContact O-SG 3.12Å; L445-C448 PolarHBondContact O-N 3.43Å; C448-G450 VanDerWaalsContact C-N 3.25Å; C448-G450 PolarHBondContact O-N 3.33Å; C448-T451 PolarHBondContact O-OG1 3.13Å; C448-C452 VanDerWaalsContact O-CB 3.27Å; C448-C452 WeakPolarHBondContact O-CB 3.31Å; C448-C452 PolarHBondContact O-N 3.31Å
449	F	90	Very high	86.3	Confident	52 Å²	52	57.3 Å²	57.3	23%	0.228	29%	0.293	C	S	.	.	H	α-helix	trans	-68.6	-27.4	177.9	-62.6	-44.6	0	0	0	112.4	L445 G453 C463 N464 V467 F471	L445-F449 HydrophobicContact CB-CD2 4.45Å; L445-F449 HydrophobicContact CB-CE2 4.24Å; L445-F449 HydrophobicContact CD2-CE2 4.25Å; L445-F449 HydrophobicContact CD2-CZ 4.45Å; L445-F449 WeakPolarHBondContact O-CD2 3.15Å; L445-F449 WeakPolarHBondContact O-CG 3.09Å; L445-F449 PolarHBondContact O-N 3.3Å; F449-G453 VanDerWaalsContact O-CA 3.24Å; F449-G453 WeakPolarHBondContact O-CA 3.46Å; F449-G453 PolarHBondContact O-N 3.47Å; F449-C463 HydrophobicContact CD1-CB 4.07Å; F449-C463 HydrophobicContact CE1-CB 4.34Å; F449-C463 VanDerWaalsContact CE1-SG 3.57Å; F449-N464 CarbonylContact O-C 3.55Å; F449-V467 HydrophobicContact CD2-CG1 4.16Å; F449-F471 AromaticContact CD2-CD2 3.68Å; F449-F471 HydrophobicContact CD2-CD2 3.68Å; F449-F471 AromaticContact CD2-CE2 3.64Å; F449-F471 HydrophobicContact CD2-CE2 3.64Å; F449-F471 HydrophobicContact CE2-CD2 4.01Å; F449-F471 AromaticContact CE2-CE2 3.51Å; F449-F471 HydrophobicContact CE2-CE2 3.51Å; F449-F471 HydrophobicContact CE2-CZ 4.22Å
450	G	88.4	Confident	84.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-76.5	-35.1	178	0	0	0	0	0	115.2	G446 L447 C448 R465 Y808	G446-G450 WeakPolarHBondContact O-CA 3.35Å; G446-G450 PolarHBondContact O-N 3.46Å; L447-G450 PolarHBondContact O-N 2.97Å; C448-G450 VanDerWaalsContact C-N 3.25Å; C448-G450 PolarHBondContact O-N 3.33Å; G450-R465 WeakPolarHBondContact O-CG 3.3Å; G450-Y808 VanDerWaalsContact C-CZ 3.41Å; G450-Y808 VanDerWaalsContact CA-CZ 3.45Å; G450-Y808 WeakPolarHBondContact O-CE1 3.46Å
451	T	87.6	Confident	83.6	Confident	67 Å²	67	60.4 Å²	60.4	41%	0.411	32%	0.324	S	S	.	.	H	α-helix	trans	-87.8	-43	178.9	56	0	0	0	0	112.2	T144 L447 C448 Y808	T144-T451 HydrophobicContact CG2-CG2 3.43Å; T144-T451 VanDerWaalsContact CG2-CG2 3.43Å; L447-T451 WeakPolarHBondContact O-CB 3.42Å; L447-T451 WeakPolarHBondContact O-CG2 3.32Å; L447-T451 PolarHBondContact O-N 3.49Å; L447-T451 PolarHBondContact O-OG1 2.89Å; C448-T451 PolarHBondContact O-OG1 3.13Å; T451-Y808 WeakPolarHBondContact CG2-OH 3.5Å
452	C	84.7	Confident	82.5	Confident	113 Å²	113	63.1 Å²	63.1	76%	0.764	34%	0.338	S	S	*	.	H	α-helix	trans	-89.5	-21	-176.5	-59	0	0	0	0	113.3	C448	C448-C452 VanDerWaalsContact O-CB 3.27Å; C448-C452 WeakPolarHBondContact O-CB 3.31Å; C448-C452 PolarHBondContact O-N 3.31Å
453	G	80.6	Confident	81.6	Confident	4 Å²	4	65.8 Å²	65.8	4%	0.041	36%	0.357	C	S	.	.	S	Bend	trans	-76.2	154.4	-177.5	0	0	0	0	0	113.6	F449 C463 R465	F449-G453 VanDerWaalsContact O-CA 3.24Å; F449-G453 WeakPolarHBondContact O-CA 3.46Å; F449-G453 PolarHBondContact O-N 3.47Å; G453-C463 VanDerWaalsContact CA-O 3.28Å; G453-C463 WeakPolarHBondContact CA-O 3.37Å; G453-R465 WeakPolarHBondContact O-CG 3.19Å; G453-R465 PolarHBondContact O-NE 3.07Å
454	D	79.9	Confident	81.1	Confident	104 Å²	104	66.9 Å²	66.9	56%	0.556	36%	0.363	S	S	*	.	B	Isolated β-bridge	trans	-71.7	161.9	169.2	-74.9	-41.4	0	0	0	111.8	Y457 R465	D454-Y457 HydrophobicContact CB-CE1 4.21Å; D454-R465 WeakPolarHBondContact O-CG 3.5Å; D454-R465 PolarHBondContact O-N 3.39Å
455	R	79.1	Confident	80.7	Confident	47 Å²	47	66.1 Å²	66.1	18%	0.177	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-58.3	148.4	174.5	-72.8	-166.8	176.3	77.1	1.1	110	D132 Y457 T811 K813	D132-R455 IonicContact OD2-CZ 3.86Å; D132-R455 IonicContact OD2-NE 2.74Å; D132-R455 IonicContact OD2-NH2 3.57Å; D132-R455 PolarHBondContact OD2-NH2 3.15Å; R455-Y457 WeakPolarHBondContact O-CD1 3.26Å; R455-Y457 PolarHBondContact O-N 3.39Å; R455-T811 WeakPolarHBondContact CD-O 3.39Å; R455-K813 VanDerWaalsContact NH2-CG 3.32Å
456	P	72.3	Confident	80.2	Confident	27 Å²	27	63.7 Å²	63.7	18%	0.175	35%	0.35	C	S	.	.			trans	-71.9	99.4	176.9	27.4	-29	0	0	0	109.7	T811	P456-T811 HydrophobicContact CG-CG2 4.26Å; P456-T811 WeakPolarHBondContact O-CG2 3.45Å
457	Y	69.3	Low	80	Confident	128 Å²	128	65.5 Å²	65.5	50%	0.502	36%	0.361	S	S	.	.			trans	-112	167.4	165	57.5	-87.6	0	0	0	109.4	D454 R455 E459 A460	D454-Y457 HydrophobicContact CB-CE1 4.21Å; R455-Y457 WeakPolarHBondContact O-CD1 3.26Å; R455-Y457 PolarHBondContact O-N 3.39Å; Y457-E459 HydrophobicContact CD2-CB 3.97Å; Y457-E459 HydrophobicContact CE2-CB 3.81Å; Y457-E459 PolarHBondContact O-N 3.13Å; Y457-E459 VanDerWaalsContact O-N 3.12Å; Y457-A460 HydrophobicContact CD1-CB 3.91Å; Y457-A460 HydrophobicContact CD2-CB 4.28Å; Y457-A460 HydrophobicContact CE1-CB 3.83Å; Y457-A460 HydrophobicContact CE2-CB 4.23Å; Y457-A460 VanDerWaalsContact CE2-N 3.34Å; Y457-A460 HydrophobicContact CG-CB 4.11Å; Y457-A460 WeakPolarHBondContact O-CB 3.43Å; Y457-A460 PolarHBondContact O-N 3.02Å
458	E	61.4	Low	79.8	Confident	171 Å²	171	65.2 Å²	65.2	80%	0.799	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-32.8	-173	-69.9	-176	155	0	0	113.4	Y875	E458-Y875 PolarHBondContact OE2-OH 2.9Å
459	E	63.4	Low	79.7	Confident	173 Å²	173	62 Å²	62	81%	0.808	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	13.6	-179.1	-60.3	-178	175.9	0	0	113.9	Y457 G461	Y457-E459 HydrophobicContact CD2-CB 3.97Å; Y457-E459 HydrophobicContact CE2-CB 3.81Å; Y457-E459 PolarHBondContact O-N 3.13Å; Y457-E459 VanDerWaalsContact O-N 3.12Å; E459-G461 PolarHBondContact O-N 3.31Å
460	A	62.5	Low	79.7	Confident	19 Å²	19	63.4 Å²	63.4	16%	0.157	35%	0.347	C	S	.	.			trans	-66.2	137.6	-179.5	0	0	0	0	0	111.4	Y457 N464	Y457-A460 HydrophobicContact CD1-CB 3.91Å; Y457-A460 HydrophobicContact CD2-CB 4.28Å; Y457-A460 HydrophobicContact CE1-CB 3.83Å; Y457-A460 HydrophobicContact CE2-CB 4.23Å; Y457-A460 VanDerWaalsContact CE2-N 3.34Å; Y457-A460 HydrophobicContact CG-CB 4.11Å; Y457-A460 WeakPolarHBondContact O-CB 3.43Å; Y457-A460 PolarHBondContact O-N 3.02Å; A460-N464 HydrophobicContact CB-CB 3.99Å
461	G	73.5	Confident	80	Confident	50 Å²	50	66.5 Å²	66.5	52%	0.515	36%	0.361	S	S	.	.			trans	-60.6	173	176.3	0	0	0	0	0	113.9	E459 C463 N464	E459-G461 PolarHBondContact O-N 3.31Å; G461-C463 PolarHBondContact O-N 3.42Å; G461-C463 VanDerWaalsContact O-N 3.17Å; G461-N464 PolarHBondContact O-ND2 2.91Å
462	L	72.8	Confident	80.4	Confident	155 Å²	155	63.3 Å²	63.3	81%	0.812	34%	0.341	S	S	*	.	S	Bend	trans	-54.1	-37.3	-179.2	-173.7	67.1	0	0	0	112.6	N464	L462-N464 PolarHBondContact O-N 3.47Å
463	C	79.4	Confident	80.7	Confident	75 Å²	75	59 Å²	59	51%	0.507	31%	0.31	S	S	.	.	S	Bend	trans	-88.9	74.8	178	-63.6	0	0	0	0	111.4	F449 G453 G461	F449-C463 HydrophobicContact CD1-CB 4.07Å; F449-C463 HydrophobicContact CE1-CB 4.34Å; F449-C463 VanDerWaalsContact CE1-SG 3.57Å; G453-C463 VanDerWaalsContact CA-O 3.28Å; G453-C463 WeakPolarHBondContact CA-O 3.37Å; G461-C463 PolarHBondContact O-N 3.42Å; G461-C463 VanDerWaalsContact O-N 3.17Å
464	N	85.9	Confident	81.4	Confident	23 Å²	23	60.8 Å²	60.8	12%	0.123	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-119.7	163.4	176.3	70.1	58.8	0	0	0	112.8	F449 A460 G461 L462 G466 V467 G468	F449-N464 CarbonylContact O-C 3.55Å; A460-N464 HydrophobicContact CB-CB 3.99Å; G461-N464 PolarHBondContact O-ND2 2.91Å; L462-N464 PolarHBondContact O-N 3.47Å; N464-G466 PolarHBondContact O-N 2.95Å; N464-G466 VanDerWaalsContact OD1-CA 3.29Å; N464-G466 WeakPolarHBondContact OD1-CA 3.45Å; N464-G466 PolarHBondContact OD1-N 3.17Å; N464-V467 WeakPolarHBondContact O-CB 3.22Å; N464-V467 PolarHBondContact O-N 2.85Å; N464-V467 VanDerWaalsContact O-N 3.16Å; N464-V467 PolarHBondContact OD1-N 2.93Å; N464-G468 PolarHBondContact O-N 2.93Å; N464-G468 VanDerWaalsContact O-N 3.14Å
465	R	87.3	Confident	82.2	Confident	45 Å²	45	55.8 Å²	55.8	17%	0.17	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-29.1	-178.9	-61.6	-177.4	-173.8	179.7	-4.4	113.1	R140 G450 G453 D454 V467 G468 A469 Y808	R140-R465 VanDerWaalsContact NH1-NH1 3.14Å; G450-R465 WeakPolarHBondContact O-CG 3.3Å; G453-R465 WeakPolarHBondContact O-CG 3.19Å; G453-R465 PolarHBondContact O-NE 3.07Å; D454-R465 WeakPolarHBondContact O-CG 3.5Å; D454-R465 PolarHBondContact O-N 3.39Å; R465-V467 VanDerWaalsContact C-N 3.33Å; R465-G468 PolarHBondContact O-N 3.39Å; R465-A469 PolarHBondContact O-N 3.12Å; R465-Y808 HydrophobicContact CB-CG 4.42Å; R465-Y808 VanDerWaalsContact CB-O 3.25Å; R465-Y808 WeakPolarHBondContact CB-O 3.41Å; R465-Y808 WeakPolarHBondContact O-CB 3.26Å
466	G	85.4	Confident	82.9	Confident	11 Å²	11	53.6 Å²	53.6	11%	0.113	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-42.8	174.7	0	0	0	0	0	112	N464 A469 N470	N464-G466 PolarHBondContact O-N 2.95Å; N464-G466 VanDerWaalsContact OD1-CA 3.29Å; N464-G466 WeakPolarHBondContact OD1-CA 3.45Å; N464-G466 PolarHBondContact OD1-N 3.17Å; G466-A469 WeakPolarHBondContact O-CB 3.25Å; G466-A469 PolarHBondContact O-N 3.25Å; G466-N470 PolarHBondContact O-N 2.82Å; G466-N470 VanDerWaalsContact O-N 3.12Å
467	V	88.8	Confident	84	Confident	38 Å²	38	52.9 Å²	52.9	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-44.7	173	174.2	0	0	0	0	110.6	F449 N464 R465 A469 N470 F471	F449-V467 HydrophobicContact CD2-CG1 4.16Å; N464-V467 WeakPolarHBondContact O-CB 3.22Å; N464-V467 PolarHBondContact O-N 2.85Å; N464-V467 VanDerWaalsContact O-N 3.16Å; N464-V467 PolarHBondContact OD1-N 2.93Å; R465-V467 VanDerWaalsContact C-N 3.33Å; V467-A469 VanDerWaalsContact C-N 3.31Å; V467-A469 PolarHBondContact O-N 2.83Å; V467-N470 WeakPolarHBondContact O-CB 3.38Å; V467-N470 PolarHBondContact O-N 3.42Å; V467-F471 HydrophobicContact CG1-CD2 3.74Å; V467-F471 HydrophobicContact CG1-CE2 3.51Å; V467-F471 WeakPolarHBondContact O-CD2 3.47Å; V467-F471 PolarHBondContact O-N 3.34Å
468	G	90.7	Very high	85.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-56	-42.9	174.2	0	0	0	0	0	113.3	G446 N464 R465 N470 F471 L472	G446-G468 WeakPolarHBondContact CA-O 3.43Å; G446-G468 WeakPolarHBondContact O-CA 3.34Å; N464-G468 PolarHBondContact O-N 2.93Å; N464-G468 VanDerWaalsContact O-N 3.14Å; R465-G468 PolarHBondContact O-N 3.39Å; G468-N470 VanDerWaalsContact C-N 3.33Å; G468-N470 PolarHBondContact O-N 3.36Å; G468-F471 PolarHBondContact O-N 3.26Å; G468-L472 WeakPolarHBondContact O-CG 3.17Å; G468-L472 PolarHBondContact O-N 2.67Å
469	A	90.4	Very high	86.9	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-38.8	174.7	0	0	0	0	0	112.9	R465 G466 V467 L472 L473 A805 R809	R465-A469 PolarHBondContact O-N 3.12Å; G466-A469 WeakPolarHBondContact O-CB 3.25Å; G466-A469 PolarHBondContact O-N 3.25Å; V467-A469 VanDerWaalsContact C-N 3.31Å; V467-A469 PolarHBondContact O-N 2.83Å; A469-L472 PolarHBondContact O-N 3.44Å; A469-L473 VanDerWaalsContact O-CG 3.3Å; A469-L473 WeakPolarHBondContact O-CG 3.39Å; A469-L473 PolarHBondContact O-N 3.47Å; A469-L473 VanDerWaalsContact O-N 3.07Å; A469-A805 HydrophobicContact CB-CB 4.05Å; A469-A805 WeakPolarHBondContact CB-O 3.43Å; A469-R809 HydrophobicContact CB-CG 3.77Å
470	N	90.3	Very high	88.5	Confident	81 Å²	81	34.2 Å²	34.2	43%	0.433	20%	0.204	S	C	.	.	H	α-helix	trans	-67.6	-41	177.8	-68.8	-18.5	0	0	0	111.4	G466 V467 G468 L473 A474 R809	G466-N470 PolarHBondContact O-N 2.82Å; G466-N470 VanDerWaalsContact O-N 3.12Å; V467-N470 WeakPolarHBondContact O-CB 3.38Å; V467-N470 PolarHBondContact O-N 3.42Å; G468-N470 VanDerWaalsContact C-N 3.33Å; G468-N470 PolarHBondContact O-N 3.36Å; N470-L473 PolarHBondContact O-N 2.96Å; N470-A474 WeakPolarHBondContact O-CB 3.44Å; N470-A474 PolarHBondContact O-N 3.38Å; N470-R809 PolarHBondContact OD1-NH2 3.15Å
471	F	95.1	Very high	90	Very high	65 Å²	65	38.6 Å²	38.6	29%	0.285	22%	0.224	S	C	.	.	H	α-helix	trans	-61.7	-46.4	173	-82.5	-69.3	0	0	0	112	I442 L445 F449 V467 G468 L473 A474 G475	I442-F471 HydrophobicContact CG2-CB 4.4Å; I442-F471 HydrophobicContact CG2-CD1 4.23Å; I442-F471 WeakPolarHBondContact CG2-O 3.43Å; L445-F471 HydrophobicContact CB-CD1 4.38Å; L445-F471 HydrophobicContact CB-CG 4.36Å; L445-F471 HydrophobicContact CD1-CE1 4.32Å; F449-F471 AromaticContact CD2-CD2 3.68Å; F449-F471 HydrophobicContact CD2-CD2 3.68Å; F449-F471 AromaticContact CD2-CE2 3.64Å; F449-F471 HydrophobicContact CD2-CE2 3.64Å; F449-F471 HydrophobicContact CE2-CD2 4.01Å; F449-F471 AromaticContact CE2-CE2 3.51Å; F449-F471 HydrophobicContact CE2-CE2 3.51Å; F449-F471 HydrophobicContact CE2-CZ 4.22Å; V467-F471 HydrophobicContact CG1-CD2 3.74Å; V467-F471 HydrophobicContact CG1-CE2 3.51Å; V467-F471 WeakPolarHBondContact O-CD2 3.47Å; V467-F471 PolarHBondContact O-N 3.34Å; G468-F471 PolarHBondContact O-N 3.26Å; F471-L473 VanDerWaalsContact C-N 3.28Å; F471-L473 PolarHBondContact O-N 3.39Å; F471-A474 PolarHBondContact O-N 3.11Å; F471-A474 VanDerWaalsContact O-N 3.15Å; F471-G475 PolarHBondContact O-N 3.45Å
472	L	95	Very high	91	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-56.3	-43.3	175.8	-71.6	-177.1	0	0	0	112.1	L147 L443 L447 G468 A469 G475 V476 A801 L804 A805 Y808	L147-L472 HydrophobicContact CD2-CD2 3.79Å; L443-L472 HydrophobicContact CD2-CD2 3.88Å; L447-L472 HydrophobicContact CG-CD2 4.44Å; G468-L472 WeakPolarHBondContact O-CG 3.17Å; G468-L472 PolarHBondContact O-N 2.67Å; A469-L472 PolarHBondContact O-N 3.44Å; L472-G475 PolarHBondContact O-N 3.08Å; L472-V476 VanDerWaalsContact O-CG2 3.32Å; L472-V476 WeakPolarHBondContact O-CG2 3.32Å; L472-V476 PolarHBondContact O-N 3.39Å; L472-A801 HydrophobicContact CB-CB 4.47Å; L472-L804 HydrophobicContact CD1-CB 4.11Å; L472-L804 HydrophobicContact CD1-CD2 3.93Å; L472-L804 HydrophobicContact CD1-CG 3.96Å; L472-A805 HydrophobicContact CB-CB 4.31Å; L472-Y808 HydrophobicContact CD1-CD2 3.89Å; L472-Y808 HydrophobicContact CD1-CE2 3.7Å
473	L	92.6	Very high	92.1	Very high	22 Å²	22	31.2 Å²	31.2	12%	0.115	17%	0.172	C	C	.	.	H	α-helix	trans	-71.8	-33.4	178.6	-69.3	168.9	0	0	0	113	F115 R119 A469 N470 F471 V476 G477 V802 A805	F115-L473 HydrophobicContact CZ-CD2 4.31Å; R119-L473 VanDerWaalsContact NH2-CD1 3.29Å; A469-L473 VanDerWaalsContact O-CG 3.3Å; A469-L473 WeakPolarHBondContact O-CG 3.39Å; A469-L473 PolarHBondContact O-N 3.47Å; A469-L473 VanDerWaalsContact O-N 3.07Å; N470-L473 PolarHBondContact O-N 2.96Å; F471-L473 VanDerWaalsContact C-N 3.28Å; F471-L473 PolarHBondContact O-N 3.39Å; L473-V476 PolarHBondContact O-N 2.94Å; L473-G477 PolarHBondContact O-N 2.89Å; L473-V802 HydrophobicContact CD2-CG2 4.32Å; L473-A805 HydrophobicContact CD1-CB 4.11Å; L473-A805 HydrophobicContact CD2-CB 4.09Å; L473-A805 HydrophobicContact CG-CB 3.79Å
474	A	94.4	Very high	92.8	Very high	42 Å²	42	30.3 Å²	30.3	35%	0.347	16%	0.164	S	C	.	.	H	α-helix	trans	-63.7	-43.8	171.8	0	0	0	0	0	110.8	I442 N470 F471 V476 G477 F478	I442-A474 HydrophobicContact CG2-CB 4.17Å; N470-A474 WeakPolarHBondContact O-CB 3.44Å; N470-A474 PolarHBondContact O-N 3.38Å; F471-A474 PolarHBondContact O-N 3.11Å; F471-A474 VanDerWaalsContact O-N 3.15Å; A474-V476 VanDerWaalsContact C-N 3.34Å; A474-V476 PolarHBondContact O-N 3.47Å; A474-G477 WeakPolarHBondContact O-CA 3.48Å; A474-G477 PolarHBondContact O-N 2.88Å; A474-G477 VanDerWaalsContact O-N 3.09Å; A474-F478 WeakPolarHBondContact O-CD2 3.15Å; A474-F478 PolarHBondContact O-N 3.37Å
475	G	95.9	Very high	93.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59.2	-43.8	173.9	0	0	0	0	0	111.9	F471 L472 G477 F478 M479	F471-G475 PolarHBondContact O-N 3.45Å; L472-G475 PolarHBondContact O-N 3.08Å; G475-G477 VanDerWaalsContact C-N 3.32Å; G475-G477 PolarHBondContact O-N 3.44Å; G475-F478 PolarHBondContact O-N 2.77Å; G475-M479 WeakPolarHBondContact O-CG 3.27Å; G475-M479 PolarHBondContact O-N 2.9Å
476	V	95.5	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-41.5	172.2	170.1	0	0	0	0	112.2	F115 L472 L473 A474 M479 F480 I798 A801 V802	F115-V476 HydrophobicContact CE1-CG1 4.2Å; L472-V476 VanDerWaalsContact O-CG2 3.32Å; L472-V476 WeakPolarHBondContact O-CG2 3.32Å; L472-V476 PolarHBondContact O-N 3.39Å; L473-V476 PolarHBondContact O-N 2.94Å; A474-V476 VanDerWaalsContact C-N 3.34Å; A474-V476 PolarHBondContact O-N 3.47Å; V476-M479 HydrophobicContact CB-CE 4.28Å; V476-M479 HydrophobicContact CG2-CE 3.75Å; V476-M479 PolarHBondContact O-N 2.98Å; V476-F480 HydrophobicContact CG1-CD2 3.86Å; V476-F480 HydrophobicContact CG1-CE2 3.48Å; V476-F480 VanDerWaalsContact CG1-CE2 3.48Å; V476-F480 HydrophobicContact CG1-CZ 4.41Å; V476-F480 VanDerWaalsContact O-CD2 3.24Å; V476-F480 WeakPolarHBondContact O-CD2 3.43Å; V476-F480 PolarHBondContact O-N 3.3Å; V476-F480 VanDerWaalsContact O-N 3.09Å; V476-I798 HydrophobicContact CG1-CG1 4.37Å; V476-I798 HydrophobicContact CG1-CG2 3.98Å; V476-I798 HydrophobicContact CG2-CG1 4.46Å; V476-A801 HydrophobicContact CG2-CB 3.63Å; V476-V802 HydrophobicContact CG1-CG2 4.09Å; V476-V802 HydrophobicContact CG2-CG2 4.1Å
477	G	93.9	Very high	94.1	Very high	12 Å²	12	32 Å²	32	12%	0.124	17%	0.172	C	C	.	.	H	α-helix	trans	-60	-47	175.2	0	0	0	0	0	113.1	F116 L473 A474 G475 F480 L481	F116-G477 VanDerWaalsContact CZ-CA 3.49Å; L473-G477 PolarHBondContact O-N 2.89Å; A474-G477 WeakPolarHBondContact O-CA 3.48Å; A474-G477 PolarHBondContact O-N 2.88Å; A474-G477 VanDerWaalsContact O-N 3.09Å; G475-G477 VanDerWaalsContact C-N 3.32Å; G475-G477 PolarHBondContact O-N 3.44Å; G477-F480 PolarHBondContact O-N 2.78Å; G477-L481 WeakPolarHBondContact O-CB 3.46Å; G477-L481 PolarHBondContact O-N 2.78Å
478	F	95.7	Very high	94.3	Very high	70 Å²	70	32.6 Å²	32.6	31%	0.307	18%	0.181	S	C	.	.	H	α-helix	trans	-66.5	-36.4	176.3	-74.4	-55.5	0	0	0	112.9	I439 I442 A474 G475 F480 L481 F482	I439-F478 HydrophobicContact CD1-CB 4.13Å; I439-F478 HydrophobicContact CG1-CB 3.71Å; I442-F478 HydrophobicContact CD1-CD2 3.53Å; I442-F478 HydrophobicContact CD1-CE2 3.55Å; A474-F478 WeakPolarHBondContact O-CD2 3.15Å; A474-F478 PolarHBondContact O-N 3.37Å; G475-F478 PolarHBondContact O-N 2.77Å; F478-F480 VanDerWaalsContact C-N 3.32Å; F478-F480 PolarHBondContact O-N 2.01Å; F478-L481 HydrophobicContact CD1-CD2 4.17Å; F478-L481 HydrophobicContact CE1-CD2 4.45Å; F478-L481 PolarHBondContact O-N 3.24Å; F478-F482 HydrophobicContact CB-CD2 4.25Å; F478-F482 HydrophobicContact CB-CE2 4.48Å; F478-F482 HydrophobicContact CD1-CD2 4.02Å; F478-F482 AromaticContact CD1-CE2 3.47Å; F478-F482 HydrophobicContact CD1-CE2 3.47Å; F478-F482 VanDerWaalsContact CD1-CE2 3.47Å; F478-F482 HydrophobicContact CD1-CZ 4.48Å; F478-F482 HydrophobicContact CE1-CE2 4.05Å; F478-F482 HydrophobicContact CG-CE2 4.34Å; F478-F482 WeakPolarHBondContact O-CD2 3.14Å; F478-F482 PolarHBondContact O-N 3.42Å
479	M	96.3	Very high	94.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-45.8	172.7	-76.8	-171.1	-79.4	0	0	111.2	I439 L443 G475 V476 S483 F794 A797 I798	I439-M479 HydrophobicContact CD1-CG 4.16Å; I439-M479 HydrophobicContact CG2-CG 3.55Å; I439-M479 HydrophobicContact CG2-SD 4.26Å; L443-M479 HydrophobicContact CD1-CE 4.13Å; L443-M479 HydrophobicContact CD2-CE 4.32Å; G475-M479 WeakPolarHBondContact O-CG 3.27Å; G475-M479 PolarHBondContact O-N 2.9Å; V476-M479 HydrophobicContact CB-CE 4.28Å; V476-M479 HydrophobicContact CG2-CE 3.75Å; V476-M479 PolarHBondContact O-N 2.98Å; M479-S483 WeakPolarHBondContact O-CB 3.5Å; M479-S483 PolarHBondContact O-N 2.88Å; M479-S483 VanDerWaalsContact O-N 3.16Å; M479-F794 HydrophobicContact CB-CD2 4.19Å; M479-F794 HydrophobicContact CB-CE2 4.44Å; M479-F794 HydrophobicContact CB-CG 4.39Å; M479-F794 HydrophobicContact CG-CD1 3.96Å; M479-F794 HydrophobicContact CG-CD2 4.17Å; M479-F794 HydrophobicContact CG-CE1 4.1Å; M479-F794 HydrophobicContact CG-CE2 4.25Å; M479-F794 HydrophobicContact CG-CG 4.05Å; M479-F794 HydrophobicContact CG-CZ 4.25Å; M479-F794 HydrophobicContact SD-CB 4.08Å; M479-F794 HydrophobicContact SD-CD1 3.62Å; M479-F794 HydrophobicContact SD-CE1 4.21Å; M479-F794 HydrophobicContact SD-CG 3.88Å; M479-A797 HydrophobicContact CE-CB 4.47Å; M479-A797 HydrophobicContact SD-CB 4.27Å; M479-I798 HydrophobicContact CB-CD1 4.1Å; M479-I798 HydrophobicContact CB-CG1 4.26Å; M479-I798 HydrophobicContact CE-CG1 3.55Å; M479-I798 HydrophobicContact SD-CD1 4.44Å; M479-I798 HydrophobicContact SD-CG1 3.84Å
480	F	96.2	Very high	94.5	Very high	10 Å²	10	34.1 Å²	34.1	4%	0.044	19%	0.191	C	C	.	.	H	α-helix	trans	-67.1	-45.7	175.6	-70.1	-53.6	0	0	0	112.5	M108 V111 F115 F116 V476 G477 F478 F482 S483 I798	M108-F480 HydrophobicContact CB-CD1 4.5Å; M108-F480 HydrophobicContact CE-CD1 4.17Å; M108-F480 HydrophobicContact CE-CE1 4.39Å; M108-F480 WeakPolarHBondContact O-CD1 3.13Å; M108-F480 HydrophobicContact SD-CD1 4.35Å; M108-F480 HydrophobicContact SD-CE1 4.22Å; V111-F480 HydrophobicContact CB-CE1 4.45Å; V111-F480 HydrophobicContact CG1-CE1 4.11Å; V111-F480 HydrophobicContact CG1-CZ 4.17Å; F115-F480 HydrophobicContact CB-CE2 4.49Å; F115-F480 HydrophobicContact CD1-CE2 4.05Å; F115-F480 HydrophobicContact CG-CE2 4.37Å; F116-F480 HydrophobicContact CE2-CD2 4.48Å; V476-F480 HydrophobicContact CG1-CD2 3.86Å; V476-F480 HydrophobicContact CG1-CE2 3.48Å; V476-F480 VanDerWaalsContact CG1-CE2 3.48Å; V476-F480 HydrophobicContact CG1-CZ 4.41Å; V476-F480 VanDerWaalsContact O-CD2 3.24Å; V476-F480 WeakPolarHBondContact O-CD2 3.43Å; V476-F480 PolarHBondContact O-N 3.3Å; V476-F480 VanDerWaalsContact O-N 3.09Å; G477-F480 PolarHBondContact O-N 2.78Å; F478-F480 VanDerWaalsContact C-N 3.32Å; F478-F480 PolarHBondContact O-N 2.01Å; F480-F482 PolarHBondContact O-N 3.21Å; F480-S483 PolarHBondContact O-OG 2.91Å; F480-I798 HydrophobicContact CD1-CD1 4.13Å; F480-I798 HydrophobicContact CE1-CD1 3.69Å; F480-I798 HydrophobicContact CE2-CD1 4.47Å; F480-I798 HydrophobicContact CE2-CG2 4.2Å; F480-I798 HydrophobicContact CZ-CD1 3.89Å; F480-I798 HydrophobicContact CZ-CG2 3.76Å
481	L	94.1	Very high	94.8	Very high	112 Å²	112	31.3 Å²	31.3	59%	0.586	18%	0.176	S	C	*	.	H	α-helix	trans	-60	-45.6	-175.6	-177.6	65.3	0	0	0	112.8	G477 F478	G477-L481 WeakPolarHBondContact O-CB 3.46Å; G477-L481 PolarHBondContact O-N 2.78Å; F478-L481 HydrophobicContact CD1-CD2 4.17Å; F478-L481 HydrophobicContact CE1-CD2 4.45Å; F478-L481 PolarHBondContact O-N 3.24Å
482	F	95.6	Very high	94.6	Very high	50 Å²	50	33.1 Å²	33.1	22%	0.219	19%	0.192	C	C	.	.	H	α-helix	trans	-96.2	-6.4	-174.4	-65.1	-65.6	0	0	0	114	I435 F478 F480 T484 I485 L486	I435-F482 HydrophobicContact CD1-CD1 4.08Å; I435-F482 HydrophobicContact CD1-CE1 4.39Å; I435-F482 HydrophobicContact CD1-CG 4.45Å; I435-F482 HydrophobicContact CG2-CB 3.62Å; I435-F482 HydrophobicContact CG2-CD1 4.19Å; I435-F482 HydrophobicContact CG2-CD2 3.49Å; I435-F482 VanDerWaalsContact CG2-CD2 3.49Å; I435-F482 HydrophobicContact CG2-CE2 4.13Å; I435-F482 HydrophobicContact CG2-CG 3.52Å; F478-F482 HydrophobicContact CB-CD2 4.25Å; F478-F482 HydrophobicContact CB-CE2 4.48Å; F478-F482 HydrophobicContact CD1-CD2 4.02Å; F478-F482 AromaticContact CD1-CE2 3.47Å; F478-F482 HydrophobicContact CD1-CE2 3.47Å; F478-F482 VanDerWaalsContact CD1-CE2 3.47Å; F478-F482 HydrophobicContact CD1-CZ 4.48Å; F478-F482 HydrophobicContact CE1-CE2 4.05Å; F478-F482 HydrophobicContact CG-CE2 4.34Å; F478-F482 WeakPolarHBondContact O-CD2 3.14Å; F478-F482 PolarHBondContact O-N 3.42Å; F480-F482 PolarHBondContact O-N 3.21Å; F482-T484 VanDerWaalsContact C-N 3.3Å; F482-T484 PolarHBondContact O-N 3.06Å; F482-I485 HydrophobicContact CD1-CD1 4.45Å; F482-I485 PolarHBondContact O-N 2.7Å; F482-L486 HydrophobicContact CB-CD1 4.31Å; F482-L486 HydrophobicContact CB-CG 4.48Å; F482-L486 WeakPolarHBondContact O-CG 3.47Å; F482-L486 PolarHBondContact O-N 2.75Å
483	S	94.8	Very high	94.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-51.7	-44.8	-179.2	57.3	0	0	0	0	113.6	M108 M479 F480 M487	M108-S483 WeakPolarHBondContact CB-OG 3.22Å; M479-S483 WeakPolarHBondContact O-CB 3.5Å; M479-S483 PolarHBondContact O-N 2.88Å; M479-S483 VanDerWaalsContact O-N 3.16Å; F480-S483 PolarHBondContact O-OG 2.91Å; S483-M487 WeakPolarHBondContact O-CB 3.45Å; S483-M487 PolarHBondContact O-N 3.44Å
484	T	94.9	Very high	94.7	Very high	55 Å²	55	33.4 Å²	33.4	34%	0.337	19%	0.194	S	C	.	.	H	α-helix	trans	-64.5	-45.7	-178.8	-52.2	0	0	0	0	111.8	A105 P109 F482 M487 A488	A105-T484 HydrophobicContact CB-CG2 4.27Å; A105-T484 PolarHBondContact O-OG1 2.83Å; P109-T484 WeakPolarHBondContact CG-OG1 3.16Å; F482-T484 VanDerWaalsContact C-N 3.3Å; F482-T484 PolarHBondContact O-N 3.06Å; T484-M487 PolarHBondContact O-N 3.17Å; T484-A488 WeakPolarHBondContact O-CB 3.09Å; T484-A488 PolarHBondContact O-N 2.94Å
485	I	94.6	Very high	94.6	Very high	92 Å²	92	34.4 Å²	34.4	47%	0.472	19%	0.194	S	C	.	.	H	α-helix	trans	-66.7	-46.2	-178.7	-64.7	171.4	0	0	0	110.3	L432 F482 M487 A488 S489	L432-I485 HydrophobicContact CD2-CG2 3.81Å; F482-I485 HydrophobicContact CD1-CD1 4.45Å; F482-I485 PolarHBondContact O-N 2.7Å; I485-M487 PolarHBondContact O-N 2.93Å; I485-A488 PolarHBondContact O-N 3.08Å; I485-S489 PolarHBondContact O-N 2.76Å
486	L	95.5	Very high	94.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.7	-40.9	178.7	-65.3	175.8	0	0	0	111.7	L432 I435 F482 S489 C490 L787 L791 F794	L432-L486 HydrophobicContact CD2-CD2 4.39Å; L432-L486 WeakPolarHBondContact O-CD2 3.29Å; I435-L486 HydrophobicContact CB-CD2 4.49Å; I435-L486 HydrophobicContact CD1-CD2 4.47Å; I435-L486 HydrophobicContact CG2-CD1 4.21Å; F482-L486 HydrophobicContact CB-CD1 4.31Å; F482-L486 HydrophobicContact CB-CG 4.48Å; F482-L486 WeakPolarHBondContact O-CG 3.47Å; F482-L486 PolarHBondContact O-N 2.75Å; L486-S489 WeakPolarHBondContact O-CB 3.5Å; L486-S489 PolarHBondContact O-N 2.66Å; L486-C490 PolarHBondContact O-N 3.36Å; L486-C490 VanDerWaalsContact O-N 3.13Å; L486-L787 HydrophobicContact CD2-CD1 4.37Å; L486-L791 HydrophobicContact CB-CD1 4.09Å; L486-L791 HydrophobicContact CB-CD2 3.67Å; L486-L791 HydrophobicContact CB-CG 4.36Å; L486-L791 HydrophobicContact CD1-CD2 4.12Å; L486-F794 HydrophobicContact CD1-CE2 4.15Å; L486-F794 HydrophobicContact CD1-CZ 4.25Å
487	M	96.1	Very high	94.3	Very high	23 Å²	23	39.7 Å²	39.7	11%	0.113	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-39	176.9	-176.1	57.1	77	0	0	112	G101 F104 A105 S483 T484 I485 S489 C490 I491 L791	G101-M487 VanDerWaalsContact O-CG 3.31Å; G101-M487 WeakPolarHBondContact O-CG 3.34Å; F104-M487 HydrophobicContact CB-CE 3.93Å; F104-M487 HydrophobicContact CD1-CB 3.99Å; F104-M487 HydrophobicContact CD1-CE 3.24Å; F104-M487 HydrophobicContact CD1-CG 3.96Å; F104-M487 HydrophobicContact CD1-SD 4.45Å; F104-M487 HydrophobicContact CD2-CE 4.23Å; F104-M487 HydrophobicContact CE1-CB 4.31Å; F104-M487 HydrophobicContact CE1-CE 3.67Å; F104-M487 HydrophobicContact CG-CE 3.55Å; F104-M487 HydrophobicContact CZ-CE 4.31Å; A105-M487 HydrophobicContact CB-CB 4.24Å; A105-M487 HydrophobicContact CB-CG 4.07Å; S483-M487 WeakPolarHBondContact O-CB 3.45Å; S483-M487 PolarHBondContact O-N 3.44Å; T484-M487 PolarHBondContact O-N 3.17Å; I485-M487 PolarHBondContact O-N 2.93Å; M487-S489 VanDerWaalsContact C-N 3.28Å; M487-S489 PolarHBondContact O-N 3.08Å; M487-C490 WeakPolarHBondContact O-CB 3.41Å; M487-C490 PolarHBondContact O-N 3.29Å; M487-C490 HydrophobicContact SD-CB 4.37Å; M487-I491 HydrophobicContact CG-CD1 3.98Å; M487-I491 HydrophobicContact CG-CG1 4.4Å; M487-I491 WeakPolarHBondContact O-CG1 3.49Å; M487-I491 PolarHBondContact O-N 2.76Å; M487-I491 HydrophobicContact SD-CD1 4.45Å; M487-I491 HydrophobicContact SD-CG1 4.33Å; M487-L791 HydrophobicContact CB-CD1 4.18Å; M487-L791 HydrophobicContact CE-CB 4.14Å; M487-L791 HydrophobicContact CE-CD1 4.01Å; M487-L791 HydrophobicContact SD-CD1 4.28Å
488	A	92.5	Very high	94.3	Very high	51 Å²	51	39.1 Å²	39.1	42%	0.421	21%	0.211	S	C	.	.	H	α-helix	trans	-59.7	-40.8	173.3	0	0	0	0	0	111.7	T484 I485 C490 I491 V492	T484-A488 WeakPolarHBondContact O-CB 3.09Å; T484-A488 PolarHBondContact O-N 2.94Å; I485-A488 PolarHBondContact O-N 3.08Å; A488-C490 PolarHBondContact O-N 3.24Å; A488-I491 PolarHBondContact O-N 3.2Å; A488-V492 PolarHBondContact O-N 3.44Å
489	S	91.5	Very high	94	Very high	24 Å²	24	38 Å²	38	17%	0.168	21%	0.21	C	C	.	.	H	α-helix	trans	-67.9	-16.5	174.2	-172.1	0	0	0	0	114.2	L432 I485 L486 M487 P493	L432-S489 WeakPolarHBondContact CD1-OG 3.41Å; I485-S489 PolarHBondContact O-N 2.76Å; L486-S489 WeakPolarHBondContact O-CB 3.5Å; L486-S489 PolarHBondContact O-N 2.66Å; M487-S489 VanDerWaalsContact C-N 3.28Å; M487-S489 PolarHBondContact O-N 3.08Å; S489-P493 WeakPolarHBondContact O-CD 3.32Å; S489-P493 VanDerWaalsContact O-CG 3.25Å; S489-P493 WeakPolarHBondContact O-CG 3.38Å
490	C	94.9	Very high	93.7	Very high	7 Å²	7	40.8 Å²	40.8	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-84.2	-45.5	168.7	-78.9	0	0	0	0	111.6	L486 M487 A488 V492 F494 L787 G788	L486-C490 PolarHBondContact O-N 3.36Å; L486-C490 VanDerWaalsContact O-N 3.13Å; M487-C490 WeakPolarHBondContact O-CB 3.41Å; M487-C490 PolarHBondContact O-N 3.29Å; M487-C490 HydrophobicContact SD-CB 4.37Å; A488-C490 PolarHBondContact O-N 3.24Å; C490-V492 PolarHBondContact O-N 2.82Å; C490-F494 WeakPolarHBondContact O-CB 3.42Å; C490-F494 PolarHBondContact O-N 2.74Å; C490-L787 VanDerWaalsContact SG-CB 3.59Å; C490-L787 VanDerWaalsContact SG-CD2 3.56Å; C490-L787 WeakPolarHBondContact SG-CG 3.49Å; C490-G788 PolarHBondContact SG-N 3Å
491	I	95.8	Very high	93.5	Very high	22 Å²	22	40.3 Å²	40.3	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-44.6	-171.8	-70.3	168.2	0	0	0	111.6	L98 L102 M487 A488 F494 L495	L98-I491 HydrophobicContact CD1-CG2 3.56Å; L102-I491 HydrophobicContact CD2-CD1 4.26Å; M487-I491 HydrophobicContact CG-CD1 3.98Å; M487-I491 HydrophobicContact CG-CG1 4.4Å; M487-I491 WeakPolarHBondContact O-CG1 3.49Å; M487-I491 PolarHBondContact O-N 2.76Å; M487-I491 HydrophobicContact SD-CD1 4.45Å; M487-I491 HydrophobicContact SD-CG1 4.33Å; A488-I491 PolarHBondContact O-N 3.2Å; I491-F494 PolarHBondContact O-N 3.12Å; I491-L495 HydrophobicContact CG2-CD1 3.93Å; I491-L495 HydrophobicContact CG2-CG 4.29Å; I491-L495 WeakPolarHBondContact O-CG 3.32Å; I491-L495 PolarHBondContact O-N 3.43Å
492	V	91.5	Very high	93.2	Very high	103 Å²	103	35 Å²	35	62%	0.624	20%	0.195	S	C	*	.	H	α-helix	trans	-65.5	-53.4	-175.5	173.6	0	0	0	0	111.5	A488 C490 F494 L495 F496	A488-V492 PolarHBondContact O-N 3.44Å; C490-V492 PolarHBondContact O-N 2.82Å; V492-F494 VanDerWaalsContact C-N 3.31Å; V492-F494 PolarHBondContact O-N 2.78Å; V492-L495 PolarHBondContact O-N 3.43Å; V492-F496 PolarHBondContact O-N 2.98Å; V492-F496 VanDerWaalsContact O-N 3.14Å
493	P	92.5	Very high	92.6	Very high	17 Å²	17	34.1 Å²	34.1	11%	0.11	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-35.8	172.7	-26.9	38.2	0	0	0	113.8	S489 G497 F780 W784	S489-P493 WeakPolarHBondContact O-CD 3.32Å; S489-P493 VanDerWaalsContact O-CG 3.25Å; S489-P493 WeakPolarHBondContact O-CG 3.38Å; P493-G497 WeakPolarHBondContact O-CA 3.21Å; P493-G497 PolarHBondContact O-N 2.99Å; P493-F780 HydrophobicContact CB-CE1 3.73Å; P493-F780 HydrophobicContact CB-CE2 4.27Å; P493-F780 HydrophobicContact CB-CZ 3.56Å; P493-F780 HydrophobicContact CG-CZ 4.2Å; P493-F780 WeakPolarHBondContact O-CE1 3.42Å; P493-W784 HydrophobicContact CB-CB 3.96Å; P493-W784 HydrophobicContact CB-CG 4Å
494	F	96	Very high	92.3	Very high	11 Å²	11	36.5 Å²	36.5	5%	0.048	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-49.1	176.8	164.8	-112.9	0	0	0	112.3	F51 L52 I55 Y94 C97 C490 I491 V492 G498 W784	F51-F494 HydrophobicContact CE1-CD2 4.49Å; F51-F494 AromaticContact CE1-CE2 3.85Å; F51-F494 HydrophobicContact CE1-CE2 3.85Å; L52-F494 HydrophobicContact CD2-CD2 4.41Å; L52-F494 HydrophobicContact CD2-CE2 4.08Å; I55-F494 HydrophobicContact CD1-CE2 3.48Å; I55-F494 VanDerWaalsContact CD1-CE2 3.48Å; I55-F494 HydrophobicContact CD1-CZ 3.56Å; Y94-F494 AromaticContact CD1-CE1 3.83Å; Y94-F494 HydrophobicContact CD1-CE1 3.83Å; Y94-F494 HydrophobicContact CD1-CE2 4.03Å; Y94-F494 AromaticContact CD1-CZ 3.42Å; Y94-F494 HydrophobicContact CD1-CZ 3.42Å; Y94-F494 VanDerWaalsContact CD1-CZ 3.42Å; Y94-F494 HydrophobicContact CE1-CE1 4.39Å; Y94-F494 AromaticContact CE1-CE2 3.85Å; Y94-F494 HydrophobicContact CE1-CE2 3.85Å; Y94-F494 AromaticContact CE1-CZ 3.74Å; Y94-F494 HydrophobicContact CE1-CZ 3.74Å; Y94-F494 HydrophobicContact CG-CZ 4.38Å; C97-F494 HydrophobicContact CB-CE1 3.79Å; C97-F494 HydrophobicContact CB-CZ 3.68Å; C490-F494 WeakPolarHBondContact O-CB 3.42Å; C490-F494 PolarHBondContact O-N 2.74Å; I491-F494 PolarHBondContact O-N 3.12Å; V492-F494 VanDerWaalsContact C-N 3.31Å; V492-F494 PolarHBondContact O-N 2.78Å; F494-G498 WeakPolarHBondContact O-CA 3.17Å; F494-G498 PolarHBondContact O-N 2.67Å; F494-W784 HydrophobicContact CB-CD2 3.91Å; F494-W784 HydrophobicContact CB-CE3 3.96Å; F494-W784 HydrophobicContact CB-CG 4.44Å; F494-W784 HydrophobicContact CB-CZ3 4.33Å; F494-W784 HydrophobicContact CD2-CD2 4.42Å; F494-W784 HydrophobicContact CD2-CE3 4.09Å; F494-W784 AromaticContact CD2-CH2 3.42Å; F494-W784 HydrophobicContact CD2-CH2 3.42Å; F494-W784 VanDerWaalsContact CD2-CH2 3.42Å; F494-W784 AromaticContact CD2-CZ2 3.72Å; F494-W784 HydrophobicContact CD2-CZ2 3.72Å; F494-W784 AromaticContact CD2-CZ3 3.58Å; F494-W784 HydrophobicContact CD2-CZ3 3.58Å; F494-W784 HydrophobicContact CE2-CH2 4.01Å; F494-W784 HydrophobicContact CE2-CZ3 4.32Å; F494-W784 HydrophobicContact CG-CE3 4.43Å; F494-W784 HydrophobicContact CG-CH2 4.46Å; F494-W784 HydrophobicContact CG-CZ3 4.32Å
495	L	93.4	Very high	92.2	Very high	63 Å²	63	34 Å²	34	33%	0.33	19%	0.19	S	C	.	.	H	α-helix	trans	-66	-44.2	-179.4	-70.1	177.3	0	0	0	111	L98 I491 V492 T499	L98-L495 HydrophobicContact CD1-CD1 4.03Å; I491-L495 HydrophobicContact CG2-CD1 3.93Å; I491-L495 HydrophobicContact CG2-CG 4.29Å; I491-L495 WeakPolarHBondContact O-CG 3.32Å; I491-L495 PolarHBondContact O-N 3.43Å; V492-L495 PolarHBondContact O-N 3.43Å; L495-T499 VanDerWaalsContact O-CB 3.32Å; L495-T499 WeakPolarHBondContact O-CB 3.33Å; L495-T499 WeakPolarHBondContact O-CG2 3.49Å; L495-T499 PolarHBondContact O-N 2.78Å; L495-T499 PolarHBondContact O-OG1 3.06Å
496	F	92.1	Very high	91.9	Very high	112 Å²	112	30 Å²	30	49%	0.491	17%	0.169	S	C	.	.	H	α-helix	trans	-72.1	-60	-179	-179.9	-103.9	0	0	0	112.3	V492 T499 L500 F780	V492-F496 PolarHBondContact O-N 2.98Å; V492-F496 VanDerWaalsContact O-N 3.14Å; F496-T499 PolarHBondContact O-OG1 3.39Å; F496-L500 HydrophobicContact CD1-CD1 4.14Å; F496-L500 HydrophobicContact CD2-CD1 4.24Å; F496-L500 HydrophobicContact CE1-CD1 3.64Å; F496-L500 HydrophobicContact CE2-CD1 3.76Å; F496-L500 HydrophobicContact CG-CD1 4.42Å; F496-L500 HydrophobicContact CZ-CD1 3.44Å; F496-L500 VanDerWaalsContact CZ-CD1 3.44Å; F496-L500 WeakPolarHBondContact O-CG 3.32Å; F496-L500 PolarHBondContact O-N 3.47Å; F496-F780 AromaticContact CD1-CE1 3.99Å; F496-F780 HydrophobicContact CD1-CE1 3.99Å; F496-F780 HydrophobicContact CD1-CZ 4.14Å
497	G	93.3	Very high	91.6	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-69.7	-36	-175.7	0	0	0	0	0	113	P493 Q501 N781	P493-G497 WeakPolarHBondContact O-CA 3.21Å; P493-G497 PolarHBondContact O-N 2.99Å; G497-Q501 WeakPolarHBondContact O-CB 3.38Å; G497-Q501 PolarHBondContact O-N 3.21Å; G497-N781 VanDerWaalsContact CA-OD1 3.27Å; G497-N781 WeakPolarHBondContact CA-OD1 3.41Å; G497-N781 PolarHBondContact O-ND2 3.47Å; G497-N781 VanDerWaalsContact O-ND2 3.13Å; G497-N781 PolarHBondContact O-OD1 3.32Å
498	G	93.3	Very high	91.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.2	-51.1	176.6	0	0	0	0	0	111.9	Y94 F494 L500 Q501 T502 N781	Y94-G498 PolarHBondContact OH-O 3.32Å; F494-G498 WeakPolarHBondContact O-CA 3.17Å; F494-G498 PolarHBondContact O-N 2.67Å; G498-L500 PolarHBondContact O-N 3.41Å; G498-Q501 WeakPolarHBondContact O-CB 3.37Å; G498-Q501 PolarHBondContact O-N 2.83Å; G498-Q501 VanDerWaalsContact O-N 3.11Å; G498-T502 PolarHBondContact O-N 3.28Å; G498-T502 PolarHBondContact O-OG1 2.99Å; G498-N781 PolarHBondContact N-OD1 3.16Å
499	T	89	Confident	91.2	Very high	47 Å²	47	30.3 Å²	30.3	29%	0.288	17%	0.166	S	C	.	.	H	α-helix	trans	-64.1	-43	-178.1	56.8	0	0	0	0	112.1	Y94 L495 F496 Q501 T502 E503	Y94-T499 HydrophobicContact CD1-CG2 4.38Å; Y94-T499 HydrophobicContact CE1-CG2 4.06Å; Y94-T499 PolarHBondContact OH-N 2.97Å; L495-T499 VanDerWaalsContact O-CB 3.32Å; L495-T499 WeakPolarHBondContact O-CB 3.33Å; L495-T499 WeakPolarHBondContact O-CG2 3.49Å; L495-T499 PolarHBondContact O-N 2.78Å; L495-T499 PolarHBondContact O-OG1 3.06Å; F496-T499 PolarHBondContact O-OG1 3.39Å; T499-Q501 VanDerWaalsContact C-N 3.26Å; T499-Q501 PolarHBondContact O-N 3.31Å; T499-T502 PolarHBondContact O-N 3.11Å; T499-E503 VanDerWaalsContact O-CB 3.28Å; T499-E503 WeakPolarHBondContact O-CB 2.96Å; T499-E503 WeakPolarHBondContact O-CG 3.37Å; T499-E503 PolarHBondContact O-N 3.23Å
500	L	89.7	Confident	90.8	Very high	57 Å²	57	31.6 Å²	31.6	30%	0.298	18%	0.183	S	C	.	.	H	α-helix	trans	-58.9	-40.4	173.3	-72.1	174.5	0	0	0	111.7	F496 G498 V504 C505 L777	F496-L500 HydrophobicContact CD1-CD1 4.14Å; F496-L500 HydrophobicContact CD2-CD1 4.24Å; F496-L500 HydrophobicContact CE1-CD1 3.64Å; F496-L500 HydrophobicContact CE2-CD1 3.76Å; F496-L500 HydrophobicContact CG-CD1 4.42Å; F496-L500 HydrophobicContact CZ-CD1 3.44Å; F496-L500 VanDerWaalsContact CZ-CD1 3.44Å; F496-L500 WeakPolarHBondContact O-CG 3.32Å; F496-L500 PolarHBondContact O-N 3.47Å; G498-L500 PolarHBondContact O-N 3.41Å; L500-V504 HydrophobicContact CD2-CG2 4.46Å; L500-V504 WeakPolarHBondContact O-CB 3.25Å; L500-V504 PolarHBondContact O-N 3.08Å; L500-C505 PolarHBondContact O-N 3.23Å; L500-C505 VanDerWaalsContact O-N 3.09Å; L500-L777 HydrophobicContact CB-CD1 3.84Å; L500-L777 HydrophobicContact CB-CD2 4.2Å; L500-L777 HydrophobicContact CD1-CD2 4.25Å
501	Q	92.3	Very high	90.3	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.197	C	C	.	.	I	π-helix	trans	-66.1	-40.4	179.2	-169.8	66.4	-0.1	0	0	112.8	N49 L52 G497 G498 T499 R506 R511	N49-Q501 PolarHBondContact OD1-NE2 3.44Å; L52-Q501 HydrophobicContact CD1-CB 3.87Å; L52-Q501 HydrophobicContact CD1-CG 3.79Å; G497-Q501 WeakPolarHBondContact O-CB 3.38Å; G497-Q501 PolarHBondContact O-N 3.21Å; G498-Q501 WeakPolarHBondContact O-CB 3.37Å; G498-Q501 PolarHBondContact O-N 2.83Å; G498-Q501 VanDerWaalsContact O-N 3.11Å; T499-Q501 VanDerWaalsContact C-N 3.26Å; T499-Q501 PolarHBondContact O-N 3.31Å; Q501-R506 WeakPolarHBondContact O-CB 3.22Å; Q501-R506 PolarHBondContact O-N 3.39Å; Q501-R511 VanDerWaalsContact CD-NH2 3.32Å; Q501-R511 VanDerWaalsContact NE2-CZ 3.32Å; Q501-R511 PolarHBondContact O-NH2 3.34Å
502	T	88.8	Confident	89.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	I	π-helix	trans	-86.3	-31.1	-176.2	62.1	0	0	0	0	114.3	L52 R56 Y94 G498 T499 R506	L52-T502 HydrophobicContact CB-CG2 3.76Å; R56-T502 HydrophobicContact CB-CG2 3.95Å; R56-T502 HydrophobicContact CG-CG2 4.41Å; Y94-T502 HydrophobicContact CE2-CG2 4.44Å; Y94-T502 WeakPolarHBondContact OH-CG2 3.33Å; Y94-T502 PolarHBondContact OH-OG1 2.84Å; G498-T502 PolarHBondContact O-N 3.28Å; G498-T502 PolarHBondContact O-OG1 2.99Å; T499-T502 PolarHBondContact O-N 3.11Å; T502-R506 WeakPolarHBondContact O-CB 2.92Å; T502-R506 PolarHBondContact O-NE 3.11Å
503	E	83	Confident	89.4	Confident	31 Å²	31	35.6 Å²	35.6	15%	0.145	20%	0.196	C	C	.	.	I	π-helix	trans	-93.5	-29.5	-176.3	-59.4	-38.4	114.4	0	0	113.9	R56 Y91 T499 Y507	R56-E503 VanDerWaalsContact CD-OE1 3.3Å; R56-E503 WeakPolarHBondContact CD-OE1 3.46Å; R56-E503 IonicContact CZ-OE1 3.33Å; R56-E503 IonicContact CZ-OE2 3.89Å; R56-E503 IonicContact NE-OE1 3.2Å; R56-E503 PolarHBondContact NE-OE1 2.75Å; R56-E503 IonicContact NE-OE2 2.75Å; R56-E503 PolarHBondContact NE-OE2 2.81Å; R56-E503 IonicContact NH2-OE1 2.9Å; R56-E503 PolarHBondContact NH2-OE1 3.12Å; R56-E503 IonicContact NH2-OE2 3.41Å; R56-E503 PolarHBondContact NH2-OE2 3.06Å; Y91-E503 HydrophobicContact CE1-CG 4.45Å; T499-E503 VanDerWaalsContact O-CB 3.28Å; T499-E503 WeakPolarHBondContact O-CB 2.96Å; T499-E503 WeakPolarHBondContact O-CG 3.37Å; T499-E503 PolarHBondContact O-N 3.23Å; E503-Y507 VanDerWaalsContact O-CD2 3.26Å; E503-Y507 WeakPolarHBondContact O-CD2 3.48Å
504	V	86.8	Confident	89	Confident	50 Å²	50	38.5 Å²	38.5	30%	0.303	21%	0.211	S	C	.	.	I	π-helix	trans	-113.1	-65.4	-176.5	-177.4	0	0	0	0	109.6	L500 R506 Y507 L508 M519	L500-V504 HydrophobicContact CD2-CG2 4.46Å; L500-V504 WeakPolarHBondContact O-CB 3.25Å; L500-V504 PolarHBondContact O-N 3.08Å; V504-R506 VanDerWaalsContact C-N 3.34Å; V504-R506 PolarHBondContact O-N 2.91Å; V504-Y507 PolarHBondContact O-N 3.37Å; V504-L508 HydrophobicContact CG1-CD1 3.66Å; V504-L508 HydrophobicContact CG1-CG 4.36Å; V504-L508 PolarHBondContact O-N 2.99Å; V504-M519 HydrophobicContact CG1-CE 4.43Å
505	C	92.6	Very high	88.6	Confident	2 Å²	2	38 Å²	38	1%	0.014	21%	0.209	C	C	.	.	I	π-helix	trans	-66.2	-35	-169.4	-69.2	0	0	0	0	113.8	L500 Y507 L508 T509 C773 L777	L500-C505 PolarHBondContact O-N 3.23Å; L500-C505 VanDerWaalsContact O-N 3.09Å; C505-Y507 PolarHBondContact O-N 3.2Å; C505-L508 PolarHBondContact O-N 3.33Å; C505-T509 HydrophobicContact CB-CG2 4.5Å; C505-T509 WeakPolarHBondContact O-CB 3.28Å; C505-T509 WeakPolarHBondContact O-CG2 3.46Å; C505-T509 PolarHBondContact O-N 3.38Å; C505-T509 PolarHBondContact O-OG1 3.03Å; C505-C773 WeakPolarHBondContact CA-SG 3.34Å; C505-C773 HydrophobicContact CB-CB 3.5Å; C505-C773 VanDerWaalsContact CB-CB 3.5Å; C505-C773 WeakPolarHBondContact CB-SG 3.14Å; C505-C773 WeakPolarHBondContact SG-CA 3.33Å; C505-C773 WeakPolarHBondContact SG-CB 3.24Å; C505-C773 CovalentContact SG-SG 2.03Å; C505-C773 PolarHBondContact SG-SG 3.18Å; C505-L777 WeakPolarHBondContact SG-CD1 3.29Å
506	R	89.6	Confident	88.4	Confident	9 Å²	9	35.4 Å²	35.4	3%	0.034	20%	0.196	C	C	.	.	H	α-helix	trans	-56.7	-34.1	175.1	-171.3	174.5	66.7	161	3.1	112.8	D53 G57 Q501 T502 V504 R511 Y512	D53-R506 WeakPolarHBondContact OD1-CD 3.27Å; D53-R506 IonicContact OD1-NH1 2.77Å; G57-R506 PolarHBondContact O-NH1 2.94Å; Q501-R506 WeakPolarHBondContact O-CB 3.22Å; Q501-R506 PolarHBondContact O-N 3.39Å; T502-R506 WeakPolarHBondContact O-CB 2.92Å; T502-R506 PolarHBondContact O-NE 3.11Å; V504-R506 VanDerWaalsContact C-N 3.34Å; V504-R506 PolarHBondContact O-N 2.91Å; R506-R511 HydrophobicContact CG-CB 4.19Å; R506-R511 PolarHBondContact O-N 3.21Å; R506-Y512 PolarHBondContact O-N 3.19Å
507	Y	88.8	Confident	88.2	Confident	1 Å²	1	34.7 Å²	34.7	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-82.7	-46.2	177.6	-67.7	-85.9	0	0	0	111.5	P61 E503 V504 C505 G510 Y512 G515 P516 K518 M519 Y522	P61-Y507 WeakPolarHBondContact CD-OH 3.18Å; P61-Y507 HydrophobicContact CG-CE2 4.47Å; E503-Y507 VanDerWaalsContact O-CD2 3.26Å; E503-Y507 WeakPolarHBondContact O-CD2 3.48Å; V504-Y507 PolarHBondContact O-N 3.37Å; C505-Y507 PolarHBondContact O-N 3.2Å; Y507-G510 PolarHBondContact O-N 3.49Å; Y507-Y512 HydrophobicContact CD1-CD1 4.1Å; Y507-Y512 HydrophobicContact CD1-CG 4.24Å; Y507-Y512 AromaticContact CE1-CD1 3.63Å; Y507-Y512 HydrophobicContact CE1-CD1 3.63Å; Y507-Y512 HydrophobicContact CE1-CD2 4.44Å; Y507-Y512 HydrophobicContact CE1-CE1 4.03Å; Y507-Y512 AromaticContact CE1-CG 3.85Å; Y507-Y512 HydrophobicContact CE1-CG 3.85Å; Y507-G515 WeakPolarHBondContact CD1-O 3.31Å; Y507-G515 CarbonylContact O-C 3.59Å; Y507-G515 WeakPolarHBondContact O-CA 3.12Å; Y507-P516 WeakPolarHBondContact O-CD 3.21Å; Y507-K518 HydrophobicContact CD1-CB 4.4Å; Y507-K518 HydrophobicContact CE1-CB 4.41Å; Y507-M519 HydrophobicContact CG-CB 4.47Å; Y507-Y522 HydrophobicContact CD1-CE2 4.41Å; Y507-Y522 AromaticContact CE1-CE2 3.78Å; Y507-Y522 HydrophobicContact CE1-CE2 3.78Å
508	L	90.8	Very high	87.7	Confident	34 Å²	34	36.9 Å²	36.9	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-72.5	-32.7	-175	-63.7	-178.8	0	0	0	114.1	V504 C505 G510 M519 L573 V769	V504-L508 HydrophobicContact CG1-CD1 3.66Å; V504-L508 HydrophobicContact CG1-CG 4.36Å; V504-L508 PolarHBondContact O-N 2.99Å; C505-L508 PolarHBondContact O-N 3.33Å; L508-G510 VanDerWaalsContact C-N 3.27Å; L508-G510 PolarHBondContact O-N 3.26Å; L508-M519 HydrophobicContact CD1-SD 4.42Å; L508-M519 HydrophobicContact CD2-CE 4.37Å; L508-M519 HydrophobicContact CD2-SD 3.51Å; L508-M519 VanDerWaalsContact CD2-SD 3.51Å; L508-M519 HydrophobicContact CG-SD 3.8Å; L508-L573 HydrophobicContact CB-CD1 4.49Å; L508-L573 HydrophobicContact CD2-CD1 3.89Å; L508-V769 HydrophobicContact CB-CG1 3.63Å; L508-V769 HydrophobicContact CB-CG2 4.16Å; L508-V769 HydrophobicContact CD1-CG2 4.25Å
509	T	89	Confident	87.1	Confident	46 Å²	46	39 Å²	39	28%	0.282	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	6	-179.9	72.5	0	0	0	0	113.2	C505 R511 V769 C773	C505-T509 HydrophobicContact CB-CG2 4.5Å; C505-T509 WeakPolarHBondContact O-CB 3.28Å; C505-T509 WeakPolarHBondContact O-CG2 3.46Å; C505-T509 PolarHBondContact O-N 3.38Å; C505-T509 PolarHBondContact O-OG1 3.03Å; T509-R511 VanDerWaalsContact C-N 3.29Å; T509-R511 PolarHBondContact O-N 3.47Å; T509-V769 HydrophobicContact CG2-CG1 3.84Å; T509-C773 HydrophobicContact CG2-CB 3.55Å
510	G	83	Confident	86.8	Confident	51 Å²	51	37.2 Å²	37.2	53%	0.526	20%	0.198	S	C	.	.	S	Bend	trans	72.1	13	-179.7	0	0	0	0	0	115.6	Y507 L508 Y512	Y507-G510 PolarHBondContact O-N 3.49Å; L508-G510 VanDerWaalsContact C-N 3.27Å; L508-G510 PolarHBondContact O-N 3.26Å; G510-Y512 VanDerWaalsContact C-N 3.25Å; G510-Y512 PolarHBondContact O-N 2.58Å
511	R	85.3	Confident	86.3	Confident	89 Å²	89	38.5 Å²	38.5	34%	0.336	20%	0.203	S	C	.	.	S	Bend	trans	-67.7	-28.9	173.3	-73	-157.8	-53.6	-89.6	-1.4	112.2	Q501 R506 T509	Q501-R511 VanDerWaalsContact CD-NH2 3.32Å; Q501-R511 VanDerWaalsContact NE2-CZ 3.32Å; Q501-R511 PolarHBondContact O-NH2 3.34Å; R506-R511 HydrophobicContact CG-CB 4.19Å; R506-R511 PolarHBondContact O-N 3.21Å; T509-R511 VanDerWaalsContact C-N 3.29Å; T509-R511 PolarHBondContact O-N 3.47Å
512	Y	84.9	Confident	85.5	Confident	38 Å²	38	40 Å²	40	15%	0.149	21%	0.209	C	C	.	.	S	Bend	trans	-93	134.1	168.8	-156	-97.4	0	0	0	110.3	K58 R506 Y507 G510 D514 G515 K518	K58-Y512 PolarHBondContact O-OH 2.94Å; R506-Y512 PolarHBondContact O-N 3.19Å; Y507-Y512 HydrophobicContact CD1-CD1 4.1Å; Y507-Y512 HydrophobicContact CD1-CG 4.24Å; Y507-Y512 AromaticContact CE1-CD1 3.63Å; Y507-Y512 HydrophobicContact CE1-CD1 3.63Å; Y507-Y512 HydrophobicContact CE1-CD2 4.44Å; Y507-Y512 HydrophobicContact CE1-CE1 4.03Å; Y507-Y512 AromaticContact CE1-CG 3.85Å; Y507-Y512 HydrophobicContact CE1-CG 3.85Å; G510-Y512 VanDerWaalsContact C-N 3.25Å; G510-Y512 PolarHBondContact O-N 2.58Å; Y512-D514 PolarHBondContact O-N 3.33Å; Y512-G515 WeakPolarHBondContact O-CA 3.44Å; Y512-G515 PolarHBondContact O-N 3.47Å; Y512-K518 HydrophobicContact CD1-CD 3.84Å; Y512-K518 HydrophobicContact CE1-CD 3.49Å; Y512-K518 VanDerWaalsContact CE1-CD 3.49Å; Y512-K518 VanDerWaalsContact CE1-NZ 3.34Å
513	P	83.5	Confident	84.8	Confident	88 Å²	88	42.9 Å²	42.9	57%	0.571	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	131.4	178	26	-33.7	0	0	0	110.6	G515 K518	P513-G515 PolarHBondContact O-N 3.15Å; P513-K518 PolarHBondContact O-NZ 2.9Å
514	D	83.7	Confident	84.5	Confident	79 Å²	79	43.1 Å²	43.1	42%	0.422	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	36	-170.4	-51.9	-30.9	0	0	0	113	Y512 R517 K518	Y512-D514 PolarHBondContact O-N 3.33Å; D514-R517 HydrophobicContact CB-CB 4.39Å; D514-R517 PolarHBondContact O-N 3.37Å; D514-R517 IonicContact OD2-CZ 3.88Å; D514-R517 IonicContact OD2-NH2 3.41Å; D514-R517 PolarHBondContact OD2-NH2 3.22Å; D514-K518 WeakPolarHBondContact O-CB 2.77Å; D514-K518 WeakPolarHBondContact O-CG 3.41Å; D514-K518 PolarHBondContact O-N 3.11Å
515	G	87.3	Confident	83.8	Confident	1 Å²	1	45 Å²	45	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-51.8	-58.1	-173.4	0	0	0	0	0	113.7	Y507 Y512 P513 R517 K518 M519	Y507-G515 WeakPolarHBondContact CD1-O 3.31Å; Y507-G515 CarbonylContact O-C 3.59Å; Y507-G515 WeakPolarHBondContact O-CA 3.12Å; Y512-G515 WeakPolarHBondContact O-CA 3.44Å; Y512-G515 PolarHBondContact O-N 3.47Å; P513-G515 PolarHBondContact O-N 3.15Å; G515-R517 PolarHBondContact O-N 2.95Å; G515-K518 PolarHBondContact O-N 2.92Å; G515-M519 PolarHBondContact O-N 2.77Å
516	P	89.7	Confident	82.6	Confident	8 Å²	8	45.9 Å²	45.9	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-45.4	-178.3	-25.6	36.5	0	0	0	112.7	Y507 K518 M519 D520 S569 L573	Y507-P516 WeakPolarHBondContact O-CD 3.21Å; P516-K518 PolarHBondContact O-N 2.79Å; P516-M519 WeakPolarHBondContact O-CB 3.41Å; P516-M519 PolarHBondContact O-N 3.49Å; P516-M519 VanDerWaalsContact O-N 3.17Å; P516-D520 PolarHBondContact O-N 3.22Å; P516-S569 WeakPolarHBondContact CB-O 3.34Å; P516-L573 HydrophobicContact CB-CB 4.41Å; P516-L573 HydrophobicContact CB-CD1 4.42Å; P516-L573 HydrophobicContact CG-CB 4.12Å; P516-L573 HydrophobicContact CG-CD1 4.27Å
517	R	87	Confident	81.7	Confident	97 Å²	97	47.8 Å²	47.8	37%	0.366	25%	0.249	S	C	.	.	H	α-helix	trans	-56.2	-46.4	175.1	-167.1	171.7	65.6	146.3	-4.6	113.4	D514 G515 M519 D520 Q521 D570	D514-R517 HydrophobicContact CB-CB 4.39Å; D514-R517 PolarHBondContact O-N 3.37Å; D514-R517 IonicContact OD2-CZ 3.88Å; D514-R517 IonicContact OD2-NH2 3.41Å; D514-R517 PolarHBondContact OD2-NH2 3.22Å; G515-R517 PolarHBondContact O-N 2.95Å; R517-M519 VanDerWaalsContact C-N 3.34Å; R517-D520 PolarHBondContact O-N 2.98Å; R517-Q521 VanDerWaalsContact O-CG 3.32Å; R517-Q521 WeakPolarHBondContact O-CG 3.46Å; R517-Q521 PolarHBondContact O-N 3.25Å; R517-D570 HydrophobicContact CB-CB 3.89Å; R517-D570 HydrophobicContact CG-CB 4.32Å
518	K	82.8	Confident	81	Confident	46 Å²	46	50.6 Å²	50.6	20%	0.2	26%	0.261	C	S	.	.	H	α-helix	trans	-65.2	-42.5	178.5	-79	177.7	-175.9	155.8	0	110.7	Y507 Y512 P513 D514 G515 P516 D520 Q521 Y522	Y507-K518 HydrophobicContact CD1-CB 4.4Å; Y507-K518 HydrophobicContact CE1-CB 4.41Å; Y512-K518 HydrophobicContact CD1-CD 3.84Å; Y512-K518 HydrophobicContact CE1-CD 3.49Å; Y512-K518 VanDerWaalsContact CE1-CD 3.49Å; Y512-K518 VanDerWaalsContact CE1-NZ 3.34Å; P513-K518 PolarHBondContact O-NZ 2.9Å; D514-K518 WeakPolarHBondContact O-CB 2.77Å; D514-K518 WeakPolarHBondContact O-CG 3.41Å; D514-K518 PolarHBondContact O-N 3.11Å; G515-K518 PolarHBondContact O-N 2.92Å; P516-K518 PolarHBondContact O-N 2.79Å; K518-D520 PolarHBondContact O-N 2.89Å; K518-Q521 PolarHBondContact O-N 3.46Å; K518-Y522 HydrophobicContact CB-CE1 4.39Å; K518-Y522 HydrophobicContact CB-CE2 3.72Å; K518-Y522 WeakPolarHBondContact O-CB 3.49Å; K518-Y522 WeakPolarHBondContact O-CD1 2.93Å; K518-Y522 WeakPolarHBondContact O-CD2 2.98Å; K518-Y522 WeakPolarHBondContact O-CE2 3.33Å; K518-Y522 PolarHBondContact O-N 2.77Å
519	M	81.6	Confident	79.9	Confident	43 Å²	43	50.6 Å²	50.6	21%	0.212	26%	0.264	C	S	.	.	H	α-helix	trans	-58.8	-46	175.7	-176.7	170.1	173.9	0	0	111.9	V504 Y507 L508 G515 P516 R517 Q521 Y522 V523	V504-M519 HydrophobicContact CG1-CE 4.43Å; Y507-M519 HydrophobicContact CG-CB 4.47Å; L508-M519 HydrophobicContact CD1-SD 4.42Å; L508-M519 HydrophobicContact CD2-CE 4.37Å; L508-M519 HydrophobicContact CD2-SD 3.51Å; L508-M519 VanDerWaalsContact CD2-SD 3.51Å; L508-M519 HydrophobicContact CG-SD 3.8Å; G515-M519 PolarHBondContact O-N 2.77Å; P516-M519 WeakPolarHBondContact O-CB 3.41Å; P516-M519 PolarHBondContact O-N 3.49Å; P516-M519 VanDerWaalsContact O-N 3.17Å; R517-M519 VanDerWaalsContact C-N 3.34Å; M519-Q521 PolarHBondContact O-N 2.7Å; M519-Y522 WeakPolarHBondContact O-CB 3.34Å; M519-Y522 PolarHBondContact O-N 3.46Å; M519-Y522 VanDerWaalsContact O-N 3.13Å; M519-V523 WeakPolarHBondContact O-CG2 3.28Å; M519-V523 PolarHBondContact O-N 3.49Å
520	D	83	Confident	78.9	Confident	11 Å²	11	51.4 Å²	51.4	6%	0.059	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-46.5	176.2	-71.5	-31.6	0	0	0	112.2	P516 R517 K518 Y522 V523 F524 N567 L568 S569 D570	P516-D520 PolarHBondContact O-N 3.22Å; R517-D520 PolarHBondContact O-N 2.98Å; K518-D520 PolarHBondContact O-N 2.89Å; D520-Y522 PolarHBondContact O-N 3.04Å; D520-V523 PolarHBondContact O-N 2.84Å; D520-F524 VanDerWaalsContact O-CB 3.27Å; D520-F524 WeakPolarHBondContact O-CB 3.06Å; D520-F524 PolarHBondContact O-N 3.24Å; D520-N567 HydrophobicContact CB-CB 3.9Å; D520-N567 WeakPolarHBondContact CB-OD1 3.3Å; D520-N567 WeakPolarHBondContact OD2-CA 3.18Å; D520-N567 WeakPolarHBondContact OD2-CB 3.16Å; D520-N567 VanDerWaalsContact OD2-O 3.1Å; D520-L568 PolarHBondContact OD2-N 3.28Å; D520-S569 WeakPolarHBondContact OD1-CB 3.35Å; D520-S569 PolarHBondContact OD1-N 3.44Å; D520-S569 PolarHBondContact OD1-OG 2.94Å; D520-S569 WeakPolarHBondContact OD2-CA 3.35Å; D520-S569 VanDerWaalsContact OD2-CB 3.29Å; D520-S569 WeakPolarHBondContact OD2-CB 3.28Å; D520-S569 PolarHBondContact OD2-N 3.09Å; D520-D570 PolarHBondContact OD2-N 2.89Å
521	Q	79.2	Confident	78.3	Confident	84 Å²	84	49.4 Å²	49.4	39%	0.393	24%	0.243	S	C	.	.	H	α-helix	trans	-57.9	-38.8	174.6	-73.2	175.4	-10.2	0	0	111.8	R517 K518 M519 F524 E525	R517-Q521 VanDerWaalsContact O-CG 3.32Å; R517-Q521 WeakPolarHBondContact O-CG 3.46Å; R517-Q521 PolarHBondContact O-N 3.25Å; K518-Q521 PolarHBondContact O-N 3.46Å; M519-Q521 PolarHBondContact O-N 2.7Å; Q521-F524 PolarHBondContact O-N 3.41Å; Q521-E525 WeakPolarHBondContact O-CB 3.48Å; Q521-E525 WeakPolarHBondContact O-CG 3.16Å; Q521-E525 PolarHBondContact O-N 3.28Å
522	Y	74.7	Confident	77.6	Confident	33 Å²	33	52 Å²	52	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-67.8	-47	178.3	-56.4	-25.8	0	0	0	111.6	P60 P61 T62 Y507 K518 M519 D520 F524 S526	P60-Y522 HydrophobicContact CB-CE1 4.13Å; P60-Y522 HydrophobicContact CB-CE2 4.42Å; P60-Y522 WeakPolarHBondContact CB-OH 3.47Å; P61-Y522 HydrophobicContact CG-CD2 3.33Å; P61-Y522 HydrophobicContact CG-CE2 3.53Å; P61-Y522 HydrophobicContact CG-CG 4.09Å; T62-Y522 HydrophobicContact CG2-CD1 3.05Å; T62-Y522 HydrophobicContact CG2-CE1 3.41Å; T62-Y522 VanDerWaalsContact CG2-CE1 3.41Å; T62-Y522 HydrophobicContact CG2-CG 3.85Å; Y507-Y522 HydrophobicContact CD1-CE2 4.41Å; Y507-Y522 AromaticContact CE1-CE2 3.78Å; Y507-Y522 HydrophobicContact CE1-CE2 3.78Å; K518-Y522 HydrophobicContact CB-CE1 4.39Å; K518-Y522 HydrophobicContact CB-CE2 3.72Å; K518-Y522 WeakPolarHBondContact O-CB 3.49Å; K518-Y522 WeakPolarHBondContact O-CD1 2.93Å; K518-Y522 WeakPolarHBondContact O-CD2 2.98Å; K518-Y522 WeakPolarHBondContact O-CE2 3.33Å; K518-Y522 PolarHBondContact O-N 2.77Å; M519-Y522 WeakPolarHBondContact O-CB 3.34Å; M519-Y522 PolarHBondContact O-N 3.46Å; M519-Y522 VanDerWaalsContact O-N 3.13Å; D520-Y522 PolarHBondContact O-N 3.04Å; Y522-F524 VanDerWaalsContact C-N 3.29Å; Y522-F524 PolarHBondContact O-N 3.07Å; Y522-S526 WeakPolarHBondContact O-CB 3.38Å; Y522-S526 PolarHBondContact O-N 3.28Å; Y522-S526 PolarHBondContact O-OG 3.02Å
523	V	74.8	Confident	76.7	Confident	59 Å²	59	51.6 Å²	51.6	36%	0.358	26%	0.258	S	S	.	.	H	α-helix	trans	-61.6	-41.8	176.2	176.1	0	0	0	0	110.2	M519 D520 S526 L527 I564	M519-V523 WeakPolarHBondContact O-CG2 3.28Å; M519-V523 PolarHBondContact O-N 3.49Å; D520-V523 PolarHBondContact O-N 2.84Å; V523-S526 PolarHBondContact O-N 3.03Å; V523-L527 HydrophobicContact CG1-CD1 3.84Å; V523-L527 WeakPolarHBondContact O-CB 3.49Å; V523-L527 WeakPolarHBondContact O-CG 3.4Å; V523-L527 PolarHBondContact O-N 3.37Å; V523-I564 HydrophobicContact CB-CG2 4.41Å; V523-I564 HydrophobicContact CG1-CD1 4.07Å; V523-I564 HydrophobicContact CG1-CG2 3.98Å
524	F	76.4	Confident	75.9	Confident	36 Å²	36	48.6 Å²	48.6	16%	0.158	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-56.3	177.6	-179.8	-104.9	0	0	0	112.5	D520 Q521 Y522 S526 L527 K528 L561 I564 R565	D520-F524 VanDerWaalsContact O-CB 3.27Å; D520-F524 WeakPolarHBondContact O-CB 3.06Å; D520-F524 PolarHBondContact O-N 3.24Å; Q521-F524 PolarHBondContact O-N 3.41Å; Y522-F524 VanDerWaalsContact C-N 3.29Å; Y522-F524 PolarHBondContact O-N 3.07Å; F524-S526 PolarHBondContact O-N 3.48Å; F524-L527 PolarHBondContact O-N 2.88Å; F524-K528 HydrophobicContact CE1-CD 3.82Å; F524-K528 HydrophobicContact CZ-CD 4.13Å; F524-K528 WeakPolarHBondContact O-CB 3.35Å; F524-K528 PolarHBondContact O-N 3.48Å; F524-L561 HydrophobicContact CD2-CD1 4Å; F524-L561 HydrophobicContact CE2-CD1 3.82Å; F524-L561 HydrophobicContact CE2-CG 4.19Å; F524-I564 HydrophobicContact CB-CG2 3.88Å; F524-I564 HydrophobicContact CD2-CG2 4.26Å; F524-R565 HydrophobicContact CD2-CB 4.23Å; F524-R565 HydrophobicContact CE2-CB 3.84Å; F524-R565 HydrophobicContact CE2-CG 3.95Å; F524-R565 HydrophobicContact CZ-CG 4.22Å
525	E	71.4	Confident	75.2	Confident	91 Å²	91	48.3 Å²	48.3	43%	0.425	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-34	-179.8	-71.1	-60.9	151.4	0	0	111.4	Q521 K528 S529	Q521-E525 WeakPolarHBondContact O-CB 3.48Å; Q521-E525 WeakPolarHBondContact O-CG 3.16Å; Q521-E525 PolarHBondContact O-N 3.28Å; E525-K528 IonicContact OE1-NZ 2.59Å; E525-K528 PolarHBondContact OE1-NZ 2.75Å; E525-K528 VanDerWaalsContact OE1-NZ 3.08Å; E525-K528 IonicContact OE2-NZ 2.95Å; E525-K528 PolarHBondContact OE2-NZ 3.43Å; E525-S529 WeakPolarHBondContact O-CB 3.41Å; E525-S529 PolarHBondContact O-N 3.13Å; E525-S529 PolarHBondContact O-OG 2.88Å
526	S	69	Low	74.2	Confident	20 Å²	20	50.3 Å²	50.3	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-61.2	-55.1	174	-62.7	0	0	0	0	111.4	F65 Y522 V523 F524 K528 S529 I530	F65-S526 VanDerWaalsContact CD1-OG 3.24Å; F65-S526 WeakPolarHBondContact CD1-OG 3.41Å; F65-S526 VanDerWaalsContact CE1-C 3.43Å; F65-S526 WeakPolarHBondContact CE1-O 3.19Å; F65-S526 WeakPolarHBondContact CG-OG 3.42Å; Y522-S526 WeakPolarHBondContact O-CB 3.38Å; Y522-S526 PolarHBondContact O-N 3.28Å; Y522-S526 PolarHBondContact O-OG 3.02Å; V523-S526 PolarHBondContact O-N 3.03Å; F524-S526 PolarHBondContact O-N 3.48Å; S526-K528 VanDerWaalsContact C-N 3.35Å; S526-K528 PolarHBondContact O-N 3.49Å; S526-S529 PolarHBondContact O-N 2.93Å; S526-S529 PolarHBondContact O-OG 2.8Å; S526-I530 PolarHBondContact O-N 3.29Å
527	L	70.4	Confident	72.9	Confident	48 Å²	48	51.8 Å²	51.8	25%	0.251	27%	0.265	S	S	.	.	H	α-helix	trans	-65.7	-37.6	179.9	-73.2	168.8	0	0	0	112.9	V523 F524 S529 I530 F531 L561 I564	V523-L527 HydrophobicContact CG1-CD1 3.84Å; V523-L527 WeakPolarHBondContact O-CB 3.49Å; V523-L527 WeakPolarHBondContact O-CG 3.4Å; V523-L527 PolarHBondContact O-N 3.37Å; F524-L527 PolarHBondContact O-N 2.88Å; L527-S529 VanDerWaalsContact C-N 3.3Å; L527-S529 PolarHBondContact O-N 3.17Å; L527-I530 HydrophobicContact CD2-CD1 4.09Å; L527-I530 PolarHBondContact O-N 2.93Å; L527-F531 VanDerWaalsContact O-CB 3.32Å; L527-F531 WeakPolarHBondContact O-CB 3.4Å; L527-F531 PolarHBondContact O-N 2.78Å; L527-L561 HydrophobicContact CB-CD1 4.11Å; L527-I564 HydrophobicContact CD1-CD1 3.07Å; L527-I564 HydrophobicContact CD1-CG1 4.43Å
528	K	73.2	Confident	71.6	Confident	60 Å²	60	49.5 Å²	49.5	26%	0.261	26%	0.26	S	S	.	.	H	α-helix	trans	-59	-42.4	174	178.3	178.5	161.3	-152.1	0	111.4	F524 E525 S526 F531 Y532 L561	F524-K528 HydrophobicContact CE1-CD 3.82Å; F524-K528 HydrophobicContact CZ-CD 4.13Å; F524-K528 WeakPolarHBondContact O-CB 3.35Å; F524-K528 PolarHBondContact O-N 3.48Å; E525-K528 IonicContact OE1-NZ 2.59Å; E525-K528 PolarHBondContact OE1-NZ 2.75Å; E525-K528 VanDerWaalsContact OE1-NZ 3.08Å; E525-K528 IonicContact OE2-NZ 2.95Å; E525-K528 PolarHBondContact OE2-NZ 3.43Å; S526-K528 VanDerWaalsContact C-N 3.35Å; S526-K528 PolarHBondContact O-N 3.49Å; K528-F531 WeakPolarHBondContact O-CB 2.7Å; K528-F531 PolarHBondContact O-N 2.69Å; K528-Y532 HydrophobicContact CD-CE2 4.23Å; K528-Y532 HydrophobicContact CG-CD2 3.79Å; K528-Y532 HydrophobicContact CG-CE2 3.45Å; K528-Y532 VanDerWaalsContact CG-CE2 3.45Å; K528-Y532 WeakPolarHBondContact O-CD2 3.32Å; K528-Y532 PolarHBondContact O-N 3.01Å; K528-L561 HydrophobicContact CB-CD1 4.21Å
529	S	67.1	Low	70.4	Confident	34 Å²	34	52.1 Å²	52.1	24%	0.238	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-36.3	176.8	72.4	0	0	0	0	112.9	F65 V69 E525 S526 L527 A533	F65-S529 WeakPolarHBondContact CE1-OG 3.37Å; V69-S529 WeakPolarHBondContact CG2-OG 3.29Å; E525-S529 WeakPolarHBondContact O-CB 3.41Å; E525-S529 PolarHBondContact O-N 3.13Å; E525-S529 PolarHBondContact O-OG 2.88Å; S526-S529 PolarHBondContact O-N 2.93Å; S526-S529 PolarHBondContact O-OG 2.8Å; L527-S529 VanDerWaalsContact C-N 3.3Å; L527-S529 PolarHBondContact O-N 3.17Å; S529-A533 VanDerWaalsContact O-CB 3.25Å; S529-A533 WeakPolarHBondContact O-CB 3.44Å; S529-A533 PolarHBondContact O-N 3.47Å
530	I	68.3	Low	69	Low	64 Å²	64	56.2 Å²	56.2	33%	0.328	31%	0.307	S	S	.	.	H	α-helix	trans	-61.8	-47.3	169.4	-64.7	163.4	0	0	0	110.1	F65 S526 L527 Y532 A533 V534	F65-I530 HydrophobicContact CE1-CD1 4.27Å; F65-I530 HydrophobicContact CE1-CG1 4.05Å; F65-I530 HydrophobicContact CE2-CD1 4.45Å; F65-I530 HydrophobicContact CZ-CD1 3.51Å; F65-I530 HydrophobicContact CZ-CG1 3.71Å; S526-I530 PolarHBondContact O-N 3.29Å; L527-I530 HydrophobicContact CD2-CD1 4.09Å; L527-I530 PolarHBondContact O-N 2.93Å; I530-Y532 PolarHBondContact O-N 3.31Å; I530-A533 WeakPolarHBondContact O-CB 3.42Å; I530-A533 PolarHBondContact O-N 2.94Å; I530-V534 HydrophobicContact CG2-CG2 4.1Å; I530-V534 VanDerWaalsContact O-CG2 3.32Å; I530-V534 WeakPolarHBondContact O-CG2 3.46Å; I530-V534 PolarHBondContact O-N 3.48Å
531	F	71.2	Confident	67.5	Low	9 Å²	9	58.4 Å²	58.4	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-56.7	-51.2	-177.8	-175.4	-87.9	0	0	0	110.8	L527 K528 A533 V534 E535 L554 I557 R558 L561	L527-F531 VanDerWaalsContact O-CB 3.32Å; L527-F531 WeakPolarHBondContact O-CB 3.4Å; L527-F531 PolarHBondContact O-N 2.78Å; K528-F531 WeakPolarHBondContact O-CB 2.7Å; K528-F531 PolarHBondContact O-N 2.69Å; F531-A533 PolarHBondContact O-N 3.15Å; F531-V534 PolarHBondContact O-N 3.41Å; F531-E535 VanDerWaalsContact CE1-OE2 3.31Å; F531-E535 WeakPolarHBondContact CE1-OE2 3.12Å; F531-E535 WeakPolarHBondContact O-CB 3.07Å; F531-E535 PolarHBondContact O-N 3.37Å; F531-L554 HydrophobicContact CD2-CD1 3.47Å; F531-L554 VanDerWaalsContact CD2-CD1 3.47Å; F531-L554 HydrophobicContact CD2-CG 4.35Å; F531-L554 HydrophobicContact CE2-CD1 3.29Å; F531-L554 HydrophobicContact CE2-CD2 4.37Å; F531-L554 HydrophobicContact CE2-CG 3.66Å; F531-L554 HydrophobicContact CG-CD1 4.24Å; F531-L554 HydrophobicContact CZ-CD1 3.92Å; F531-L554 HydrophobicContact CZ-CD2 4.24Å; F531-L554 HydrophobicContact CZ-CG 4Å; F531-I557 HydrophobicContact CD2-CG2 4.31Å; F531-R558 HydrophobicContact CE2-CB 4.36Å; F531-L561 HydrophobicContact CB-CD2 4.46Å; F531-L561 HydrophobicContact CG-CD2 4.23Å
532	Y	70.1	Confident	66.2	Low	142 Å²	142	59.4 Å²	59.4	56%	0.557	34%	0.339	S	S	*	.	H	α-helix	trans	-66.7	-35.1	177.3	-73	-57.2	0	0	0	113.5	K528 I530 G536	K528-Y532 HydrophobicContact CD-CE2 4.23Å; K528-Y532 HydrophobicContact CG-CD2 3.79Å; K528-Y532 HydrophobicContact CG-CE2 3.45Å; K528-Y532 VanDerWaalsContact CG-CE2 3.45Å; K528-Y532 WeakPolarHBondContact O-CD2 3.32Å; K528-Y532 PolarHBondContact O-N 3.01Å; I530-Y532 PolarHBondContact O-N 3.31Å; Y532-G536 PolarHBondContact O-N 2.98Å
533	A	65.5	Low	65	Low	31 Å²	31	67.2 Å²	67.2	26%	0.256	37%	0.374	S	S	.	.	H	α-helix	trans	-61.6	-45.3	174.4	0	0	0	0	0	111.6	T73 S529 I530 F531 S537	T73-A533 HydrophobicContact CG2-CB 3.33Å; S529-A533 VanDerWaalsContact O-CB 3.25Å; S529-A533 WeakPolarHBondContact O-CB 3.44Å; S529-A533 PolarHBondContact O-N 3.47Å; I530-A533 WeakPolarHBondContact O-CB 3.42Å; I530-A533 PolarHBondContact O-N 2.94Å; F531-A533 PolarHBondContact O-N 3.15Å; A533-S537 PolarHBondContact O-N 3.32Å; A533-S537 VanDerWaalsContact O-N 3.11Å
534	V	66.7	Low	63.7	Low	24 Å²	24	67.1 Å²	67.1	15%	0.145	38%	0.376	C	S	.	.	H	α-helix	trans	-67.5	-46.3	177.7	173	0	0	0	0	110.8	I530 F531 G536 S537 L538 V549 L554	I530-V534 HydrophobicContact CG2-CG2 4.1Å; I530-V534 VanDerWaalsContact O-CG2 3.32Å; I530-V534 WeakPolarHBondContact O-CG2 3.46Å; I530-V534 PolarHBondContact O-N 3.48Å; F531-V534 PolarHBondContact O-N 3.41Å; V534-G536 VanDerWaalsContact C-N 3.35Å; V534-G536 PolarHBondContact O-N 3.37Å; V534-S537 PolarHBondContact O-N 3.26Å; V534-S537 PolarHBondContact O-OG 3.23Å; V534-L538 PolarHBondContact O-N 2.9Å; V534-L538 VanDerWaalsContact O-N 3.11Å; V534-V549 HydrophobicContact CG1-CB 4.16Å; V534-V549 HydrophobicContact CG1-CG1 3.71Å; V534-V549 HydrophobicContact CG1-CG2 4.13Å; V534-L554 HydrophobicContact CB-CD1 4.2Å; V534-L554 HydrophobicContact CG1-CD1 3.83Å
535	E	70	Confident	62.2	Low	73 Å²	73	77.5 Å²	77.5	34%	0.341	42%	0.415	S	S	.	.	H	α-helix	trans	-61.7	-40.9	178	-172	172.5	-151.8	0	0	112.4	F531 S537 L538 S539 L554	F531-E535 VanDerWaalsContact CE1-OE2 3.31Å; F531-E535 WeakPolarHBondContact CE1-OE2 3.12Å; F531-E535 WeakPolarHBondContact O-CB 3.07Å; F531-E535 PolarHBondContact O-N 3.37Å; E535-S537 PolarHBondContact O-N 2.83Å; E535-L538 WeakPolarHBondContact O-CB 3.33Å; E535-L538 PolarHBondContact O-N 3.27Å; E535-S539 PolarHBondContact O-N 3.2Å; E535-L554 HydrophobicContact CB-CD2 4.07Å; E535-L554 HydrophobicContact CG-CD2 4.38Å
536	G	65.4	Low	61.2	Low	43 Å²	43	79.1 Å²	79.1	44%	0.443	43%	0.431	S	S	.	.	H	α-helix	trans	-62	-41.6	173.8	0	0	0	0	0	112.5	Y532 V534 L538 S539 D540	Y532-G536 PolarHBondContact O-N 2.98Å; V534-G536 VanDerWaalsContact C-N 3.35Å; V534-G536 PolarHBondContact O-N 3.37Å; G536-L538 VanDerWaalsContact C-N 3.3Å; G536-L538 PolarHBondContact O-N 2.95Å; G536-S539 PolarHBondContact O-N 3.4Å; G536-D540 PolarHBondContact O-N 3.41Å
537	S	62.4	Low	60.3	Low	39 Å²	39	84.7 Å²	84.7	27%	0.273	45%	0.453	S	S	.	.	H	α-helix	trans	-65.5	-31	177.9	75.1	0	0	0	0	113.3	A533 V534 E535 D540 S541	A533-S537 PolarHBondContact O-N 3.32Å; A533-S537 VanDerWaalsContact O-N 3.11Å; V534-S537 PolarHBondContact O-N 3.26Å; V534-S537 PolarHBondContact O-OG 3.23Å; E535-S537 PolarHBondContact O-N 2.83Å; S537-D540 PolarHBondContact O-N 2.6Å; S537-S541 WeakPolarHBondContact O-CB 3.2Å; S537-S541 PolarHBondContact O-N 2.81Å
538	L	61.4	Low	59.2	Low	49 Å²	49	91.6 Å²	91.6	26%	0.257	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-40.3	175	-77.5	164.6	0	0	0	112	V534 E535 G536 D540 S541 V549 L554	V534-L538 PolarHBondContact O-N 2.9Å; V534-L538 VanDerWaalsContact O-N 3.11Å; E535-L538 WeakPolarHBondContact O-CB 3.33Å; E535-L538 PolarHBondContact O-N 3.27Å; G536-L538 VanDerWaalsContact C-N 3.3Å; G536-L538 PolarHBondContact O-N 2.95Å; L538-D540 VanDerWaalsContact C-N 3.34Å; L538-D540 PolarHBondContact O-N 3.31Å; L538-S541 PolarHBondContact O-N 2.93Å; L538-S541 PolarHBondContact O-OG 2.9Å; L538-V549 WeakPolarHBondContact CD2-O 3.39Å; L538-L554 HydrophobicContact CD1-CD2 3.6Å
539	S	56.5	Low	58.4	Low	102 Å²	102	89.5 Å²	89.5	71%	0.713	48%	0.476	S	S	*	.	H	α-helix	trans	-67	-33.6	178.6	-71.4	0	0	0	0	112.9	E535 G536	E535-S539 PolarHBondContact O-N 3.2Å; G536-S539 PolarHBondContact O-N 3.4Å
540	D	53.3	Low	58.2	Low	129 Å²	129	91.6 Å²	91.6	69%	0.69	48%	0.484	S	S	*	.	H	α-helix	trans	-88.6	-11	179.7	-112.5	-2.2	0	0	0	113.9	G536 S537 L538 S542 K543	G536-D540 PolarHBondContact O-N 3.41Å; S537-D540 PolarHBondContact O-N 2.6Å; L538-D540 VanDerWaalsContact C-N 3.34Å; L538-D540 PolarHBondContact O-N 3.31Å; D540-S542 PolarHBondContact O-N 3.49Å; D540-K543 PolarHBondContact O-N 2.9Å; D540-K543 VanDerWaalsContact O-N 3.11Å
541	S	50.7	Low	58.1	Low	57 Å²	57	95.1 Å²	95.1	40%	0.399	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-9.8	-177.6	71.6	0	0	0	0	114.7	S537 L538 K543 S544	S537-S541 WeakPolarHBondContact O-CB 3.2Å; S537-S541 PolarHBondContact O-N 2.81Å; L538-S541 PolarHBondContact O-N 2.93Å; L538-S541 PolarHBondContact O-OG 2.9Å; S541-K543 PolarHBondContact O-N 3.44Å; S541-S544 PolarHBondContact O-N 3.47Å
542	S	51.6	Low	57.7	Low	104 Å²	104	99.9 Å²	99.9	73%	0.727	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-13.4	168.7	68.7	0	0	0	0	113.7	D540	D540-S542 PolarHBondContact O-N 3.49Å
543	K	48.9	Very low	57.6	Low	197 Å²	197	98.8 Å²	98.8	86%	0.857	52%	0.523	S	S	*	.	S	Bend	trans	-129.8	3.3	176.5	-73.7	-176.7	179.4	173.6	0	117.3	D540 S541	D540-K543 PolarHBondContact O-N 2.9Å; D540-K543 VanDerWaalsContact O-N 3.11Å; S541-K543 PolarHBondContact O-N 3.44Å
544	S	47.8	Very low	57.5	Low	58 Å²	58	97.7 Å²	97.7	41%	0.406	51%	0.513	S	S	.	.			trans	-124.9	120.8	-175.1	174.9	0	0	0	0	112.5	S541	S541-S544 PolarHBondContact O-N 3.47Å
545	R	46.1	Very low	57.5	Low	254 Å²	254	100.1 Å²	100.1	96%	0.958	53%	0.525	S	S	*	.	S	Bend	trans	-87.4	9.6	-173.2	-79.2	-170.7	-170.7	171	3.5	116
546	T	48.8	Very low	57.2	Low	125 Å²	125	99.8 Å²	99.8	77%	0.767	53%	0.534	S	S	*	.	S	Bend	trans	-116.3	-2.1	-166.4	43.3	0	0	0	0	116.9
547	F	50.9	Low	57.1	Low	136 Å²	136	100.9 Å²	100.9	60%	0.596	53%	0.529	S	S	*	.			trans	-146	91.9	176.6	-157.5	-120.4	0	0	0	110.9	V549	F547-V549 HydrophobicContact CD1-CG2 3.39Å; F547-V549 HydrophobicContact CE1-CG2 3.04Å; F547-V549 HydrophobicContact CG-CG2 4.33Å; F547-V549 HydrophobicContact CZ-CG2 3.75Å; F547-V549 PolarHBondContact O-N 3.15Å
548	H	47.2	Very low	57.3	Low	194 Å²	194	104.3 Å²	104.3	90%	0.898	54%	0.536	S	S	*	.			trans	-82.6	98.4	167.1	-108.6	-76	0	0	0	107.1
549	V	56.6	Low	57.3	Low	16 Å²	16	105.5 Å²	105.5	10%	0.097	55%	0.547	C	S	.	.			trans	-86.1	127.4	158.2	-175.3	0	0	0	0	106.3	V534 L538 F547 E553	V534-V549 HydrophobicContact CG1-CB 4.16Å; V534-V549 HydrophobicContact CG1-CG1 3.71Å; V534-V549 HydrophobicContact CG1-CG2 4.13Å; L538-V549 WeakPolarHBondContact CD2-O 3.39Å; F547-V549 HydrophobicContact CD1-CG2 3.39Å; F547-V549 HydrophobicContact CE1-CG2 3.04Å; F547-V549 HydrophobicContact CG-CG2 4.33Å; F547-V549 HydrophobicContact CZ-CG2 3.75Å; F547-V549 PolarHBondContact O-N 3.15Å; V549-E553 HydrophobicContact CG1-CB 4.42Å
550	D	62.4	Low	57.6	Low	78 Å²	78	103.8 Å²	103.8	42%	0.417	53%	0.532	S	S	.	.			trans	-69.9	133	173.4	-169.3	-6.6	0	0	0	108.3	N552 E553 L554	D550-N552 HydrophobicContact CB-CB 4.49Å; D550-N552 PolarHBondContact O-N 3.47Å; D550-N552 VanDerWaalsContact O-N 3.13Å; D550-N552 PolarHBondContact OD1-N 2.9Å; D550-N552 VanDerWaalsContact OD1-N 3.13Å; D550-N552 PolarHBondContact OD1-ND2 3.23Å; D550-N552 PolarHBondContact OD2-ND2 2.8Å; D550-E553 HydrophobicContact CB-CG 4.18Å; D550-E553 WeakPolarHBondContact O-CB 3.41Å; D550-E553 PolarHBondContact O-N 3.35Å; D550-L554 PolarHBondContact O-N 3.09Å
551	K	66.9	Low	58.2	Low	137 Å²	137	98.8 Å²	98.8	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-55.7	-30.7	173.4	-174	177.7	175.6	179.4	0	110.7	E553 L554 D555	K551-E553 VanDerWaalsContact C-N 3.32Å; K551-E553 PolarHBondContact O-N 3.42Å; K551-L554 PolarHBondContact O-N 3.12Å; K551-D555 WeakPolarHBondContact O-CB 3.18Å; K551-D555 PolarHBondContact O-N 2.93Å
552	N	63.5	Low	58.8	Low	110 Å²	110	99.8 Å²	99.8	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-61.8	-36.6	174.4	-59.7	-33.3	0	0	0	112.9	D550 A556	D550-N552 HydrophobicContact CB-CB 4.49Å; D550-N552 PolarHBondContact O-N 3.47Å; D550-N552 VanDerWaalsContact O-N 3.13Å; D550-N552 PolarHBondContact OD1-N 2.9Å; D550-N552 VanDerWaalsContact OD1-N 3.13Å; D550-N552 PolarHBondContact OD1-ND2 3.23Å; D550-N552 PolarHBondContact OD2-ND2 2.8Å; N552-A556 WeakPolarHBondContact O-CB 3.45Å; N552-A556 PolarHBondContact O-N 3.34Å
553	E	66.5	Low	59.2	Low	119 Å²	119	98.9 Å²	98.9	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-69.3	-38.9	176.3	-71.2	179.6	164.3	0	0	111.1	V549 D550 K551 A556 I557	V549-E553 HydrophobicContact CG1-CB 4.42Å; D550-E553 HydrophobicContact CB-CG 4.18Å; D550-E553 WeakPolarHBondContact O-CB 3.41Å; D550-E553 PolarHBondContact O-N 3.35Å; K551-E553 VanDerWaalsContact C-N 3.32Å; K551-E553 PolarHBondContact O-N 3.42Å; E553-A556 WeakPolarHBondContact O-CB 3.44Å; E553-A556 PolarHBondContact O-N 2.72Å; E553-I557 WeakPolarHBondContact O-CG1 3.33Å; E553-I557 PolarHBondContact O-N 3.35Å
554	L	64.5	Low	60	Low	8 Å²	8	91 Å²	91	4%	0.042	46%	0.459	C	S	.	.	H	α-helix	trans	-67	-44.3	176.6	-173.6	64.3	0	0	0	111.8	F531 V534 E535 L538 D550 K551 A556 I557 R558	F531-L554 HydrophobicContact CD2-CD1 3.47Å; F531-L554 VanDerWaalsContact CD2-CD1 3.47Å; F531-L554 HydrophobicContact CD2-CG 4.35Å; F531-L554 HydrophobicContact CE2-CD1 3.29Å; F531-L554 HydrophobicContact CE2-CD2 4.37Å; F531-L554 HydrophobicContact CE2-CG 3.66Å; F531-L554 HydrophobicContact CG-CD1 4.24Å; F531-L554 HydrophobicContact CZ-CD1 3.92Å; F531-L554 HydrophobicContact CZ-CD2 4.24Å; F531-L554 HydrophobicContact CZ-CG 4Å; V534-L554 HydrophobicContact CB-CD1 4.2Å; V534-L554 HydrophobicContact CG1-CD1 3.83Å; E535-L554 HydrophobicContact CB-CD2 4.07Å; E535-L554 HydrophobicContact CG-CD2 4.38Å; L538-L554 HydrophobicContact CD1-CD2 3.6Å; D550-L554 PolarHBondContact O-N 3.09Å; K551-L554 PolarHBondContact O-N 3.12Å; L554-A556 PolarHBondContact O-N 3.44Å; L554-I557 PolarHBondContact O-N 3.36Å; L554-R558 PolarHBondContact O-N 2.73Å
555	D	65.6	Low	61	Low	75 Å²	75	93.3 Å²	93.3	40%	0.401	46%	0.459	S	S	.	.	H	α-helix	trans	-63.9	-27.8	175.9	-73.6	-26.6	0	0	0	111.3	K551 P559	K551-D555 WeakPolarHBondContact O-CB 3.18Å; K551-D555 PolarHBondContact O-N 2.93Å; D555-P559 WeakPolarHBondContact O-CD 3.48Å
556	A	64.3	Low	62.1	Low	65 Å²	65	82.6 Å²	82.6	54%	0.537	42%	0.419	S	S	.	.	H	α-helix	trans	-72	-25.8	172.4	0	0	0	0	0	113.9	N552 E553 L554	N552-A556 WeakPolarHBondContact O-CB 3.45Å; N552-A556 PolarHBondContact O-N 3.34Å; E553-A556 WeakPolarHBondContact O-CB 3.44Å; E553-A556 PolarHBondContact O-N 2.72Å; L554-A556 PolarHBondContact O-N 3.44Å
557	I	62.8	Low	63.5	Low	67 Å²	67	78.4 Å²	78.4	34%	0.344	39%	0.392	S	S	.	.	H	α-helix	trans	-80.3	-30.9	177.5	-66	166.6	0	0	0	111.4	F531 E553 L554 T560 L561	F531-I557 HydrophobicContact CD2-CG2 4.31Å; E553-I557 WeakPolarHBondContact O-CG1 3.33Å; E553-I557 PolarHBondContact O-N 3.35Å; L554-I557 PolarHBondContact O-N 3.36Å; I557-T560 WeakPolarHBondContact O-CA 3.35Å; I557-T560 VanDerWaalsContact O-CB 3.23Å; I557-T560 WeakPolarHBondContact O-CB 3.34Å; I557-T560 PolarHBondContact O-N 3.31Å; I557-L561 PolarHBondContact O-N 2.9Å
558	R	67.4	Low	65	Low	111 Å²	111	74.9 Å²	74.9	42%	0.419	38%	0.379	S	S	.	.	H	α-helix	trans	-53.6	-45.9	-175.5	-179.5	163.5	-75.1	-174.3	-4.1	114.1	F531 L554 T560 L561 D562	F531-R558 HydrophobicContact CE2-CB 4.36Å; L554-R558 PolarHBondContact O-N 2.73Å; R558-T560 VanDerWaalsContact C-N 3.26Å; R558-T560 PolarHBondContact O-N 2.95Å; R558-L561 WeakPolarHBondContact O-CB 3.36Å; R558-L561 PolarHBondContact O-N 3.47Å; R558-L561 VanDerWaalsContact O-N 3.12Å; R558-D562 PolarHBondContact O-N 3.18Å; R558-D562 VanDerWaalsContact O-N 3.07Å
559	P	61.6	Low	66.8	Low	73 Å²	73	67.1 Å²	67.1	47%	0.474	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-36.4	173.9	-23.5	32.8	0	0	0	113.3	D555 D562 I563	D555-P559 WeakPolarHBondContact O-CD 3.48Å; P559-D562 PolarHBondContact O-N 3.47Å; P559-I563 VanDerWaalsContact O-CG1 3.26Å; P559-I563 WeakPolarHBondContact O-CG1 3.44Å; P559-I563 PolarHBondContact O-N 2.9Å
560	T	63	Low	68.4	Low	67 Å²	67	67.3 Å²	67.3	41%	0.411	35%	0.347	S	S	.	.	H	α-helix	trans	-66	-39.6	177.3	-50.2	0	0	0	0	111.2	I557 R558 D562 I563 I564	I557-T560 WeakPolarHBondContact O-CA 3.35Å; I557-T560 VanDerWaalsContact O-CB 3.23Å; I557-T560 WeakPolarHBondContact O-CB 3.34Å; I557-T560 PolarHBondContact O-N 3.31Å; R558-T560 VanDerWaalsContact C-N 3.26Å; R558-T560 PolarHBondContact O-N 2.95Å; T560-D562 VanDerWaalsContact C-N 3.35Å; T560-I563 PolarHBondContact O-N 3.09Å; T560-I564 HydrophobicContact CG2-CD1 3.88Å; T560-I564 VanDerWaalsContact O-CG1 3.31Å; T560-I564 WeakPolarHBondContact O-CG1 3.21Å; T560-I564 PolarHBondContact O-N 3.29Å
561	L	64.7	Low	69.6	Low	24 Å²	24	63.6 Å²	63.6	13%	0.126	33%	0.328	C	S	.	.	H	α-helix	trans	-64.3	-40.5	175.8	-172.8	66	0	0	0	111.6	F524 L527 K528 F531 I557 R558 I564 R565	F524-L561 HydrophobicContact CD2-CD1 4Å; F524-L561 HydrophobicContact CE2-CD1 3.82Å; F524-L561 HydrophobicContact CE2-CG 4.19Å; L527-L561 HydrophobicContact CB-CD1 4.11Å; K528-L561 HydrophobicContact CB-CD1 4.21Å; F531-L561 HydrophobicContact CB-CD2 4.46Å; F531-L561 HydrophobicContact CG-CD2 4.23Å; I557-L561 PolarHBondContact O-N 2.9Å; R558-L561 WeakPolarHBondContact O-CB 3.36Å; R558-L561 PolarHBondContact O-N 3.47Å; R558-L561 VanDerWaalsContact O-N 3.12Å; L561-I564 PolarHBondContact O-N 3.39Å; L561-R565 PolarHBondContact O-N 2.95Å; L561-R565 VanDerWaalsContact O-N 3.14Å
562	D	62.9	Low	70.7	Confident	77 Å²	77	58.2 Å²	58.2	41%	0.412	31%	0.305	S	S	.	.	H	α-helix	trans	-64.8	-41	175.4	-67.7	-30	0	0	0	111.3	R558 P559 T560 I564 R565 F566	R558-D562 PolarHBondContact O-N 3.18Å; R558-D562 VanDerWaalsContact O-N 3.07Å; P559-D562 PolarHBondContact O-N 3.47Å; T560-D562 VanDerWaalsContact C-N 3.35Å; D562-I564 PolarHBondContact O-N 2.94Å; D562-R565 VanDerWaalsContact O-CB 3.29Å; D562-R565 WeakPolarHBondContact O-CB 3.27Å; D562-R565 PolarHBondContact O-N 3.49Å; D562-F566 WeakPolarHBondContact O-CD2 3.02Å; D562-F566 WeakPolarHBondContact O-CE2 3.47Å; D562-F566 WeakPolarHBondContact O-CZ 3.33Å
563	I	61.9	Low	72	Confident	85 Å²	85	54.3 Å²	54.3	44%	0.436	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-44	176.2	-69.1	164.6	0	0	0	111.9	P559 T560 R565 F566 L568	P559-I563 VanDerWaalsContact O-CG1 3.26Å; P559-I563 WeakPolarHBondContact O-CG1 3.44Å; P559-I563 PolarHBondContact O-N 2.9Å; T560-I563 PolarHBondContact O-N 3.09Å; I563-R565 VanDerWaalsContact C-N 3.25Å; I563-R565 PolarHBondContact O-N 3.2Å; I563-F566 VanDerWaalsContact CA-CD2 3.47Å; I563-F566 VanDerWaalsContact CA-CE2 3.5Å; I563-F566 HydrophobicContact CG1-CE2 4.48Å; I563-F566 WeakPolarHBondContact O-CB 3.42Å; I563-F566 WeakPolarHBondContact O-CD2 3.45Å; I563-F566 WeakPolarHBondContact O-CG 3.4Å; I563-F566 PolarHBondContact O-N 2.94Å; I563-F566 VanDerWaalsContact O-N 3.15Å; I563-L568 HydrophobicContact CG2-CD1 3.67Å
564	I	64.2	Low	73.2	Confident	32 Å²	32	51.4 Å²	51.4	16%	0.164	28%	0.275	C	S	.	.	H	α-helix	trans	-72.1	-25.4	-176.1	-69.3	168.6	0	0	0	111.3	V523 F524 L527 T560 L561 D562 F566 N567	V523-I564 HydrophobicContact CB-CG2 4.41Å; V523-I564 HydrophobicContact CG1-CD1 4.07Å; V523-I564 HydrophobicContact CG1-CG2 3.98Å; F524-I564 HydrophobicContact CB-CG2 3.88Å; F524-I564 HydrophobicContact CD2-CG2 4.26Å; L527-I564 HydrophobicContact CD1-CD1 3.07Å; L527-I564 HydrophobicContact CD1-CG1 4.43Å; T560-I564 HydrophobicContact CG2-CD1 3.88Å; T560-I564 VanDerWaalsContact O-CG1 3.31Å; T560-I564 WeakPolarHBondContact O-CG1 3.21Å; T560-I564 PolarHBondContact O-N 3.29Å; L561-I564 PolarHBondContact O-N 3.39Å; D562-I564 PolarHBondContact O-N 2.94Å; I564-F566 PolarHBondContact O-N 3.28Å; I564-F566 VanDerWaalsContact O-N 3.07Å; I564-N567 PolarHBondContact O-N 2.68Å; I564-N567 VanDerWaalsContact O-N 3.13Å
565	R	69	Low	74.4	Confident	107 Å²	107	54.3 Å²	54.3	40%	0.404	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.5	171.9	-162.1	173.6	179.9	-167.3	-14.2	113.2	F524 L561 D562 I563 N567 E589	F524-R565 HydrophobicContact CD2-CB 4.23Å; F524-R565 HydrophobicContact CE2-CB 3.84Å; F524-R565 HydrophobicContact CE2-CG 3.95Å; F524-R565 HydrophobicContact CZ-CG 4.22Å; L561-R565 PolarHBondContact O-N 2.95Å; L561-R565 VanDerWaalsContact O-N 3.14Å; D562-R565 VanDerWaalsContact O-CB 3.29Å; D562-R565 WeakPolarHBondContact O-CB 3.27Å; D562-R565 PolarHBondContact O-N 3.49Å; I563-R565 VanDerWaalsContact C-N 3.25Å; I563-R565 PolarHBondContact O-N 3.2Å; R565-N567 VanDerWaalsContact C-N 3.27Å; R565-N567 PolarHBondContact O-N 3.47Å; R565-E589 IonicContact CZ-OE1 2.67Å; R565-E589 IonicContact CZ-OE2 3.22Å; R565-E589 IonicContact NE-OE2 3.32Å; R565-E589 PolarHBondContact NE-OE2 3.3Å; R565-E589 IonicContact NH1-OE1 3.84Å; R565-E589 IonicContact NH1-OE2 2.63Å; R565-E589 PolarHBondContact NH1-OE2 3.03Å; R565-E589 VanDerWaalsContact NH1-OE2 3.11Å; R565-E589 VanDerWaalsContact NH2-CD 3.26Å; R565-E589 IonicContact NH2-OE1 3.33Å; R565-E589 PolarHBondContact NH2-OE1 2.82Å; R565-E589 IonicContact NH2-OE2 3.41Å; R565-E589 PolarHBondContact NH2-OE2 2.66Å
566	F	69	Low	75.6	Confident	28 Å²	28	50.8 Å²	50.8	12%	0.123	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-2.5	178.4	-53.3	-45.2	0	0	0	114.4	D562 I563 I564 L568 F590	D562-F566 WeakPolarHBondContact O-CD2 3.02Å; D562-F566 WeakPolarHBondContact O-CE2 3.47Å; D562-F566 WeakPolarHBondContact O-CZ 3.33Å; I563-F566 VanDerWaalsContact CA-CD2 3.47Å; I563-F566 VanDerWaalsContact CA-CE2 3.5Å; I563-F566 HydrophobicContact CG1-CE2 4.48Å; I563-F566 WeakPolarHBondContact O-CB 3.42Å; I563-F566 WeakPolarHBondContact O-CD2 3.45Å; I563-F566 WeakPolarHBondContact O-CG 3.4Å; I563-F566 PolarHBondContact O-N 2.94Å; I563-F566 VanDerWaalsContact O-N 3.15Å; I564-F566 PolarHBondContact O-N 3.28Å; I564-F566 VanDerWaalsContact O-N 3.07Å; F566-L568 HydrophobicContact CB-CD2 4.3Å; F566-L568 HydrophobicContact CB-CG 4.4Å; F566-L568 PolarHBondContact O-N 3.27Å; F566-F590 HydrophobicContact CD1-CB 4.18Å; F566-F590 HydrophobicContact CD1-CD2 4.4Å; F566-F590 HydrophobicContact CD2-CD2 4.02Å; F566-F590 HydrophobicContact CD2-CE2 4.5Å; F566-F590 HydrophobicContact CE1-CB 3.77Å; F566-F590 AromaticContact CE1-CD2 3.96Å; F566-F590 HydrophobicContact CE1-CD2 3.96Å; F566-F590 HydrophobicContact CE1-CG 4.37Å; F566-F590 AromaticContact CE2-CD2 3.52Å; F566-F590 HydrophobicContact CE2-CD2 3.52Å; F566-F590 HydrophobicContact CE2-CE2 4.06Å; F566-F590 HydrophobicContact CG-CD2 4.47Å; F566-F590 HydrophobicContact CZ-CB 4.17Å; F566-F590 AromaticContact CZ-CD2 3.53Å; F566-F590 HydrophobicContact CZ-CD2 3.53Å; F566-F590 HydrophobicContact CZ-CE2 4.44Å; F566-F590 HydrophobicContact CZ-CG 4.34Å
567	N	79.2	Confident	76.7	Confident	37 Å²	37	52.2 Å²	52.2	20%	0.198	26%	0.262	C	S	.	.			trans	48.5	55.6	-177.8	-55.3	-45	0	0	0	112	D520 I564 R565 S569 D570 A571	D520-N567 HydrophobicContact CB-CB 3.9Å; D520-N567 WeakPolarHBondContact CB-OD1 3.3Å; D520-N567 WeakPolarHBondContact OD2-CA 3.18Å; D520-N567 WeakPolarHBondContact OD2-CB 3.16Å; D520-N567 VanDerWaalsContact OD2-O 3.1Å; I564-N567 PolarHBondContact O-N 2.68Å; I564-N567 VanDerWaalsContact O-N 3.13Å; R565-N567 VanDerWaalsContact C-N 3.27Å; R565-N567 PolarHBondContact O-N 3.47Å; N567-S569 VanDerWaalsContact C-N 3.26Å; N567-S569 PolarHBondContact O-N 3.32Å; N567-D570 HydrophobicContact CB-CB 4.09Å; N567-D570 WeakPolarHBondContact O-CB 3.49Å; N567-D570 PolarHBondContact O-N 3.39Å; N567-D570 VanDerWaalsContact O-N 3.12Å; N567-A571 WeakPolarHBondContact O-CB 3.42Å; N567-A571 PolarHBondContact O-N 3.47Å
568	L	82.1	Confident	77.9	Confident	62 Å²	62	56 Å²	56	33%	0.325	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-34.2	-172.2	-71.6	173.9	0	0	0	113.2	D520 I563 F566 D570 I572	D520-L568 PolarHBondContact OD2-N 3.28Å; I563-L568 HydrophobicContact CG2-CD1 3.67Å; F566-L568 HydrophobicContact CB-CD2 4.3Å; F566-L568 HydrophobicContact CB-CG 4.4Å; F566-L568 PolarHBondContact O-N 3.27Å; L568-D570 VanDerWaalsContact C-N 3.34Å; L568-I572 VanDerWaalsContact O-CB 3.3Å; L568-I572 WeakPolarHBondContact O-CB 3.25Å; L568-I572 VanDerWaalsContact O-CG1 3.27Å; L568-I572 WeakPolarHBondContact O-CG1 3.29Å; L568-I572 PolarHBondContact O-N 2.84Å
569	S	85.7	Confident	78.7	Confident	31 Å²	31	53.9 Å²	53.9	22%	0.217	28%	0.278	C	S	.	.	H	α-helix	trans	-66.2	-42.2	177.8	-43.7	0	0	0	0	110.1	P516 D520 N567 L573	P516-S569 WeakPolarHBondContact CB-O 3.34Å; D520-S569 WeakPolarHBondContact OD1-CB 3.35Å; D520-S569 PolarHBondContact OD1-N 3.44Å; D520-S569 PolarHBondContact OD1-OG 2.94Å; D520-S569 WeakPolarHBondContact OD2-CA 3.35Å; D520-S569 VanDerWaalsContact OD2-CB 3.29Å; D520-S569 WeakPolarHBondContact OD2-CB 3.28Å; D520-S569 PolarHBondContact OD2-N 3.09Å; N567-S569 VanDerWaalsContact C-N 3.26Å; N567-S569 PolarHBondContact O-N 3.32Å; S569-L573 WeakPolarHBondContact O-CB 3.49Å; S569-L573 WeakPolarHBondContact O-CG 3.43Å; S569-L573 PolarHBondContact O-N 3.44Å
570	D	89.3	Confident	79.6	Confident	20 Å²	20	51.6 Å²	51.6	11%	0.107	26%	0.263	C	S	.	.	H	α-helix	trans	-67.2	-46.3	174.5	-167.6	44	0	0	0	112.9	R517 D520 N567 L568 I572 T574 R575	R517-D570 HydrophobicContact CB-CB 3.89Å; R517-D570 HydrophobicContact CG-CB 4.32Å; D520-D570 PolarHBondContact OD2-N 2.89Å; N567-D570 HydrophobicContact CB-CB 4.09Å; N567-D570 WeakPolarHBondContact O-CB 3.49Å; N567-D570 PolarHBondContact O-N 3.39Å; N567-D570 VanDerWaalsContact O-N 3.12Å; L568-D570 VanDerWaalsContact C-N 3.34Å; D570-I572 PolarHBondContact O-N 3.34Å; D570-T574 WeakPolarHBondContact O-CA 3.41Å; D570-T574 WeakPolarHBondContact O-CB 3.45Å; D570-T574 PolarHBondContact O-N 3.45Å; D570-T574 PolarHBondContact O-OG1 2.95Å; D570-T574 VanDerWaalsContact OD1-CB 3.25Å; D570-T574 WeakPolarHBondContact OD1-CB 3.39Å; D570-T574 PolarHBondContact OD1-OG1 3Å; D570-R575 PolarHBondContact O-N 3.23Å
571	A	87.3	Confident	80.3	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-55.8	-53.4	178.3	0	0	0	0	0	110	N567 R575 C576 A584 I585	N567-A571 WeakPolarHBondContact O-CB 3.42Å; N567-A571 PolarHBondContact O-N 3.47Å; A571-R575 PolarHBondContact O-N 3.06Å; A571-C576 WeakPolarHBondContact O-CB 3.36Å; A571-C576 PolarHBondContact O-N 3.27Å; A571-C576 PolarHBondContact O-SG 3.06Å; A571-A584 HydrophobicContact CB-CB 4.22Å; A571-A584 VanDerWaalsContact CB-O 3.32Å; A571-A584 WeakPolarHBondContact CB-O 3.3Å; A571-I585 HydrophobicContact CB-CG2 4.18Å
572	I	90	Very high	80.8	Confident	23 Å²	23	48.5 Å²	48.5	12%	0.118	24%	0.243	C	C	.	.	H	α-helix	trans	-77.6	-48.2	-173.9	-61.5	170.5	0	0	0	111.9	F192 L568 D570 C576 L761 R762 A765	F192-I572 HydrophobicContact CE2-CD1 4.46Å; F192-I572 HydrophobicContact CZ-CD1 4.38Å; L568-I572 VanDerWaalsContact O-CB 3.3Å; L568-I572 WeakPolarHBondContact O-CB 3.25Å; L568-I572 VanDerWaalsContact O-CG1 3.27Å; L568-I572 WeakPolarHBondContact O-CG1 3.29Å; L568-I572 PolarHBondContact O-N 2.84Å; D570-I572 PolarHBondContact O-N 3.34Å; I572-C576 WeakPolarHBondContact O-CB 3.39Å; I572-L761 HydrophobicContact CD1-CD2 4.32Å; I572-L761 HydrophobicContact CG1-CD2 4.13Å; I572-L761 HydrophobicContact CG2-CD2 4.49Å; I572-L761 HydrophobicContact CG2-CG 4.18Å; I572-R762 WeakPolarHBondContact O-CB 3.39Å; I572-R762 WeakPolarHBondContact O-CG 3.42Å; I572-A765 HydrophobicContact CG2-CB 3.5Å
573	L	91.5	Very high	81.4	Confident	29 Å²	29	48.4 Å²	48.4	15%	0.152	24%	0.24	C	C	.	.	H	α-helix	trans	-82.9	-29.9	-172.3	-62	171.9	0	0	0	113.3	L508 P516 S569 A765 K766 V769	L508-L573 HydrophobicContact CB-CD1 4.49Å; L508-L573 HydrophobicContact CD2-CD1 3.89Å; P516-L573 HydrophobicContact CB-CB 4.41Å; P516-L573 HydrophobicContact CB-CD1 4.42Å; P516-L573 HydrophobicContact CG-CB 4.12Å; P516-L573 HydrophobicContact CG-CD1 4.27Å; S569-L573 WeakPolarHBondContact O-CB 3.49Å; S569-L573 WeakPolarHBondContact O-CG 3.43Å; S569-L573 PolarHBondContact O-N 3.44Å; L573-A765 HydrophobicContact CD2-CB 3.88Å; L573-K766 HydrophobicContact CD2-CB 4.37Å; L573-V769 HydrophobicContact CD1-CG2 4.18Å; L573-V769 HydrophobicContact CD2-CG2 4.27Å
574	T	90.6	Very high	82.3	Confident	58 Å²	58	44.4 Å²	44.4	36%	0.356	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-61.9	-175.9	-39.1	0	0	0	0	111.9	D570 E577	D570-T574 WeakPolarHBondContact O-CA 3.41Å; D570-T574 WeakPolarHBondContact O-CB 3.45Å; D570-T574 PolarHBondContact O-N 3.45Å; D570-T574 PolarHBondContact O-OG1 2.95Å; D570-T574 VanDerWaalsContact OD1-CB 3.25Å; D570-T574 WeakPolarHBondContact OD1-CB 3.39Å; D570-T574 PolarHBondContact OD1-OG1 3Å; T574-E577 WeakPolarHBondContact O-CB 3.39Å; T574-E577 PolarHBondContact O-N 3Å
575	R	90.2	Very high	82.7	Confident	69 Å²	69	43 Å²	43	26%	0.26	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-74.1	-39	-165.8	-63.1	-179.3	67.3	-165.7	0.1	112.8	D570 A571 E577 N578 E579 E583 A584	D570-R575 PolarHBondContact O-N 3.23Å; A571-R575 PolarHBondContact O-N 3.06Å; R575-E577 PolarHBondContact O-N 3.2Å; R575-N578 PolarHBondContact O-N 2.97Å; R575-E579 IonicContact CZ-OE2 2.66Å; R575-E579 IonicContact NE-OE1 3.25Å; R575-E579 IonicContact NE-OE2 3.14Å; R575-E579 PolarHBondContact NE-OE2 3.35Å; R575-E579 IonicContact NH2-OE2 3.48Å; R575-E579 PolarHBondContact NH2-OE2 2.84Å; R575-E579 WeakPolarHBondContact O-CB 3.3Å; R575-E579 PolarHBondContact O-N 3.28Å; R575-E583 PolarHBondContact NH1-O 2.79Å; R575-E583 VanDerWaalsContact NH1-O 3.12Å; R575-E583 PolarHBondContact NH2-O 3.2Å; R575-A584 HydrophobicContact CB-CB 3.82Å; R575-A584 PolarHBondContact NH1-O 2.9Å
576	C	91.1	Very high	82.3	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.007	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-61.5	0	176.7	-78.3	0	0	0	0	115.6	A571 I572 C758 R762	A571-C576 WeakPolarHBondContact O-CB 3.36Å; A571-C576 PolarHBondContact O-N 3.27Å; A571-C576 PolarHBondContact O-SG 3.06Å; I572-C576 WeakPolarHBondContact O-CB 3.39Å; C576-C758 HydrophobicContact CB-CB 3.44Å; C576-C758 VanDerWaalsContact CB-CB 3.44Å; C576-C758 WeakPolarHBondContact CB-SG 3.32Å; C576-C758 WeakPolarHBondContact SG-CB 3.35Å; C576-C758 CovalentContact SG-SG 2.01Å; C576-C758 PolarHBondContact SG-SG 3.28Å; C576-R762 HydrophobicContact CB-CB 4.07Å
577	E	88.4	Confident	81.6	Confident	95 Å²	95	41.4 Å²	41.4	44%	0.444	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-71.5	-39.8	168	-176.3	157	-120.4	0	0	112.4	T574 R575 R762	T574-E577 WeakPolarHBondContact O-CB 3.39Å; T574-E577 PolarHBondContact O-N 3Å; R575-E577 PolarHBondContact O-N 3.2Å; E577-R762 VanDerWaalsContact CD-NH1 3.33Å; E577-R762 IonicContact OE1-CZ 3.16Å; E577-R762 IonicContact OE1-NH1 3.04Å; E577-R762 PolarHBondContact OE1-NH1 3.1Å; E577-R762 IonicContact OE1-NH2 2.77Å; E577-R762 PolarHBondContact OE1-NH2 2.9Å; E577-R762 IonicContact OE2-NH1 2.76Å
578	N	86.3	Confident	80.2	Confident	146 Å²	146	41.5 Å²	41.5	78%	0.781	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128	-9.2	-173.9	-59	-54.9	0	0	0	113.5	R575	R575-N578 PolarHBondContact O-N 2.97Å
579	E	85.4	Confident	78.9	Confident	67 Å²	67	42.6 Å²	42.6	31%	0.313	23%	0.231	S	C	.	.	S	Bend	trans	-114.4	145.1	-176.3	-61	178.1	-162.4	0	0	111.5	R575	R575-E579 IonicContact CZ-OE2 2.66Å; R575-E579 IonicContact NE-OE1 3.25Å; R575-E579 IonicContact NE-OE2 3.14Å; R575-E579 PolarHBondContact NE-OE2 3.35Å; R575-E579 IonicContact NH2-OE2 3.48Å; R575-E579 PolarHBondContact NH2-OE2 2.84Å; R575-E579 WeakPolarHBondContact O-CB 3.3Å; R575-E579 PolarHBondContact O-N 3.28Å
580	P	80.5	Confident	77.5	Confident	24 Å²	24	42.9 Å²	42.9	16%	0.156	23%	0.229	C	C	.	.			trans	-59.8	155.1	168.6	-21.4	32.4	0	0	0	112.4	V582 E583 A584 H754	P580-V582 VanDerWaalsContact C-N 3.29Å; P580-V582 PolarHBondContact O-N 3.14Å; P580-E583 PolarHBondContact O-N 2.94Å; P580-E583 VanDerWaalsContact O-N 3.11Å; P580-A584 WeakPolarHBondContact O-CB 3.14Å; P580-A584 PolarHBondContact O-N 3.45Å; P580-H754 WeakPolarHBondContact CB-O 3.45Å; P580-H754 WeakPolarHBondContact CG-O 3.27Å
581	F	78.2	Confident	75.8	Confident	21 Å²	21	42.6 Å²	42.6	9%	0.092	23%	0.228	C	C	.	.	H	α-helix	trans	-56.1	-44.2	-176.1	-176.4	-107	0	0	0	112.6	M199 F388 E583 A584 I585 I756 C758 L761	M199-F581 HydrophobicContact SD-CB 4.35Å; M199-F581 HydrophobicContact SD-CD2 4.36Å; M199-F581 HydrophobicContact SD-CG 4.27Å; F388-F581 HydrophobicContact CD1-CE1 4.33Å; F388-F581 AromaticContact CE1-CD1 3.48Å; F388-F581 HydrophobicContact CE1-CD1 3.48Å; F388-F581 VanDerWaalsContact CE1-CD1 3.48Å; F388-F581 AromaticContact CE1-CE1 3.17Å; F388-F581 HydrophobicContact CE1-CE1 3.17Å; F388-F581 HydrophobicContact CE1-CZ 4.26Å; F388-F581 AromaticContact CZ-CD1 3.71Å; F388-F581 HydrophobicContact CZ-CD1 3.71Å; F388-F581 AromaticContact CZ-CE1 3.52Å; F388-F581 HydrophobicContact CZ-CE1 3.52Å; F581-E583 VanDerWaalsContact C-N 3.33Å; F581-E583 PolarHBondContact O-N 3.25Å; F581-A584 PolarHBondContact O-N 3.41Å; F581-I585 HydrophobicContact CD1-CD1 3.8Å; F581-I585 HydrophobicContact CD1-CG2 4.3Å; F581-I585 HydrophobicContact CD2-CG2 4.05Å; F581-I585 HydrophobicContact CE1-CD1 3.39Å; F581-I585 HydrophobicContact CE1-CG1 4.37Å; F581-I585 HydrophobicContact CE1-CG2 3.81Å; F581-I585 HydrophobicContact CE2-CG2 3.58Å; F581-I585 HydrophobicContact CG-CG2 4.42Å; F581-I585 HydrophobicContact CZ-CD1 4.09Å; F581-I585 HydrophobicContact CZ-CG2 3.46Å; F581-I585 VanDerWaalsContact CZ-CG2 3.46Å; F581-I585 WeakPolarHBondContact O-CG1 3.47Å; F581-I585 WeakPolarHBondContact O-CG2 3.28Å; F581-I585 PolarHBondContact O-N 2.94Å; F581-I756 PolarHBondContact N-O 3.36Å; F581-C758 HydrophobicContact CB-CB 3.97Å; F581-C758 HydrophobicContact CD2-CB 4.35Å; F581-C758 VanDerWaalsContact CD2-SG 3.56Å; F581-L761 HydrophobicContact CD2-CD2 4.14Å; F581-L761 HydrophobicContact CE2-CD2 3.81Å
582	V	74.3	Confident	74.5	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-38.6	-178.3	176.9	0	0	0	0	111.4	P580 S586 I750 W753	P580-V582 VanDerWaalsContact C-N 3.29Å; P580-V582 PolarHBondContact O-N 3.14Å; V582-S586 WeakPolarHBondContact O-CA 3.41Å; V582-S586 WeakPolarHBondContact O-CB 3.39Å; V582-S586 PolarHBondContact O-N 3.3Å; V582-I750 HydrophobicContact CG1-CG2 3.86Å; V582-W753 HydrophobicContact CB-CB 4.41Å; V582-W753 HydrophobicContact CG2-CB 3.49Å; V582-W753 VanDerWaalsContact CG2-CB 3.49Å; V582-W753 HydrophobicContact CG2-CD2 4.43Å; V582-W753 HydrophobicContact CG2-CE3 3.93Å; V582-W753 HydrophobicContact CG2-CG 4.35Å
583	E	76.3	Confident	73	Confident	75 Å²	75	48.4 Å²	48.4	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-69.8	-39.8	176.2	-61.3	-167.3	163.8	0	0	111.5	R575 P580 F581 I585 S586 H754	R575-E583 PolarHBondContact NH1-O 2.79Å; R575-E583 VanDerWaalsContact NH1-O 3.12Å; R575-E583 PolarHBondContact NH2-O 3.2Å; P580-E583 PolarHBondContact O-N 2.94Å; P580-E583 VanDerWaalsContact O-N 3.11Å; F581-E583 VanDerWaalsContact C-N 3.33Å; F581-E583 PolarHBondContact O-N 3.25Å; E583-I585 PolarHBondContact O-N 3.18Å; E583-S586 PolarHBondContact O-N 3.37Å; E583-H754 IonicContact OE1-CE1 3.65Å; E583-H754 PolarHBondContact OE1-CE1 3.3Å; E583-H754 IonicContact OE1-ND1 2.69Å; E583-H754 PolarHBondContact OE1-ND1 3.01Å; E583-H754 IonicContact OE2-CE1 3.38Å
584	A	79.9	Confident	71.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-40.4	178.8	0	0	0	0	0	112.7	A571 R575 P580 F581	A571-A584 HydrophobicContact CB-CB 4.22Å; A571-A584 VanDerWaalsContact CB-O 3.32Å; A571-A584 WeakPolarHBondContact CB-O 3.3Å; R575-A584 HydrophobicContact CB-CB 3.82Å; R575-A584 PolarHBondContact NH1-O 2.9Å; P580-A584 WeakPolarHBondContact O-CB 3.14Å; P580-A584 PolarHBondContact O-N 3.45Å; F581-A584 PolarHBondContact O-N 3.41Å
585	I	73.4	Confident	70	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-89.8	-27.1	177.6	74.3	-175.8	0	0	0	113.4	F388 A571 F581 E583 T587 F590	F388-I585 HydrophobicContact CZ-CD1 4.13Å; A571-I585 HydrophobicContact CB-CG2 4.18Å; F581-I585 HydrophobicContact CD1-CD1 3.8Å; F581-I585 HydrophobicContact CD1-CG2 4.3Å; F581-I585 HydrophobicContact CD2-CG2 4.05Å; F581-I585 HydrophobicContact CE1-CD1 3.39Å; F581-I585 HydrophobicContact CE1-CG1 4.37Å; F581-I585 HydrophobicContact CE1-CG2 3.81Å; F581-I585 HydrophobicContact CE2-CG2 3.58Å; F581-I585 HydrophobicContact CG-CG2 4.42Å; F581-I585 HydrophobicContact CZ-CD1 4.09Å; F581-I585 HydrophobicContact CZ-CG2 3.46Å; F581-I585 VanDerWaalsContact CZ-CG2 3.46Å; F581-I585 WeakPolarHBondContact O-CG1 3.47Å; F581-I585 WeakPolarHBondContact O-CG2 3.28Å; F581-I585 PolarHBondContact O-N 2.94Å; E583-I585 PolarHBondContact O-N 3.18Å; I585-T587 PolarHBondContact O-N 3.29Å; I585-F590 HydrophobicContact CD1-CD1 3.65Å; I585-F590 HydrophobicContact CD1-CE1 3.73Å; I585-F590 HydrophobicContact CD1-CG 4.31Å; I585-F590 HydrophobicContact CD1-CZ 4.44Å; I585-F590 HydrophobicContact CG1-CD1 4.4Å
586	S	59.3	Low	68.9	Low	26 Å²	26	46.1 Å²	46.1	18%	0.182	27%	0.265	C	S	.	.			trans	-80.3	96.5	-168.8	-175.9	0	0	0	0	110	V582 E583 G588	V582-S586 WeakPolarHBondContact O-CA 3.41Å; V582-S586 WeakPolarHBondContact O-CB 3.39Å; V582-S586 PolarHBondContact O-N 3.3Å; E583-S586 PolarHBondContact O-N 3.37Å; S586-G588 PolarHBondContact O-N 3.35Å; S586-G588 WeakPolarHBondContact OG-CA 3.13Å; S586-G588 PolarHBondContact OG-N 3.07Å
587	T	55.1	Low	67.7	Low	75 Å²	75	52.1 Å²	52.1	46%	0.46	29%	0.293	S	S	.	.	S	Bend	trans	-78.1	20.1	150.4	50.2	0	0	0	0	111.7	I585 E589	I585-T587 PolarHBondContact O-N 3.29Å; T587-E589 PolarHBondContact O-N 3.48Å
588	G	49.4	Very low	66.6	Low	39 Å²	39	48.7 Å²	48.7	40%	0.402	28%	0.281	S	S	.	.	S	Bend	trans	80.1	-23.2	-177.9	0	0	0	0	0	114.9	S586	S586-G588 PolarHBondContact O-N 3.35Å; S586-G588 WeakPolarHBondContact OG-CA 3.13Å; S586-G588 PolarHBondContact OG-N 3.07Å
589	E	55.7	Low	66.1	Low	85 Å²	85	41.9 Å²	41.9	40%	0.397	25%	0.245	S	C	.	.	S	Bend	trans	-83.8	-31.5	-173.7	-71.4	-179.9	163.1	0	0	114.1	R565 T587 V591 S592 P593	R565-E589 IonicContact CZ-OE1 2.67Å; R565-E589 IonicContact CZ-OE2 3.22Å; R565-E589 IonicContact NE-OE2 3.32Å; R565-E589 PolarHBondContact NE-OE2 3.3Å; R565-E589 IonicContact NH1-OE1 3.84Å; R565-E589 IonicContact NH1-OE2 2.63Å; R565-E589 PolarHBondContact NH1-OE2 3.03Å; R565-E589 VanDerWaalsContact NH1-OE2 3.11Å; R565-E589 VanDerWaalsContact NH2-CD 3.26Å; R565-E589 IonicContact NH2-OE1 3.33Å; R565-E589 PolarHBondContact NH2-OE1 2.82Å; R565-E589 IonicContact NH2-OE2 3.41Å; R565-E589 PolarHBondContact NH2-OE2 2.66Å; T587-E589 PolarHBondContact O-N 3.48Å; E589-V591 VanDerWaalsContact C-N 3.33Å; E589-V591 PolarHBondContact O-N 2.63Å; E589-S592 PolarHBondContact O-N 2.98Å; E589-P593 WeakPolarHBondContact O-CD 3.32Å
590	F	56	Low	65.7	Low	36 Å²	36	41.3 Å²	41.3	16%	0.158	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-41.3	-174.8	179.4	-104.4	0	0	0	113.5	F388 I391 F566 I585	F388-F590 AromaticContact CE2-CE1 3.9Å; F388-F590 HydrophobicContact CE2-CE1 3.9Å; F388-F590 HydrophobicContact CZ-CE1 4.18Å; I391-F590 HydrophobicContact CD1-CE2 3.79Å; I391-F590 HydrophobicContact CD1-CZ 3.5Å; I391-F590 VanDerWaalsContact CD1-CZ 3.5Å; F566-F590 HydrophobicContact CD1-CB 4.18Å; F566-F590 HydrophobicContact CD1-CD2 4.4Å; F566-F590 HydrophobicContact CD2-CD2 4.02Å; F566-F590 HydrophobicContact CD2-CE2 4.5Å; F566-F590 HydrophobicContact CE1-CB 3.77Å; F566-F590 AromaticContact CE1-CD2 3.96Å; F566-F590 HydrophobicContact CE1-CD2 3.96Å; F566-F590 HydrophobicContact CE1-CG 4.37Å; F566-F590 AromaticContact CE2-CD2 3.52Å; F566-F590 HydrophobicContact CE2-CD2 3.52Å; F566-F590 HydrophobicContact CE2-CE2 4.06Å; F566-F590 HydrophobicContact CG-CD2 4.47Å; F566-F590 HydrophobicContact CZ-CB 4.17Å; F566-F590 AromaticContact CZ-CD2 3.53Å; F566-F590 HydrophobicContact CZ-CD2 3.53Å; F566-F590 HydrophobicContact CZ-CE2 4.44Å; F566-F590 HydrophobicContact CZ-CG 4.34Å; I585-F590 HydrophobicContact CD1-CD1 3.65Å; I585-F590 HydrophobicContact CD1-CE1 3.73Å; I585-F590 HydrophobicContact CD1-CG 4.31Å; I585-F590 HydrophobicContact CD1-CZ 4.44Å; I585-F590 HydrophobicContact CG1-CD1 4.4Å
591	V	53.9	Low	65.6	Low	14 Å²	14	42.4 Å²	42.4	9%	0.085	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-19.1	-174.2	-174.6	0	0	0	0	111.9	L384 E589 L595 I750	L384-V591 HydrophobicContact CD1-CG1 4.37Å; E589-V591 VanDerWaalsContact C-N 3.33Å; E589-V591 PolarHBondContact O-N 2.63Å; V591-L595 HydrophobicContact CG1-CB 4.01Å; V591-L595 HydrophobicContact CG1-CD2 3.88Å; V591-L595 WeakPolarHBondContact O-CB 3.46Å; V591-L595 PolarHBondContact O-N 3.45Å; V591-L595 VanDerWaalsContact O-N 3.08Å; V591-I750 HydrophobicContact CB-CG1 4.33Å; V591-I750 HydrophobicContact CG1-CG1 4.26Å; V591-I750 HydrophobicContact CG2-CG1 4.14Å
592	S	58.9	Low	65.4	Low	46 Å²	46	42.6 Å²	42.6	32%	0.322	26%	0.261	S	S	.	.	H	α-helix	trans	-63.1	-51.4	-168.6	-174.8	0	0	0	0	114.3	E589 V594 S596 Q746	E589-S592 PolarHBondContact O-N 2.98Å; S592-V594 VanDerWaalsContact C-N 3.33Å; S592-V594 PolarHBondContact O-N 3Å; S592-S596 WeakPolarHBondContact O-CB 3.48Å; S592-S596 PolarHBondContact O-N 3.35Å; S592-Q746 PolarHBondContact OG-NE2 2.63Å
593	P	58.3	Low	65.8	Low	100 Å²	100	42.4 Å²	42.4	65%	0.649	26%	0.26	S	S	*	.	H	α-helix	trans	-64.2	-37.6	-177	-20.1	32.2	0	0	0	113.2	E589	E589-P593 WeakPolarHBondContact O-CD 3.32Å
594	V	56.5	Low	66.2	Low	38 Å²	38	42 Å²	42	23%	0.23	26%	0.258	C	S	.	.	H	α-helix	trans	-73.2	-44.8	-174.8	175.6	0	0	0	0	110.9	L384 V387 S592 S596	L384-V594 HydrophobicContact CD1-CG1 4.31Å; V387-V594 HydrophobicContact CB-CG1 4.21Å; V387-V594 HydrophobicContact CB-CG2 4.34Å; V387-V594 HydrophobicContact CG1-CG2 3.98Å; V387-V594 HydrophobicContact CG2-CB 4.19Å; V387-V594 HydrophobicContact CG2-CG1 3.37Å; V387-V594 HydrophobicContact CG2-CG2 3.75Å; S592-V594 VanDerWaalsContact C-N 3.33Å; S592-V594 PolarHBondContact O-N 3Å; V594-S596 VanDerWaalsContact C-N 3.3Å
595	L	62.5	Low	66.3	Low	4 Å²	4	43.6 Å²	43.6	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-81.5	-17.6	-174.6	-171.2	58.5	0	0	0	112.5	T380 V591 E597 A598 I599 Q746 V749	T380-L595 HydrophobicContact CG2-CD1 4.32Å; V591-L595 HydrophobicContact CG1-CB 4.01Å; V591-L595 HydrophobicContact CG1-CD2 3.88Å; V591-L595 WeakPolarHBondContact O-CB 3.46Å; V591-L595 PolarHBondContact O-N 3.45Å; V591-L595 VanDerWaalsContact O-N 3.08Å; L595-E597 PolarHBondContact O-N 3.43Å; L595-E597 VanDerWaalsContact O-N 3.12Å; L595-A598 HydrophobicContact CD1-CB 4.16Å; L595-A598 PolarHBondContact O-N 3.39Å; L595-I599 HydrophobicContact CB-CD1 4.42Å; L595-I599 HydrophobicContact CD1-CD1 4.43Å; L595-I599 HydrophobicContact CD1-CG1 4.24Å; L595-I599 HydrophobicContact CD2-CD1 3.47Å; L595-I599 VanDerWaalsContact CD2-CD1 3.47Å; L595-I599 HydrophobicContact CD2-CG1 4.19Å; L595-I599 HydrophobicContact CG-CD1 3.46Å; L595-I599 VanDerWaalsContact CG-CD1 3.46Å; L595-I599 HydrophobicContact CG-CG1 3.72Å; L595-I599 WeakPolarHBondContact O-CB 3.46Å; L595-I599 WeakPolarHBondContact O-CG1 3.46Å; L595-I599 PolarHBondContact O-N 2.91Å; L595-Q746 HydrophobicContact CD2-CB 4.49Å; L595-Q746 HydrophobicContact CD2-CG 4.31Å; L595-V749 HydrophobicContact CD1-CB 4.09Å; L595-V749 HydrophobicContact CD1-CG1 3.7Å; L595-V749 HydrophobicContact CD1-CG2 3.79Å; L595-V749 HydrophobicContact CD2-CB 3.31Å; L595-V749 HydrophobicContact CD2-CG1 3.48Å; L595-V749 VanDerWaalsContact CD2-CG1 3.48Å; L595-V749 HydrophobicContact CD2-CG2 3.65Å; L595-V749 HydrophobicContact CG-CB 4.28Å; L595-V749 HydrophobicContact CG-CG1 4.16Å; L595-V749 HydrophobicContact CG-CG2 4.24Å
596	S	67.3	Low	66.6	Low	66 Å²	66	44.2 Å²	44.2	46%	0.462	28%	0.278	S	S	.	.	H	α-helix	trans	-50.9	-37.4	178.1	-172.7	0	0	0	0	112.2	S592 V594 D600	S592-S596 WeakPolarHBondContact O-CB 3.48Å; S592-S596 PolarHBondContact O-N 3.35Å; V594-S596 VanDerWaalsContact C-N 3.3Å; S596-D600 WeakPolarHBondContact O-CA 3.31Å; S596-D600 WeakPolarHBondContact O-CB 3.36Å; S596-D600 PolarHBondContact O-N 2.92Å
597	E	66.1	Low	67.9	Low	128 Å²	128	43.6 Å²	43.6	60%	0.598	27%	0.272	S	S	*	.	H	α-helix	trans	-73.6	-44.6	-178	-162.7	-170	136.9	0	0	112.6	K383 L595 D600 G601	K383-E597 WeakPolarHBondContact CE-OE2 3.17Å; K383-E597 IonicContact NZ-OE1 3.59Å; K383-E597 PolarHBondContact NZ-OE1 2.97Å; K383-E597 IonicContact NZ-OE2 2.76Å; K383-E597 PolarHBondContact NZ-OE2 3.38Å; L595-E597 PolarHBondContact O-N 3.43Å; L595-E597 VanDerWaalsContact O-N 3.12Å; E597-D600 PolarHBondContact O-N 2.68Å; E597-G601 PolarHBondContact O-N 2.77Å
598	A	65.8	Low	69.4	Low	23 Å²	23	45 Å²	45	19%	0.19	27%	0.273	C	S	.	.	H	α-helix	trans	-67.5	-39.8	178.1	0	0	0	0	0	111.2	T380 L595 I602	T380-A598 HydrophobicContact CG2-CB 4.15Å; L595-A598 HydrophobicContact CD1-CB 4.16Å; L595-A598 PolarHBondContact O-N 3.39Å; A598-I602 WeakPolarHBondContact O-CG1 3.45Å; A598-I602 PolarHBondContact O-N 2.92Å
599	I	74.9	Confident	71.1	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-46.5	174.8	-73.2	179.7	0	0	0	111.2	L595 G601 I602 L603 T742 L745 Q746	L595-I599 HydrophobicContact CB-CD1 4.42Å; L595-I599 HydrophobicContact CD1-CD1 4.43Å; L595-I599 HydrophobicContact CD1-CG1 4.24Å; L595-I599 HydrophobicContact CD2-CD1 3.47Å; L595-I599 VanDerWaalsContact CD2-CD1 3.47Å; L595-I599 HydrophobicContact CD2-CG1 4.19Å; L595-I599 HydrophobicContact CG-CD1 3.46Å; L595-I599 VanDerWaalsContact CG-CD1 3.46Å; L595-I599 HydrophobicContact CG-CG1 3.72Å; L595-I599 WeakPolarHBondContact O-CB 3.46Å; L595-I599 WeakPolarHBondContact O-CG1 3.46Å; L595-I599 PolarHBondContact O-N 2.91Å; I599-G601 VanDerWaalsContact C-N 3.29Å; I599-G601 PolarHBondContact O-N 3.24Å; I599-I602 PolarHBondContact O-N 3.11Å; I599-L603 WeakPolarHBondContact O-CB 3.45Å; I599-L603 PolarHBondContact O-N 2.98Å; I599-T742 HydrophobicContact CG2-CG2 4.07Å; I599-L745 HydrophobicContact CD1-CB 3.75Å; I599-L745 HydrophobicContact CG1-CB 3.81Å; I599-L745 HydrophobicContact CG2-CB 4.14Å; I599-L745 HydrophobicContact CG2-CD1 3.91Å; I599-Q746 HydrophobicContact CD1-CB 4.1Å; I599-Q746 HydrophobicContact CD1-CG 3.35Å
600	D	78.4	Confident	72.6	Confident	55 Å²	55	40.4 Å²	40.4	29%	0.294	24%	0.243	S	C	.	.	H	α-helix	trans	-64.3	-37.4	-179.6	-163.6	65	0	0	0	110.4	S596 E597 I602 L603 Q604 R738	S596-D600 WeakPolarHBondContact O-CA 3.31Å; S596-D600 WeakPolarHBondContact O-CB 3.36Å; S596-D600 PolarHBondContact O-N 2.92Å; E597-D600 PolarHBondContact O-N 2.68Å; D600-I602 PolarHBondContact O-N 3.22Å; D600-L603 PolarHBondContact O-N 2.96Å; D600-Q604 WeakPolarHBondContact O-CB 3.49Å; D600-Q604 WeakPolarHBondContact O-CG 3.26Å; D600-Q604 PolarHBondContact O-N 2.57Å; D600-R738 IonicContact OD1-CZ 2.59Å; D600-R738 IonicContact OD1-NH2 3.84Å; D600-R738 PolarHBondContact OD1-NH2 3.24Å
601	G	77.2	Confident	73.9	Confident	47 Å²	47	43.8 Å²	43.8	49%	0.485	26%	0.258	S	S	.	.	H	α-helix	trans	-57.5	-48.1	172.7	0	0	0	0	0	113.4	E597 I599 L603 Q604 G605	E597-G601 PolarHBondContact O-N 2.77Å; I599-G601 VanDerWaalsContact C-N 3.29Å; I599-G601 PolarHBondContact O-N 3.24Å; G601-L603 VanDerWaalsContact C-N 3.34Å; G601-Q604 PolarHBondContact O-N 2.93Å; G601-G605 PolarHBondContact O-N 3.1Å
602	I	75.2	Confident	75.5	Confident	24 Å²	24	50.4 Å²	50.4	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-43.8	176.4	-69.1	164.2	0	0	0	110.7	A370 L374 A598 I599 D600 G605 L606 L745	A370-I602 HydrophobicContact CB-CG2 3.85Å; L374-I602 HydrophobicContact CB-CD1 3.82Å; L374-I602 HydrophobicContact CD1-CD1 3.39Å; L374-I602 HydrophobicContact CG-CD1 4.2Å; A598-I602 WeakPolarHBondContact O-CG1 3.45Å; A598-I602 PolarHBondContact O-N 2.92Å; I599-I602 PolarHBondContact O-N 3.11Å; D600-I602 PolarHBondContact O-N 3.22Å; I602-G605 PolarHBondContact O-N 3.48Å; I602-L606 HydrophobicContact CG2-CD1 4.18Å; I602-L606 WeakPolarHBondContact O-CG 3.47Å; I602-L606 PolarHBondContact O-N 2.84Å; I602-L745 HydrophobicContact CG2-CD1 4.19Å
603	L	81.9	Confident	76.9	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-42.3	-178.5	-170.7	59.6	0	0	0	111.6	I599 D600 G601 L606 I607 R738 L741 T742	I599-L603 WeakPolarHBondContact O-CB 3.45Å; I599-L603 PolarHBondContact O-N 2.98Å; D600-L603 PolarHBondContact O-N 2.96Å; G601-L603 VanDerWaalsContact C-N 3.34Å; L603-L606 PolarHBondContact O-N 3.44Å; L603-I607 HydrophobicContact CD1-CD1 4.45Å; L603-I607 HydrophobicContact CG-CD1 4.02Å; L603-I607 WeakPolarHBondContact O-CB 3.48Å; L603-I607 WeakPolarHBondContact O-CD1 3.45Å; L603-I607 WeakPolarHBondContact O-CG1 3.47Å; L603-I607 PolarHBondContact O-N 3.33Å; L603-R738 HydrophobicContact CD1-CG 4.23Å; L603-R738 HydrophobicContact CD2-CG 3.41Å; L603-R738 VanDerWaalsContact CD2-CG 3.41Å; L603-R738 HydrophobicContact CG-CG 4Å; L603-L741 HydrophobicContact CD1-CB 3.93Å; L603-L741 HydrophobicContact CD1-CD1 4.04Å; L603-T742 WeakPolarHBondContact CD2-OG1 2.86Å
604	Q	83.8	Confident	78.3	Confident	66 Å²	66	49 Å²	49	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-63.7	-42.6	174	-68.8	-60.2	-14.3	0	0	111.2	D600 G601 L606 I607 E608	D600-Q604 WeakPolarHBondContact O-CB 3.49Å; D600-Q604 WeakPolarHBondContact O-CG 3.26Å; D600-Q604 PolarHBondContact O-N 2.57Å; G601-Q604 PolarHBondContact O-N 2.93Å; Q604-L606 VanDerWaalsContact C-N 3.34Å; Q604-L606 PolarHBondContact O-N 3.5Å; Q604-I607 PolarHBondContact O-N 2.88Å; Q604-E608 WeakPolarHBondContact O-CB 3.28Å; Q604-E608 WeakPolarHBondContact O-CG 3.03Å; Q604-E608 PolarHBondContact O-N 3.31Å
605	G	81.8	Confident	79.8	Confident	34 Å²	34	47.6 Å²	47.6	35%	0.351	26%	0.26	S	S	.	.	H	α-helix	trans	-55.8	-47.6	174.3	0	0	0	0	0	112.3	G601 I602 E608 S609	G601-G605 PolarHBondContact O-N 3.1Å; I602-G605 PolarHBondContact O-N 3.48Å; G605-E608 PolarHBondContact O-N 2.98Å; G605-S609 PolarHBondContact O-N 3.48Å; G605-S609 PolarHBondContact O-OG 3.2Å
606	L	81.5	Confident	81.1	Confident	17 Å²	17	49.4 Å²	49.4	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-65.3	-40.8	176.9	-70.4	172.9	0	0	0	113	F218 L367 A370 I602 L603 Q604 E608 S609 F610	F218-L606 HydrophobicContact CE2-CD1 4.38Å; F218-L606 HydrophobicContact CZ-CD1 3.77Å; L367-L606 HydrophobicContact CD2-CD1 4.44Å; L367-L606 HydrophobicContact CD2-CD2 3.67Å; L367-L606 HydrophobicContact CG-CD2 4.23Å; A370-L606 HydrophobicContact CB-CD1 4.08Å; A370-L606 HydrophobicContact CB-CD2 3.7Å; A370-L606 HydrophobicContact CB-CG 3.92Å; I602-L606 HydrophobicContact CG2-CD1 4.18Å; I602-L606 WeakPolarHBondContact O-CG 3.47Å; I602-L606 PolarHBondContact O-N 2.84Å; L603-L606 PolarHBondContact O-N 3.44Å; Q604-L606 VanDerWaalsContact C-N 3.34Å; Q604-L606 PolarHBondContact O-N 3.5Å; L606-E608 VanDerWaalsContact C-N 3.33Å; L606-S609 PolarHBondContact O-N 3.3Å; L606-F610 WeakPolarHBondContact O-CB 3.27Å; L606-F610 PolarHBondContact O-N 2.97Å
607	I	85.5	Confident	82.3	Confident	14 Å²	14	48.6 Å²	48.6	7%	0.072	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-41.6	177.1	-71.8	169	0	0	0	110.6	L603 Q604 F610 K611 V734 R738	L603-I607 HydrophobicContact CD1-CD1 4.45Å; L603-I607 HydrophobicContact CG-CD1 4.02Å; L603-I607 WeakPolarHBondContact O-CB 3.48Å; L603-I607 WeakPolarHBondContact O-CD1 3.45Å; L603-I607 WeakPolarHBondContact O-CG1 3.47Å; L603-I607 PolarHBondContact O-N 3.33Å; Q604-I607 PolarHBondContact O-N 2.88Å; I607-F610 PolarHBondContact O-N 3.21Å; I607-K611 HydrophobicContact CG2-CD 4.06Å; I607-K611 WeakPolarHBondContact O-CB 3.42Å; I607-K611 VanDerWaalsContact O-CG 3.29Å; I607-K611 WeakPolarHBondContact O-CG 3.02Å; I607-K611 PolarHBondContact O-N 3.19Å; I607-V734 HydrophobicContact CB-CG1 4.43Å; I607-V734 HydrophobicContact CD1-CG1 3.79Å; I607-V734 HydrophobicContact CG1-CG1 3.74Å; I607-V734 HydrophobicContact CG1-CG2 4.5Å; I607-V734 HydrophobicContact CG2-CG1 3.86Å; I607-V734 HydrophobicContact CG2-CG2 4.2Å; I607-R738 HydrophobicContact CD1-CG 4.39Å
608	E	86.4	Confident	83.6	Confident	103 Å²	103	44.4 Å²	44.4	48%	0.481	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-44.9	175.5	-77	-173	-168.8	0	0	112	Q604 G605 L606 F610 K611 K612	Q604-E608 WeakPolarHBondContact O-CB 3.28Å; Q604-E608 WeakPolarHBondContact O-CG 3.03Å; Q604-E608 PolarHBondContact O-N 3.31Å; G605-E608 PolarHBondContact O-N 2.98Å; L606-E608 VanDerWaalsContact C-N 3.33Å; E608-F610 VanDerWaalsContact C-N 3.32Å; E608-F610 PolarHBondContact O-N 2.92Å; E608-K611 PolarHBondContact O-N 2.92Å; E608-K612 VanDerWaalsContact O-CG 3.28Å; E608-K612 WeakPolarHBondContact O-CG 3.4Å; E608-K612 PolarHBondContact O-N 3.19Å; E608-K612 IonicContact OE2-NZ 2.84Å; E608-K612 PolarHBondContact OE2-NZ 3.22Å
609	S	86.6	Confident	84.9	Confident	17 Å²	17	43.5 Å²	43.5	12%	0.119	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-44.5	175.5	-75.4	0	0	0	0	111.7	D366 G605 L606 K611 K612	D366-S609 PolarHBondContact OD1-OG 3.11Å; D366-S609 WeakPolarHBondContact OD2-CB 3.36Å; D366-S609 PolarHBondContact OD2-OG 2.8Å; G605-S609 PolarHBondContact O-N 3.48Å; G605-S609 PolarHBondContact O-OG 3.2Å; L606-S609 PolarHBondContact O-N 3.3Å; S609-K611 PolarHBondContact O-N 3.42Å; S609-K612 PolarHBondContact O-N 3.07Å
610	F	85.4	Confident	85.8	Confident	11 Å²	11	48.7 Å²	48.7	5%	0.048	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-49.2	173.7	-170.4	-107.4	0	0	0	110.7	L226 F229 V359 I363 L606 I607 E608 K612 I613 M730 V734	L226-F610 HydrophobicContact CD2-CE2 3.91Å; F229-F610 HydrophobicContact CD2-CE1 4.45Å; F229-F610 AromaticContact CD2-CZ 3.81Å; F229-F610 HydrophobicContact CD2-CZ 3.81Å; F229-F610 HydrophobicContact CE2-CE1 4.36Å; F229-F610 AromaticContact CE2-CZ 3.9Å; F229-F610 HydrophobicContact CE2-CZ 3.9Å; F229-F610 HydrophobicContact CG-CZ 4.13Å; F229-F610 HydrophobicContact CZ-CZ 4.31Å; V359-F610 HydrophobicContact CG1-CD2 4.07Å; V359-F610 HydrophobicContact CG1-CE2 3.6Å; I363-F610 HydrophobicContact CD1-CD2 4.44Å; L606-F610 WeakPolarHBondContact O-CB 3.27Å; L606-F610 PolarHBondContact O-N 2.97Å; I607-F610 PolarHBondContact O-N 3.21Å; E608-F610 VanDerWaalsContact C-N 3.32Å; E608-F610 PolarHBondContact O-N 2.92Å; F610-K612 VanDerWaalsContact C-N 3.26Å; F610-K612 PolarHBondContact O-N 3.42Å; F610-I613 HydrophobicContact CD2-CD1 4.11Å; F610-I613 WeakPolarHBondContact O-CB 2.98Å; F610-I613 WeakPolarHBondContact O-CD1 3.43Å; F610-I613 VanDerWaalsContact O-CG1 3.26Å; F610-I613 WeakPolarHBondContact O-CG1 3.29Å; F610-I613 PolarHBondContact O-N 3.25Å; F610-M730 HydrophobicContact CD1-CE 3.73Å; F610-M730 HydrophobicContact CD1-CG 3.8Å; F610-M730 HydrophobicContact CE1-CB 4.23Å; F610-M730 HydrophobicContact CE1-CE 3.88Å; F610-M730 HydrophobicContact CE1-CG 3.67Å; F610-M730 HydrophobicContact CG-CE 4.29Å; F610-M730 WeakPolarHBondContact O-CE 3.35Å; F610-V734 HydrophobicContact CD1-CG2 3.6Å; F610-V734 HydrophobicContact CE1-CG2 4.07Å
611	K	84.6	Confident	86.6	Confident	107 Å²	107	53.6 Å²	53.6	47%	0.465	27%	0.272	S	S	.	.	H	α-helix	trans	-64.8	-22.1	-179.4	-75.6	177.2	177.6	179.5	0	115.4	I607 E608 S609 I613 M730	I607-K611 HydrophobicContact CG2-CD 4.06Å; I607-K611 WeakPolarHBondContact O-CB 3.42Å; I607-K611 VanDerWaalsContact O-CG 3.29Å; I607-K611 WeakPolarHBondContact O-CG 3.02Å; I607-K611 PolarHBondContact O-N 3.19Å; E608-K611 PolarHBondContact O-N 2.92Å; S609-K611 PolarHBondContact O-N 3.42Å; K611-I613 VanDerWaalsContact C-N 3.33Å; K611-M730 HydrophobicContact CB-SD 4.23Å; K611-M730 HydrophobicContact CG-CG 4.19Å; K611-M730 HydrophobicContact CG-SD 3.96Å
612	K	87.2	Confident	87.4	Confident	153 Å²	153	52 Å²	52	67%	0.665	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.1	177.9	-75	167.6	-171.9	163	0	113.4	E608 S609 F610 D614	E608-K612 VanDerWaalsContact O-CG 3.28Å; E608-K612 WeakPolarHBondContact O-CG 3.4Å; E608-K612 PolarHBondContact O-N 3.19Å; E608-K612 IonicContact OE2-NZ 2.84Å; E608-K612 PolarHBondContact OE2-NZ 3.22Å; S609-K612 PolarHBondContact O-N 3.07Å; F610-K612 VanDerWaalsContact C-N 3.26Å; F610-K612 PolarHBondContact O-N 3.42Å; K612-D614 PolarHBondContact O-N 3.28Å
613	I	87.8	Confident	88.4	Confident	25 Å²	25	50.9 Å²	50.9	13%	0.128	25%	0.247	C	C	.	.			trans	-68.4	125.1	-178.8	-55.5	169.6	0	0	0	110.2	V359 I363 F610 K611 L615	V359-I613 HydrophobicContact CB-CD1 4.41Å; V359-I613 HydrophobicContact CG1-CD1 3.69Å; I363-I613 HydrophobicContact CG2-CD1 3.49Å; I363-I613 VanDerWaalsContact CG2-CD1 3.49Å; I363-I613 HydrophobicContact CG2-CG1 4.06Å; F610-I613 HydrophobicContact CD2-CD1 4.11Å; F610-I613 WeakPolarHBondContact O-CB 2.98Å; F610-I613 WeakPolarHBondContact O-CD1 3.43Å; F610-I613 VanDerWaalsContact O-CG1 3.26Å; F610-I613 WeakPolarHBondContact O-CG1 3.29Å; F610-I613 PolarHBondContact O-N 3.25Å; K611-I613 VanDerWaalsContact C-N 3.33Å; I613-L615 HydrophobicContact CG2-CD2 3.57Å; I613-L615 HydrophobicContact CG2-CG 4.03Å; I613-L615 PolarHBondContact O-N 3.33Å; I613-L615 VanDerWaalsContact O-N 3.11Å
614	D	88.8	Confident	89.1	Confident	92 Å²	92	57 Å²	57	49%	0.492	28%	0.276	S	S	.	.			trans	-78.9	94.3	172.9	-180	12.1	0	0	0	111.1	K612 E616 S617 P618	K612-D614 PolarHBondContact O-N 3.28Å; D614-E616 PolarHBondContact OD1-N 3.07Å; D614-E616 VanDerWaalsContact OD1-N 3.1Å; D614-S617 VanDerWaalsContact CG-OG 3.28Å; D614-S617 PolarHBondContact OD1-N 3.34Å; D614-S617 PolarHBondContact OD1-OG 2.88Å; D614-S617 WeakPolarHBondContact OD2-CB 3.35Å; D614-S617 PolarHBondContact OD2-OG 2.75Å; D614-P618 WeakPolarHBondContact O-CD 3.47Å
615	L	86.7	Confident	89.7	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.047	28%	0.275	C	S	.	.			trans	-89.2	-15.9	172.9	-60	-176.6	0	0	0	112.8	F229 L355 V359 I613 F619 V726	F229-L615 HydrophobicContact CE1-CD1 3.92Å; F229-L615 HydrophobicContact CZ-CD1 3.48Å; F229-L615 VanDerWaalsContact CZ-CD1 3.48Å; L355-L615 HydrophobicContact CD1-CD1 4.36Å; L355-L615 HydrophobicContact CD1-CD2 3.69Å; V359-L615 HydrophobicContact CG2-CD1 4.46Å; V359-L615 HydrophobicContact CG2-CD2 3.73Å; I613-L615 HydrophobicContact CG2-CD2 3.57Å; I613-L615 HydrophobicContact CG2-CG 4.03Å; I613-L615 PolarHBondContact O-N 3.33Å; I613-L615 VanDerWaalsContact O-N 3.11Å; L615-F619 VanDerWaalsContact O-CD2 3.28Å; L615-F619 WeakPolarHBondContact O-CD2 3.25Å; L615-V726 HydrophobicContact CB-CG1 4.06Å; L615-V726 HydrophobicContact CB-CG2 4.21Å; L615-V726 HydrophobicContact CD1-CG1 4.41Å
616	E	91.4	Very high	90.4	Very high	41 Å²	41	54.1 Å²	54.1	19%	0.192	26%	0.258	C	S	.	.	H	α-helix	trans	-79.4	-45.2	-176.3	-71.6	-165.8	-150.8	0	0	111.9	D614 F619 R620 S723 V726	D614-E616 PolarHBondContact OD1-N 3.07Å; D614-E616 VanDerWaalsContact OD1-N 3.1Å; E616-F619 PolarHBondContact O-N 2.86Å; E616-R620 WeakPolarHBondContact O-CB 3.44Å; E616-R620 WeakPolarHBondContact O-CG 3.19Å; E616-R620 PolarHBondContact O-N 2.85Å; E616-R620 IonicContact OE2-CZ 3.08Å; E616-R620 IonicContact OE2-NE 2.78Å; E616-R620 PolarHBondContact OE2-NE 3.39Å; E616-R620 IonicContact OE2-NH2 2.67Å; E616-R620 PolarHBondContact OE2-NH2 2.98Å; E616-S723 VanDerWaalsContact OE1-CA 3.31Å; E616-S723 WeakPolarHBondContact OE1-CA 3.33Å; E616-S723 WeakPolarHBondContact OE1-CB 3.41Å; E616-S723 PolarHBondContact OE1-OG 2.98Å; E616-V726 HydrophobicContact CG-CB 4.45Å; E616-V726 HydrophobicContact CG-CG2 4.08Å
617	S	92.2	Very high	91.1	Very high	49 Å²	49	55.1 Å²	55.1	34%	0.343	26%	0.263	S	S	.	.	H	α-helix	trans	-62.6	-40.3	-172.7	-58.6	0	0	0	0	114.6	D614 R620 R621	D614-S617 VanDerWaalsContact CG-OG 3.28Å; D614-S617 PolarHBondContact OD1-N 3.34Å; D614-S617 PolarHBondContact OD1-OG 2.88Å; D614-S617 WeakPolarHBondContact OD2-CB 3.35Å; D614-S617 PolarHBondContact OD2-OG 2.75Å; S617-R620 PolarHBondContact O-N 3.38Å; S617-R621 WeakPolarHBondContact O-CB 3.2Å; S617-R621 WeakPolarHBondContact O-CG 3.47Å; S617-R621 PolarHBondContact O-N 3.31Å; S617-R621 PolarHBondContact O-NE 2.64Å
618	P	91.7	Very high	91.7	Very high	40 Å²	40	56.3 Å²	56.3	26%	0.26	28%	0.275	S	S	.	.	H	α-helix	trans	-58	-48.7	174.2	-24.4	35.1	0	0	0	112	T351 D614 R621 T622	T351-P618 HydrophobicContact CG2-CB 4.46Å; D614-P618 WeakPolarHBondContact O-CD 3.47Å; P618-R621 PolarHBondContact O-N 2.96Å; P618-T622 PolarHBondContact O-N 3.47Å; P618-T622 PolarHBondContact O-OG1 2.82Å; P618-T622 VanDerWaalsContact O-OG1 3.11Å
619	F	93.4	Very high	92.2	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-43.4	178.5	-79.4	-86.3	0	0	0	112.1	F233 T351 I352 L355 L615 E616 R621 T622 I623 Y718 L722	F233-F619 HydrophobicContact CD1-CZ 4.44Å; F233-F619 AromaticContact CE1-CE1 3.97Å; F233-F619 HydrophobicContact CE1-CE1 3.97Å; F233-F619 AromaticContact CE1-CE2 3.88Å; F233-F619 HydrophobicContact CE1-CE2 3.88Å; F233-F619 AromaticContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CE1-CZ 3.48Å; F233-F619 VanDerWaalsContact CE1-CZ 3.48Å; F233-F619 HydrophobicContact CZ-CD2 4.43Å; F233-F619 HydrophobicContact CZ-CE1 4.42Å; F233-F619 HydrophobicContact CZ-CE2 4.03Å; F233-F619 HydrophobicContact CZ-CZ 4.03Å; T351-F619 HydrophobicContact CG2-CD1 3.89Å; T351-F619 HydrophobicContact CG2-CD2 4.08Å; T351-F619 HydrophobicContact CG2-CE1 3.83Å; T351-F619 HydrophobicContact CG2-CE2 4.05Å; T351-F619 HydrophobicContact CG2-CG 4.03Å; T351-F619 HydrophobicContact CG2-CZ 3.92Å; I352-F619 HydrophobicContact CG1-CE1 3.73Å; I352-F619 HydrophobicContact CG1-CZ 4.19Å; L355-F619 HydrophobicContact CD1-CE2 4.22Å; L615-F619 VanDerWaalsContact O-CD2 3.28Å; L615-F619 WeakPolarHBondContact O-CD2 3.25Å; E616-F619 PolarHBondContact O-N 2.86Å; F619-R621 VanDerWaalsContact C-N 3.31Å; F619-R621 PolarHBondContact O-N 3.46Å; F619-T622 PolarHBondContact O-N 3.39Å; F619-I623 WeakPolarHBondContact O-CB 3.29Å; F619-I623 WeakPolarHBondContact O-CD1 3.33Å; F619-I623 WeakPolarHBondContact O-CG1 3.34Å; F619-I623 PolarHBondContact O-N 3.47Å; F619-Y718 HydrophobicContact CD1-CE1 4Å; F619-Y718 WeakPolarHBondContact CE1-OH 3.32Å; F619-L722 HydrophobicContact CB-CD1 4.04Å; F619-L722 HydrophobicContact CB-CD2 3.75Å; F619-L722 HydrophobicContact CG-CD1 4.29Å
620	R	94.4	Very high	92.7	Very high	112 Å²	112	50.9 Å²	50.9	42%	0.423	25%	0.248	S	C	.	.	H	α-helix	trans	-59.1	-42.2	176.6	-73.8	-174	-174.9	-148.8	5.4	111.9	E616 S617 Q624 L722	E616-R620 WeakPolarHBondContact O-CB 3.44Å; E616-R620 WeakPolarHBondContact O-CG 3.19Å; E616-R620 PolarHBondContact O-N 2.85Å; E616-R620 IonicContact OE2-CZ 3.08Å; E616-R620 IonicContact OE2-NE 2.78Å; E616-R620 PolarHBondContact OE2-NE 3.39Å; E616-R620 IonicContact OE2-NH2 2.67Å; E616-R620 PolarHBondContact OE2-NH2 2.98Å; S617-R620 PolarHBondContact O-N 3.38Å; R620-Q624 WeakPolarHBondContact O-CB 3.49Å; R620-Q624 VanDerWaalsContact O-CG 3.24Å; R620-Q624 WeakPolarHBondContact O-CG 3.41Å; R620-Q624 PolarHBondContact O-N 3.49Å; R620-L722 HydrophobicContact CG-CD2 3.81Å
621	R	95	Very high	93.1	Very high	159 Å²	159	56.2 Å²	56.2	60%	0.6	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-47.7	174.9	-75.5	-175.5	-65.8	166.1	-2	111.5	S617 P618 F619 I623 Q624 S625	S617-R621 WeakPolarHBondContact O-CB 3.2Å; S617-R621 WeakPolarHBondContact O-CG 3.47Å; S617-R621 PolarHBondContact O-N 3.31Å; S617-R621 PolarHBondContact O-NE 2.64Å; P618-R621 PolarHBondContact O-N 2.96Å; F619-R621 VanDerWaalsContact C-N 3.31Å; F619-R621 PolarHBondContact O-N 3.46Å; R621-I623 PolarHBondContact O-N 3.04Å; R621-Q624 PolarHBondContact O-N 2.91Å; R621-S625 WeakPolarHBondContact O-CB 3.27Å; R621-S625 PolarHBondContact O-N 2.89Å; R621-S625 PolarHBondContact O-OG 3.2Å; R621-S625 VanDerWaalsContact O-OG 3.1Å
622	T	95.2	Very high	93.7	Very high	12 Å²	12	57 Å²	57	7%	0.074	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-44.3	178.5	-58	0	0	0	0	111.6	E347 F348 T351 P618 F619 Q624 S625 C626	E347-T622 HydrophobicContact CB-CG2 4.23Å; E347-T622 HydrophobicContact CG-CG2 4.27Å; F348-T622 HydrophobicContact CB-CG2 4.25Å; T351-T622 PolarHBondContact OG1-OG1 3.15Å; P618-T622 PolarHBondContact O-N 3.47Å; P618-T622 PolarHBondContact O-OG1 2.82Å; P618-T622 VanDerWaalsContact O-OG1 3.11Å; F619-T622 PolarHBondContact O-N 3.39Å; T622-Q624 PolarHBondContact O-N 3.1Å; T622-S625 PolarHBondContact O-N 2.84Å; T622-C626 WeakPolarHBondContact O-CB 3.31Å; T622-C626 PolarHBondContact O-N 3.26Å; T622-C626 PolarHBondContact O-SG 2.79Å
623	I	95.8	Very high	94.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-59.7	-48.4	176.2	-67.2	159.6	0	0	0	110.7	F619 R621 S625 C626 L627 L715 Y718 N719 L722	F619-I623 WeakPolarHBondContact O-CB 3.29Å; F619-I623 WeakPolarHBondContact O-CD1 3.33Å; F619-I623 WeakPolarHBondContact O-CG1 3.34Å; F619-I623 PolarHBondContact O-N 3.47Å; R621-I623 PolarHBondContact O-N 3.04Å; I623-S625 VanDerWaalsContact C-N 3.31Å; I623-S625 PolarHBondContact O-N 2.97Å; I623-C626 PolarHBondContact O-N 3.17Å; I623-L627 HydrophobicContact CG2-CD1 3.9Å; I623-L627 HydrophobicContact CG2-CG 4.3Å; I623-L627 WeakPolarHBondContact O-CB 3.42Å; I623-L627 WeakPolarHBondContact O-CG 3.35Å; I623-L627 PolarHBondContact O-N 2.88Å; I623-L715 HydrophobicContact CG1-CD2 4.21Å; I623-L715 HydrophobicContact CG2-CD2 4.37Å; I623-Y718 HydrophobicContact CD1-CD1 3.64Å; I623-Y718 HydrophobicContact CD1-CE1 3.98Å; I623-Y718 HydrophobicContact CG1-CD1 4.32Å; I623-N719 HydrophobicContact CD1-CB 4.13Å; I623-N719 HydrophobicContact CG2-CB 4.14Å; I623-L722 HydrophobicContact CD1-CD2 4.24Å
624	Q	95.7	Very high	94.3	Very high	130 Å²	130	53.8 Å²	53.8	61%	0.607	26%	0.258	S	S	*	.	H	α-helix	trans	-59.3	-43.8	178.2	-76.6	173.5	-6.9	0	0	111.5	R620 R621 T622 L627 A628	R620-Q624 WeakPolarHBondContact O-CB 3.49Å; R620-Q624 VanDerWaalsContact O-CG 3.24Å; R620-Q624 WeakPolarHBondContact O-CG 3.41Å; R620-Q624 PolarHBondContact O-N 3.49Å; R621-Q624 PolarHBondContact O-N 2.91Å; T622-Q624 PolarHBondContact O-N 3.1Å; Q624-L627 PolarHBondContact O-N 3.22Å; Q624-A628 WeakPolarHBondContact O-CB 3.41Å; Q624-A628 PolarHBondContact O-N 3.38Å
625	S	95.8	Very high	94.5	Very high	41 Å²	41	51.5 Å²	51.5	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-66.4	-38.8	177	-62	0	0	0	0	112.4	Y344 R621 T622 I623 A628 A629	Y344-S625 WeakPolarHBondContact OH-CB 3.27Å; Y344-S625 PolarHBondContact OH-OG 3.24Å; R621-S625 WeakPolarHBondContact O-CB 3.27Å; R621-S625 PolarHBondContact O-N 2.89Å; R621-S625 PolarHBondContact O-OG 3.2Å; R621-S625 VanDerWaalsContact O-OG 3.1Å; T622-S625 PolarHBondContact O-N 2.84Å; I623-S625 VanDerWaalsContact C-N 3.31Å; I623-S625 PolarHBondContact O-N 2.97Å; S625-A628 PolarHBondContact O-N 2.87Å; S625-A629 WeakPolarHBondContact O-CB 3.26Å; S625-A629 PolarHBondContact O-N 3.14Å
626	C	97.4	Very high	94.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.5	-43.9	173.6	-70.2	0	0	0	0	112	L345 T622 I623 A628 A629 F630 L715	L345-C626 HydrophobicContact CD2-CB 3.96Å; T622-C626 WeakPolarHBondContact O-CB 3.31Å; T622-C626 PolarHBondContact O-N 3.26Å; T622-C626 PolarHBondContact O-SG 2.79Å; I623-C626 PolarHBondContact O-N 3.17Å; C626-A628 VanDerWaalsContact C-N 3.33Å; C626-A628 PolarHBondContact O-N 2.92Å; C626-A629 WeakPolarHBondContact O-CB 3.36Å; C626-A629 PolarHBondContact O-N 3.23Å; C626-F630 VanDerWaalsContact O-CD2 3.23Å; C626-F630 WeakPolarHBondContact O-CD2 3.28Å; C626-F630 PolarHBondContact O-N 3.17Å; C626-L715 HydrophobicContact CB-CD1 3.77Å; C626-L715 HydrophobicContact CB-CD2 4.33Å
627	L	96.6	Very high	94.5	Very high	38 Å²	38	51.9 Å²	51.9	20%	0.199	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-40.3	175.6	-70.9	173.7	0	0	0	111.3	I623 Q624 A629 F630 E631 V712 L715	I623-L627 HydrophobicContact CG2-CD1 3.9Å; I623-L627 HydrophobicContact CG2-CG 4.3Å; I623-L627 WeakPolarHBondContact O-CB 3.42Å; I623-L627 WeakPolarHBondContact O-CG 3.35Å; I623-L627 PolarHBondContact O-N 2.88Å; Q624-L627 PolarHBondContact O-N 3.22Å; L627-A629 VanDerWaalsContact C-N 3.34Å; L627-A629 PolarHBondContact O-N 3.26Å; L627-F630 PolarHBondContact O-N 3.33Å; L627-E631 PolarHBondContact O-N 3.29Å; L627-V712 HydrophobicContact CD2-CG1 4.01Å; L627-L715 HydrophobicContact CD2-CB 4.1Å; L627-L715 HydrophobicContact CD2-CD1 4.2Å
628	A	97	Very high	94	Very high	39 Å²	39	55 Å²	55	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-65.1	-36.9	174.6	0	0	0	0	0	112.4	Q624 S625 C626 E631 R632	Q624-A628 WeakPolarHBondContact O-CB 3.41Å; Q624-A628 PolarHBondContact O-N 3.38Å; S625-A628 PolarHBondContact O-N 2.87Å; C626-A628 VanDerWaalsContact C-N 3.33Å; C626-A628 PolarHBondContact O-N 2.92Å; A628-E631 PolarHBondContact O-N 2.82Å; A628-R632 PolarHBondContact O-N 2.93Å; A628-R632 VanDerWaalsContact O-N 3.16Å; A628-R632 PolarHBondContact O-NH1 3.45Å
629	A	97	Very high	93.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-43.6	171.9	0	0	0	0	0	111.1	D341 L345 S625 C626 L627 E631 R632 L633	D341-A629 HydrophobicContact CB-CB 4.16Å; L345-A629 HydrophobicContact CD2-CB 4.11Å; S625-A629 WeakPolarHBondContact O-CB 3.26Å; S625-A629 PolarHBondContact O-N 3.14Å; C626-A629 WeakPolarHBondContact O-CB 3.36Å; C626-A629 PolarHBondContact O-N 3.23Å; L627-A629 VanDerWaalsContact C-N 3.34Å; L627-A629 PolarHBondContact O-N 3.26Å; A629-E631 PolarHBondContact O-N 3.21Å; A629-R632 PolarHBondContact O-N 2.75Å; A629-L633 WeakPolarHBondContact O-CG 3.44Å; A629-L633 PolarHBondContact O-N 3.38Å
630	F	96.9	Very high	93	Very high	6 Å²	6	56.4 Å²	56.4	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-64	-37.6	175	-78.9	-56.8	0	0	0	113.6	I246 F249 L345 C626 L627 R632 L633 K634 M708 A711 V712 L715	I246-F630 HydrophobicContact CG1-CZ 4.47Å; F249-F630 AromaticContact CD1-CE1 3.71Å; F249-F630 HydrophobicContact CD1-CE1 3.71Å; F249-F630 HydrophobicContact CD1-CZ 4.25Å; F249-F630 HydrophobicContact CE1-CD1 4.48Å; F249-F630 AromaticContact CE1-CE1 3.75Å; F249-F630 HydrophobicContact CE1-CE1 3.75Å; F249-F630 HydrophobicContact CG-CE1 4.17Å; F249-F630 HydrophobicContact CZ-CE1 4.22Å; L345-F630 HydrophobicContact CD1-CD1 4.47Å; L345-F630 HydrophobicContact CD1-CE1 3.66Å; L345-F630 HydrophobicContact CD1-CE2 4.15Å; L345-F630 HydrophobicContact CD1-CZ 3.47Å; L345-F630 VanDerWaalsContact CD1-CZ 3.47Å; L345-F630 HydrophobicContact CD2-CD2 4Å; L345-F630 HydrophobicContact CD2-CE1 4.4Å; L345-F630 HydrophobicContact CD2-CE2 3.62Å; L345-F630 HydrophobicContact CD2-CZ 3.85Å; L345-F630 HydrophobicContact CG-CZ 4.3Å; C626-F630 VanDerWaalsContact O-CD2 3.23Å; C626-F630 WeakPolarHBondContact O-CD2 3.28Å; C626-F630 PolarHBondContact O-N 3.17Å; L627-F630 PolarHBondContact O-N 3.33Å; F630-R632 VanDerWaalsContact C-N 3.3Å; F630-R632 PolarHBondContact O-N 3.32Å; F630-L633 HydrophobicContact CD1-CD1 4.31Å; F630-L633 CarbonylContact O-C 3.58Å; F630-L633 WeakPolarHBondContact O-CA 3.23Å; F630-L633 PolarHBondContact O-N 3.37Å; F630-K634 PolarHBondContact O-N 2.94Å; F630-M708 HydrophobicContact CD1-CG 3.49Å; F630-M708 VanDerWaalsContact CD1-CG 3.49Å; F630-M708 HydrophobicContact CD1-SD 4.25Å; F630-M708 HydrophobicContact CE1-CG 3.78Å; F630-M708 HydrophobicContact CG-CG 4.48Å; F630-A711 HydrophobicContact CE1-CB 4.29Å; F630-A711 HydrophobicContact CE2-CB 3.98Å; F630-A711 HydrophobicContact CZ-CB 3.53Å; F630-V712 HydrophobicContact CB-CG2 3.72Å; F630-V712 HydrophobicContact CD1-CG2 4.26Å; F630-V712 HydrophobicContact CD2-CG2 3.73Å; F630-V712 HydrophobicContact CE2-CG2 4.39Å; F630-V712 HydrophobicContact CG-CG2 3.65Å; F630-L715 HydrophobicContact CD2-CD1 3.82Å; F630-L715 HydrophobicContact CE2-CD1 3.56Å
631	E	95.5	Very high	92.7	Very high	122 Å²	122	51 Å²	51	57%	0.57	25%	0.254	S	S	*	.	H	α-helix	trans	-63.6	-34.9	173.1	-77	-62.1	148.5	0	0	112.2	L627 A628 A629 L633 K634	L627-E631 PolarHBondContact O-N 3.29Å; A628-E631 PolarHBondContact O-N 2.82Å; A629-E631 PolarHBondContact O-N 3.21Å; E631-L633 VanDerWaalsContact C-N 3.27Å; E631-L633 PolarHBondContact O-N 3Å; E631-K634 WeakPolarHBondContact O-CB 3.34Å; E631-K634 PolarHBondContact O-N 3.11Å; E631-K634 IonicContact OE2-NZ 3.58Å; E631-K634 PolarHBondContact OE2-NZ 3.15Å; E631-K634 VanDerWaalsContact OE2-NZ 3.15Å
632	R	95.4	Very high	92.4	Very high	123 Å²	123	50.6 Å²	50.6	46%	0.464	25%	0.252	S	S	.	.	H	α-helix	trans	-69.5	-25.6	172.2	-70.5	-172.6	-67.4	-85.7	1.5	112.8	D341 A628 A629 F630 K634	D341-R632 IonicContact OD1-CZ 3.69Å; D341-R632 IonicContact OD1-NE 2.99Å; D341-R632 PolarHBondContact OD1-NE 3.17Å; D341-R632 IonicContact OD1-NH2 3.11Å; D341-R632 PolarHBondContact OD1-NH2 3.12Å; D341-R632 IonicContact OD2-NE 2.83Å; A628-R632 PolarHBondContact O-N 2.93Å; A628-R632 VanDerWaalsContact O-N 3.16Å; A628-R632 PolarHBondContact O-NH1 3.45Å; A629-R632 PolarHBondContact O-N 2.75Å; F630-R632 VanDerWaalsContact C-N 3.3Å; F630-R632 PolarHBondContact O-N 3.32Å; R632-K634 VanDerWaalsContact C-N 3.31Å
633	L	95.9	Very high	91.9	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	5.2	176.1	-66.3	166.3	0	0	0	113.7	F249 H338 D341 V342 A629 F630 E631 F635 L636 M708	F249-L633 HydrophobicContact CE1-CD1 3.9Å; F249-L633 HydrophobicContact CZ-CD1 3.92Å; H338-L633 HydrophobicContact CB-CD2 3.64Å; D341-L633 HydrophobicContact CB-CD1 4.27Å; D341-L633 HydrophobicContact CB-CD2 4.42Å; D341-L633 HydrophobicContact CB-CG 4.25Å; V342-L633 HydrophobicContact CG2-CD1 4.07Å; V342-L633 HydrophobicContact CG2-CD2 3.96Å; A629-L633 WeakPolarHBondContact O-CG 3.44Å; A629-L633 PolarHBondContact O-N 3.38Å; F630-L633 HydrophobicContact CD1-CD1 4.31Å; F630-L633 CarbonylContact O-C 3.58Å; F630-L633 WeakPolarHBondContact O-CA 3.23Å; F630-L633 PolarHBondContact O-N 3.37Å; E631-L633 VanDerWaalsContact C-N 3.27Å; E631-L633 PolarHBondContact O-N 3Å; L633-F635 HydrophobicContact CD2-CE1 3.94Å; L633-F635 HydrophobicContact CD2-CZ 4.08Å; L633-F635 PolarHBondContact O-N 3.49Å; L633-L636 HydrophobicContact CB-CD1 4.32Å; L633-L636 HydrophobicContact CD2-CD1 4.47Å; L633-L636 VanDerWaalsContact O-CB 3.3Å; L633-L636 WeakPolarHBondContact O-CB 3.28Å; L633-L636 WeakPolarHBondContact O-CG 3.41Å; L633-L636 PolarHBondContact O-N 2.89Å; L633-M708 HydrophobicContact CB-SD 4.12Å
634	K	92.7	Very high	91.5	Very high	112 Å²	112	53.6 Å²	53.6	49%	0.487	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-60.7	-18.6	-176	-169.3	174.3	-163.8	156.4	0	114.9	F630 E631 R632 L636 S637	F630-K634 PolarHBondContact O-N 2.94Å; E631-K634 WeakPolarHBondContact O-CB 3.34Å; E631-K634 PolarHBondContact O-N 3.11Å; E631-K634 IonicContact OE2-NZ 3.58Å; E631-K634 PolarHBondContact OE2-NZ 3.15Å; E631-K634 VanDerWaalsContact OE2-NZ 3.15Å; R632-K634 VanDerWaalsContact C-N 3.31Å; K634-L636 PolarHBondContact O-N 2.89Å; K634-L636 VanDerWaalsContact O-N 3.14Å; K634-S637 WeakPolarHBondContact O-CB 3.41Å; K634-S637 PolarHBondContact O-N 2.95Å; K634-S637 PolarHBondContact O-OG 3.31Å
635	F	92	Very high	91.3	Very high	44 Å²	44	48.2 Å²	48.2	19%	0.193	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-55.7	-27.4	170.2	66.3	-94.5	0	0	0	112.2	Q334 I335 H338 L633 S637 V638	Q334-F635 HydrophobicContact CB-CD2 3.78Å; Q334-F635 HydrophobicContact CB-CE2 3.4Å; Q334-F635 VanDerWaalsContact CB-CE2 3.4Å; Q334-F635 HydrophobicContact CB-CG 4.48Å; Q334-F635 HydrophobicContact CB-CZ 3.84Å; Q334-F635 HydrophobicContact CG-CD2 4.5Å; Q334-F635 VanDerWaalsContact OE1-CG 3.31Å; I335-F635 HydrophobicContact CG1-CE2 4.26Å; I335-F635 HydrophobicContact CG1-CZ 4.5Å; H338-F635 HydrophobicContact CB-CE1 4.1Å; H338-F635 HydrophobicContact CB-CZ 4.31Å; H338-F635 AromaticContact CD2-CE1 3.46Å; H338-F635 VanDerWaalsContact CD2-CE1 3.46Å; H338-F635 WeakPolarHBondContact CD2-CE1 3.48Å; H338-F635 AromaticContact CG-CE1 3.81Å; L633-F635 HydrophobicContact CD2-CE1 3.94Å; L633-F635 HydrophobicContact CD2-CZ 4.08Å; L633-F635 PolarHBondContact O-N 3.49Å; F635-S637 PolarHBondContact O-N 3.15Å; F635-V638 PolarHBondContact O-N 3.39Å
636	L	91.9	Very high	90.9	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-68.1	-18.9	174.4	-63.5	175.2	0	0	0	113.4	F249 I331 I335 L633 K634 V638 V639 I704 P705 M708	F249-L636 HydrophobicContact CE2-CD1 3.75Å; F249-L636 HydrophobicContact CZ-CD1 3.73Å; I331-L636 HydrophobicContact CG2-CD2 3.68Å; I335-L636 HydrophobicContact CD1-CD2 4.06Å; I335-L636 HydrophobicContact CG1-CD2 3.83Å; L633-L636 HydrophobicContact CB-CD1 4.32Å; L633-L636 HydrophobicContact CD2-CD1 4.47Å; L633-L636 VanDerWaalsContact O-CB 3.3Å; L633-L636 WeakPolarHBondContact O-CB 3.28Å; L633-L636 WeakPolarHBondContact O-CG 3.41Å; L633-L636 PolarHBondContact O-N 2.89Å; K634-L636 PolarHBondContact O-N 2.89Å; K634-L636 VanDerWaalsContact O-N 3.14Å; L636-V638 PolarHBondContact O-N 2.85Å; L636-V639 WeakPolarHBondContact O-CG2 3.5Å; L636-I704 HydrophobicContact CB-CG2 4.41Å; L636-I704 HydrophobicContact CD1-CG2 3.92Å; L636-I704 HydrophobicContact CD2-CG2 4.32Å; L636-I704 HydrophobicContact CG-CG2 4.46Å; L636-P705 VanDerWaalsContact O-CG 3.32Å; L636-P705 WeakPolarHBondContact O-CG 3.1Å; L636-M708 HydrophobicContact CB-CE 4.48Å; L636-M708 HydrophobicContact CB-SD 4.19Å; L636-M708 HydrophobicContact CD1-SD 4.44Å
637	S	86.4	Confident	90.4	Very high	57 Å²	57	54 Å²	54	40%	0.399	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-72.5	-16.6	179.2	66.9	0	0	0	0	114	K634 F635	K634-S637 WeakPolarHBondContact O-CB 3.41Å; K634-S637 PolarHBondContact O-N 2.95Å; K634-S637 PolarHBondContact O-OG 3.31Å; F635-S637 PolarHBondContact O-N 3.15Å
638	V	81.8	Confident	90.1	Very high	113 Å²	113	52.3 Å²	52.3	69%	0.685	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-91.3	-8.3	-176.5	-172.8	0	0	0	0	111.9	F635 L636 D640	F635-V638 PolarHBondContact O-N 3.39Å; L636-V638 PolarHBondContact O-N 2.85Å; V638-D640 PolarHBondContact O-N 3.45Å; V638-D640 VanDerWaalsContact O-N 3.16Å
639	V	80.4	Confident	89.6	Confident	13 Å²	13	55.4 Å²	55.4	8%	0.079	26%	0.263	C	S	.	.			trans	-65.6	115	-176.5	-178	0	0	0	0	110.5	I331 L636 I641 F701 P705	I331-V639 HydrophobicContact CD1-CB 4.12Å; I331-V639 HydrophobicContact CD1-CG1 3.81Å; I331-V639 HydrophobicContact CD1-CG2 3.4Å; I331-V639 HydrophobicContact CG1-CG2 4Å; I331-V639 HydrophobicContact CG2-CG2 4.19Å; L636-V639 WeakPolarHBondContact O-CG2 3.5Å; V639-I641 HydrophobicContact CG1-CG2 4.42Å; V639-F701 HydrophobicContact CG1-CD1 3.86Å; V639-F701 HydrophobicContact CG1-CE1 3.39Å; V639-F701 HydrophobicContact CG1-CZ 4.24Å; V639-P705 HydrophobicContact CB-CG 4.2Å
640	D	85	Confident	89.2	Confident	61 Å²	61	57 Å²	57	33%	0.326	27%	0.273	S	S	.	.			trans	-134.5	95.4	174.8	-174.4	3.8	0	0	0	110.5	Q324 V638 R642	Q324-D640 PolarHBondContact NE2-O 2.91Å; V638-D640 PolarHBondContact O-N 3.45Å; V638-D640 VanDerWaalsContact O-N 3.16Å; D640-R642 VanDerWaalsContact OD1-CB 3.27Å; D640-R642 WeakPolarHBondContact OD1-CB 3.34Å; D640-R642 WeakPolarHBondContact OD1-CG 3.17Å; D640-R642 IonicContact OD1-CZ 2.75Å; D640-R642 PolarHBondContact OD1-N 3.43Å; D640-R642 IonicContact OD1-NE 3.25Å; D640-R642 PolarHBondContact OD1-NE 3.14Å; D640-R642 IonicContact OD1-NH2 2.92Å; D640-R642 IonicContact OD2-CZ 3.37Å; D640-R642 IonicContact OD2-NE 3.78Å; D640-R642 PolarHBondContact OD2-NE 2.95Å; D640-R642 IonicContact OD2-NH2 3.97Å; D640-R642 PolarHBondContact OD2-NH2 3.33Å
641	I	87.4	Confident	88.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.279	C	S	.	.			trans	-106.8	26.1	178.1	60.5	156.9	0	0	0	112	Q324 V328 V639 E643 A644 I645 F698 F701 N702	Q324-I641 HydrophobicContact CB-CG2 4.47Å; V328-I641 HydrophobicContact CG2-CG2 4.33Å; V639-I641 HydrophobicContact CG1-CG2 4.42Å; I641-E643 PolarHBondContact O-N 3Å; I641-A644 HydrophobicContact CB-CB 4.29Å; I641-A644 PolarHBondContact O-N 3.11Å; I641-I645 HydrophobicContact CD1-CD1 4.43Å; I641-I645 HydrophobicContact CG1-CD1 4.21Å; I641-I645 WeakPolarHBondContact O-CG1 3.39Å; I641-I645 PolarHBondContact O-N 3.29Å; I641-F698 HydrophobicContact CD1-CB 3.77Å; I641-F698 HydrophobicContact CD1-CD1 3.71Å; I641-F698 HydrophobicContact CD1-CG 4.03Å; I641-F698 VanDerWaalsContact CD1-O 3.28Å; I641-F698 WeakPolarHBondContact CD1-O 3.42Å; I641-F701 HydrophobicContact CD1-CB 4.06Å; I641-F701 HydrophobicContact CD1-CD1 3.52Å; I641-F701 HydrophobicContact CD1-CE1 4.44Å; I641-F701 HydrophobicContact CD1-CG 4.24Å; I641-F701 HydrophobicContact CG1-CD1 4.1Å; I641-F701 HydrophobicContact CG2-CD1 4.38Å; I641-F701 HydrophobicContact CG2-CE1 4.29Å; I641-N702 HydrophobicContact CD1-CB 4.08Å; I641-N702 HydrophobicContact CG1-CB 3.69Å; I641-N702 WeakPolarHBondContact CG1-OD1 3.46Å; I641-N702 PolarHBondContact N-OD1 3.38Å
642	R	88.1	Confident	88.5	Confident	150 Å²	150	52.2 Å²	52.2	57%	0.566	25%	0.253	S	S	*	.	H	α-helix	trans	-60.6	-32.1	179.9	-74.6	-179.4	-71.9	-164.3	-2	112.7	D640 K646	D640-R642 VanDerWaalsContact OD1-CB 3.27Å; D640-R642 WeakPolarHBondContact OD1-CB 3.34Å; D640-R642 WeakPolarHBondContact OD1-CG 3.17Å; D640-R642 IonicContact OD1-CZ 2.75Å; D640-R642 PolarHBondContact OD1-N 3.43Å; D640-R642 IonicContact OD1-NE 3.25Å; D640-R642 PolarHBondContact OD1-NE 3.14Å; D640-R642 IonicContact OD1-NH2 2.92Å; D640-R642 IonicContact OD2-CZ 3.37Å; D640-R642 IonicContact OD2-NE 3.78Å; D640-R642 PolarHBondContact OD2-NE 2.95Å; D640-R642 IonicContact OD2-NH2 3.97Å; D640-R642 PolarHBondContact OD2-NH2 3.33Å; R642-K646 WeakPolarHBondContact O-CG 3.37Å; R642-K646 PolarHBondContact O-N 2.93Å
643	E	86.4	Confident	88.3	Confident	76 Å²	76	46.3 Å²	46.3	36%	0.355	23%	0.231	S	C	.	.	H	α-helix	trans	-71.1	-45.9	176.9	-166.6	56	-148	0	0	110.9	V322 I641 I645 K646 Q647	V322-E643 HydrophobicContact CG1-CG 3.64Å; I641-E643 PolarHBondContact O-N 3Å; E643-I645 VanDerWaalsContact C-N 3.26Å; E643-I645 PolarHBondContact O-N 2.89Å; E643-K646 PolarHBondContact O-N 3.49Å; E643-K646 VanDerWaalsContact O-N 3.08Å; E643-K646 IonicContact OE2-NZ 2.79Å; E643-Q647 HydrophobicContact CG-CG 4.5Å; E643-Q647 VanDerWaalsContact O-CG 3.31Å; E643-Q647 WeakPolarHBondContact O-CG 3.44Å; E643-Q647 PolarHBondContact O-N 3.23Å; E643-Q647 PolarHBondContact OE1-NE2 3.16Å
644	A	87	Confident	88.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.2	-39.7	172.4	0	0	0	0	0	112.6	I641 Q647 V648 F698	I641-A644 HydrophobicContact CB-CB 4.29Å; I641-A644 PolarHBondContact O-N 3.11Å; A644-Q647 PolarHBondContact O-N 3.42Å; A644-V648 PolarHBondContact O-N 3.47Å; A644-F698 HydrophobicContact CB-CD2 4.42Å; A644-F698 HydrophobicContact CB-CE2 4.28Å
645	I	90	Very high	88.2	Confident	16 Å²	16	46.3 Å²	46.3	8%	0.082	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-43.6	175	-69.5	165.5	0	0	0	111.9	I641 E643 V648 N649 Y695 F698 M699 N702	I641-I645 HydrophobicContact CD1-CD1 4.43Å; I641-I645 HydrophobicContact CG1-CD1 4.21Å; I641-I645 WeakPolarHBondContact O-CG1 3.39Å; I641-I645 PolarHBondContact O-N 3.29Å; E643-I645 VanDerWaalsContact C-N 3.26Å; E643-I645 PolarHBondContact O-N 2.89Å; I645-V648 WeakPolarHBondContact O-CG1 3.35Å; I645-N649 PolarHBondContact O-N 3.4Å; I645-Y695 HydrophobicContact CG2-CD2 4.06Å; I645-Y695 HydrophobicContact CG2-CE2 3.5Å; I645-Y695 VanDerWaalsContact CG2-CE2 3.5Å; I645-F698 HydrophobicContact CD1-CB 4.49Å; I645-F698 HydrophobicContact CG1-CB 3.68Å; I645-M699 HydrophobicContact CD1-SD 3.84Å; I645-M699 HydrophobicContact CG1-SD 4.37Å; I645-M699 HydrophobicContact CG2-CG 4.45Å; I645-M699 HydrophobicContact CG2-SD 3.74Å; I645-N702 HydrophobicContact CD1-CB 3.62Å
646	K	88.7	Confident	87.9	Confident	129 Å²	129	49.6 Å²	49.6	56%	0.561	25%	0.251	S	S	*	.	H	α-helix	trans	-64.9	-41.8	176.9	-73.1	172.1	-173	171.4	0	111.5	R642 E643 N649 T650	R642-K646 WeakPolarHBondContact O-CG 3.37Å; R642-K646 PolarHBondContact O-N 2.93Å; E643-K646 PolarHBondContact O-N 3.49Å; E643-K646 VanDerWaalsContact O-N 3.08Å; E643-K646 IonicContact OE2-NZ 2.79Å; K646-N649 PolarHBondContact O-N 3.32Å; K646-T650 PolarHBondContact O-OG1 2.84Å
647	Q	87.1	Confident	87.9	Confident	35 Å²	35	53.2 Å²	53.2	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-72	-41	-176.5	-64.2	-60.8	-26.3	0	0	112.4	V318 V322 F323 E643 A644 N649 T650	V318-Q647 HydrophobicContact CG1-CB 4.41Å; V322-Q647 HydrophobicContact CB-CG 3.92Å; V322-Q647 HydrophobicContact CG1-CG 3.52Å; F323-Q647 HydrophobicContact CE1-CB 4.27Å; F323-Q647 HydrophobicContact CZ-CB 4.29Å; E643-Q647 HydrophobicContact CG-CG 4.5Å; E643-Q647 VanDerWaalsContact O-CG 3.31Å; E643-Q647 WeakPolarHBondContact O-CG 3.44Å; E643-Q647 PolarHBondContact O-N 3.23Å; E643-Q647 PolarHBondContact OE1-NE2 3.16Å; A644-Q647 PolarHBondContact O-N 3.42Å; Q647-N649 PolarHBondContact O-N 3.28Å; Q647-T650 WeakPolarHBondContact O-CB 3.44Å; Q647-T650 PolarHBondContact O-N 3.04Å
648	V	89.3	Confident	88.1	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-29.4	177.1	77.9	0	0	0	0	112.2	F269 F323 A644 I645 T650 R691 I694 Y695 F698	F269-V648 HydrophobicContact CE1-CG2 4.22Å; F269-V648 HydrophobicContact CZ-CG2 4.04Å; F323-V648 HydrophobicContact CD1-CB 4.44Å; F323-V648 HydrophobicContact CE1-CB 3.71Å; F323-V648 HydrophobicContact CE1-CG2 4.11Å; A644-V648 PolarHBondContact O-N 3.47Å; I645-V648 WeakPolarHBondContact O-CG1 3.35Å; V648-T650 VanDerWaalsContact C-N 3.26Å; V648-T650 PolarHBondContact O-N 3.1Å; V648-R691 HydrophobicContact CG2-CB 4.31Å; V648-R691 WeakPolarHBondContact O-CD 3.34Å; V648-R691 PolarHBondContact O-NH1 2.84Å; V648-I694 HydrophobicContact CG2-CB 3.96Å; V648-I694 HydrophobicContact CG2-CG2 3.82Å; V648-Y695 HydrophobicContact CG1-CD2 3.69Å; V648-Y695 HydrophobicContact CG1-CG 4.21Å; V648-F698 HydrophobicContact CB-CD2 4.29Å; V648-F698 HydrophobicContact CB-CE2 4.4Å; V648-F698 HydrophobicContact CG1-CD2 4.1Å
649	N	86.4	Confident	88.6	Confident	104 Å²	104	49.9 Å²	49.9	56%	0.556	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-14.8	177	-160.8	39.1	0	0	0	113	I645 K646 Q647 R691 Y695	I645-N649 PolarHBondContact O-N 3.4Å; K646-N649 PolarHBondContact O-N 3.32Å; Q647-N649 PolarHBondContact O-N 3.28Å; N649-R691 PolarHBondContact O-NH1 3.24Å; N649-Y695 HydrophobicContact CB-CD2 4.13Å; N649-Y695 HydrophobicContact CB-CE2 4.22Å
650	T	88.1	Confident	89.2	Confident	35 Å²	35	54.5 Å²	54.5	22%	0.215	26%	0.264	C	S	.	.	S	Bend	trans	-80.2	132.3	177	-56.2	0	0	0	0	110.2	R317 K646 Q647 V648 R691	R317-T650 HydrophobicContact CG-CG2 3.93Å; K646-T650 PolarHBondContact O-OG1 2.84Å; Q647-T650 WeakPolarHBondContact O-CB 3.44Å; Q647-T650 PolarHBondContact O-N 3.04Å; V648-T650 VanDerWaalsContact C-N 3.26Å; V648-T650 PolarHBondContact O-N 3.1Å; T650-R691 VanDerWaalsContact C-NH1 3.27Å; T650-R691 PolarHBondContact O-NH1 3.24Å; T650-R691 VanDerWaalsContact O-NH1 3.13Å
651	P	89.1	Confident	89.7	Confident	22 Å²	22	51.8 Å²	51.8	14%	0.143	25%	0.25	C	C	.	.			trans	-54.3	144.4	173.6	-26.5	35.1	0	0	0	111.8	T653	P651-T653 PolarHBondContact O-N 3.34Å
652	L	89.3	Confident	90.1	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	25%	0.25	C	S	.	.	S	Bend	trans	-61.5	-29.4	-175.6	-175.5	59.4	0	0	0	112.9	L273 V276 R317 V318 P684 L687 D688	L273-L652 HydrophobicContact CD1-CD1 3.4Å; V276-L652 HydrophobicContact CG1-CD2 3.77Å; R317-L652 PolarHBondContact N-O 2.81Å; V318-L652 HydrophobicContact CG2-CD1 4.5Å; L652-P684 HydrophobicContact CD2-CB 3.85Å; L652-L687 HydrophobicContact CD2-CD2 4.05Å; L652-D688 HydrophobicContact CB-CB 4.48Å; L652-D688 WeakPolarHBondContact CB-OD1 3.33Å; L652-D688 PolarHBondContact N-OD1 2.88Å
653	T	92.3	Very high	90.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-125.9	177.8	178.6	83.9	0	0	0	0	111.8	L280 L314 K315 R317 P651 I655 L658	L280-T653 HydrophobicContact CD2-CG2 3.93Å; L314-T653 HydrophobicContact CD1-CG2 4.37Å; K315-T653 VanDerWaalsContact O-CA 3.23Å; K315-T653 WeakPolarHBondContact O-CA 3.21Å; K315-T653 WeakPolarHBondContact O-CB 3.33Å; R317-T653 WeakPolarHBondContact CD-O 3.24Å; P651-T653 PolarHBondContact O-N 3.34Å; T653-I655 WeakPolarHBondContact OG1-CB 3.42Å; T653-I655 PolarHBondContact OG1-N 3.25Å; T653-I655 PolarHBondContact OG1-O 3.4Å; T653-L658 HydrophobicContact CG2-CD1 4.15Å; T653-L658 HydrophobicContact CG2-CD2 4.16Å; T653-L658 VanDerWaalsContact OG1-CD1 3.3Å; T653-L658 WeakPolarHBondContact OG1-CD1 3.47Å
654	F	92.9	Very high	90.9	Very high	100 Å²	100	48.3 Å²	48.3	44%	0.439	24%	0.243	S	C	.	.	S	Bend	trans	-78.4	-10.4	171.5	-63.3	-85	0	0	0	113	Q313 K315 R317 D656	Q313-F654 HydrophobicContact CB-CB 3.9Å; Q313-F654 HydrophobicContact CG-CB 4.26Å; Q313-F654 WeakPolarHBondContact O-CB 3.39Å; Q313-F654 PolarHBondContact O-N 2.93Å; Q313-F654 VanDerWaalsContact O-N 3.14Å; Q313-F654 PolarHBondContact OE1-O 3.3Å; K315-F654 HydrophobicContact CB-CD2 4.11Å; K315-F654 HydrophobicContact CB-CE2 4.23Å; R317-F654 HydrophobicContact CB-CD2 4.32Å; R317-F654 HydrophobicContact CB-CE1 4.46Å; R317-F654 HydrophobicContact CB-CE2 4.16Å; R317-F654 HydrophobicContact CB-CZ 4.23Å; R317-F654 HydrophobicContact CG-CD1 4.25Å; R317-F654 HydrophobicContact CG-CE1 3.95Å; R317-F654 HydrophobicContact CG-CE2 4.49Å; R317-F654 HydrophobicContact CG-CZ 4.08Å; F654-D656 PolarHBondContact O-N 3.18Å
655	I	92.7	Very high	91.3	Very high	11 Å²	11	48.4 Å²	48.4	6%	0.056	24%	0.243	C	C	.	.			trans	-78.8	112.7	164.8	-56	178.6	0	0	0	106.5	L309 Q313 L314 T653 N657 L658 F661	L309-I655 HydrophobicContact CD1-CG1 4.47Å; L309-I655 HydrophobicContact CG-CD1 4.21Å; Q313-I655 HydrophobicContact CB-CD1 4.38Å; Q313-I655 HydrophobicContact CB-CG1 3.53Å; L314-I655 HydrophobicContact CB-CD1 4.07Å; L314-I655 HydrophobicContact CD1-CD1 4.1Å; T653-I655 WeakPolarHBondContact OG1-CB 3.42Å; T653-I655 PolarHBondContact OG1-N 3.25Å; T653-I655 PolarHBondContact OG1-O 3.4Å; I655-N657 VanDerWaalsContact C-N 3.32Å; I655-N657 PolarHBondContact O-N 2.87Å; I655-L658 HydrophobicContact CB-CD1 4.3Å; I655-L658 WeakPolarHBondContact O-CD1 3.15Å; I655-F661 HydrophobicContact CD1-CB 4.35Å; I655-F661 HydrophobicContact CD1-CD1 3.94Å; I655-F661 HydrophobicContact CD1-CD2 3.95Å; I655-F661 HydrophobicContact CD1-CE1 4.21Å; I655-F661 HydrophobicContact CD1-CE2 4.22Å; I655-F661 HydrophobicContact CD1-CG 3.8Å; I655-F661 HydrophobicContact CD1-CZ 4.35Å; I655-F661 HydrophobicContact CG2-CB 3.94Å
656	D	86.3	Confident	91.5	Very high	113 Å²	113	52.5 Å²	52.5	60%	0.604	26%	0.26	S	S	*	.	S	Bend	trans	-70.3	-29.6	-177.3	-68.3	-37.8	0	0	0	112.3	R317 F654	R317-D656 IonicContact NH1-OD1 2.73Å; R317-D656 PolarHBondContact NH1-OD1 3.36Å; F654-D656 PolarHBondContact O-N 3.18Å
657	N	90.6	Very high	91.7	Very high	78 Å²	78	49.5 Å²	49.5	42%	0.417	26%	0.259	S	S	.	.			trans	-121.3	84.1	178.9	-169.3	-6.3	0	0	0	111.5	I655 D659 E660 F661	I655-N657 VanDerWaalsContact C-N 3.32Å; I655-N657 PolarHBondContact O-N 2.87Å; N657-D659 VanDerWaalsContact C-N 3.25Å; N657-D659 PolarHBondContact O-N 3.14Å; N657-D659 PolarHBondContact OD1-N 2.9Å; N657-E660 HydrophobicContact CB-CB 4.04Å; N657-E660 VanDerWaalsContact CG-CB 3.43Å; N657-E660 VanDerWaalsContact ND2-CB 3.32Å; N657-E660 WeakPolarHBondContact ND2-CB 3.46Å; N657-E660 PolarHBondContact ND2-OE2 3.1Å; N657-E660 PolarHBondContact O-N 3.5Å; N657-E660 PolarHBondContact OD1-N 3.35Å; N657-F661 PolarHBondContact O-N 3.43Å
658	L	91.2	Very high	91.9	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-33	179	-87.9	74	0	0	0	112.8	T653 I655 E660 F661 V662 P684 V685	T653-L658 HydrophobicContact CG2-CD1 4.15Å; T653-L658 HydrophobicContact CG2-CD2 4.16Å; T653-L658 VanDerWaalsContact OG1-CD1 3.3Å; T653-L658 WeakPolarHBondContact OG1-CD1 3.47Å; I655-L658 HydrophobicContact CB-CD1 4.3Å; I655-L658 WeakPolarHBondContact O-CD1 3.15Å; L658-E660 VanDerWaalsContact C-N 3.34Å; L658-F661 PolarHBondContact O-N 3.46Å; L658-V662 WeakPolarHBondContact O-CB 3.43Å; L658-V662 WeakPolarHBondContact O-CG2 3.33Å; L658-V662 PolarHBondContact O-N 3.13Å; L658-P684 HydrophobicContact CD2-CB 3.65Å; L658-P684 HydrophobicContact CD2-CG 4.25Å; L658-V685 HydrophobicContact CB-CG2 3.91Å; L658-V685 HydrophobicContact CD2-CG2 4.32Å
659	D	92.5	Very high	92	Very high	91 Å²	91	54.5 Å²	54.5	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-66.5	-39.4	-178.2	-169.2	70	0	0	0	111.4	N657 V662 S663	N657-D659 VanDerWaalsContact C-N 3.25Å; N657-D659 PolarHBondContact O-N 3.14Å; N657-D659 PolarHBondContact OD1-N 2.9Å; D659-V662 PolarHBondContact O-N 3.12Å; D659-S663 WeakPolarHBondContact O-CB 3.47Å; D659-S663 PolarHBondContact O-N 3Å; D659-S663 PolarHBondContact O-OG 3.34Å
660	E	93.9	Very high	92.2	Very high	110 Å²	110	50.3 Å²	50.3	51%	0.514	26%	0.264	S	S	.	.	H	α-helix	trans	-65.5	-42.8	172.3	179.4	177.9	175.3	0	0	111.9	N657 L658 V662 S663 R664	N657-E660 HydrophobicContact CB-CB 4.04Å; N657-E660 VanDerWaalsContact CG-CB 3.43Å; N657-E660 VanDerWaalsContact ND2-CB 3.32Å; N657-E660 WeakPolarHBondContact ND2-CB 3.46Å; N657-E660 PolarHBondContact ND2-OE2 3.1Å; N657-E660 PolarHBondContact O-N 3.5Å; N657-E660 PolarHBondContact OD1-N 3.35Å; L658-E660 VanDerWaalsContact C-N 3.34Å; E660-V662 VanDerWaalsContact C-N 3.34Å; E660-V662 PolarHBondContact O-N 3.46Å; E660-S663 WeakPolarHBondContact O-CB 3.48Å; E660-S663 PolarHBondContact O-N 3.37Å; E660-S663 VanDerWaalsContact O-N 3.15Å; E660-R664 WeakPolarHBondContact O-CG 3.37Å; E660-R664 PolarHBondContact O-N 3.2Å
661	F	95.2	Very high	92.2	Very high	5 Å²	5	55.9 Å²	55.9	2%	0.022	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-45.2	175.2	175.6	-109.2	0	0	0	112	L287 L306 L309 A310 L314 I655 N657 L658 S663 R664 L665 L680	L287-F661 HydrophobicContact CD2-CE1 4.13Å; L287-F661 HydrophobicContact CD2-CZ 4.05Å; L306-F661 HydrophobicContact CD2-CD2 3.88Å; L306-F661 HydrophobicContact CD2-CE2 3.74Å; L309-F661 HydrophobicContact CB-CE2 4.49Å; L309-F661 HydrophobicContact CD2-CD2 3.65Å; L309-F661 HydrophobicContact CD2-CE2 3.99Å; L309-F661 HydrophobicContact CG-CD2 4.26Å; L309-F661 HydrophobicContact CG-CE2 4.23Å; A310-F661 HydrophobicContact CB-CZ 3.9Å; L314-F661 HydrophobicContact CD1-CE1 4.31Å; L314-F661 HydrophobicContact CD2-CE1 4.16Å; I655-F661 HydrophobicContact CD1-CB 4.35Å; I655-F661 HydrophobicContact CD1-CD1 3.94Å; I655-F661 HydrophobicContact CD1-CD2 3.95Å; I655-F661 HydrophobicContact CD1-CE1 4.21Å; I655-F661 HydrophobicContact CD1-CE2 4.22Å; I655-F661 HydrophobicContact CD1-CG 3.8Å; I655-F661 HydrophobicContact CD1-CZ 4.35Å; I655-F661 HydrophobicContact CG2-CB 3.94Å; N657-F661 PolarHBondContact O-N 3.43Å; L658-F661 PolarHBondContact O-N 3.46Å; F661-S663 VanDerWaalsContact C-N 3.31Å; F661-S663 PolarHBondContact O-N 2.87Å; F661-R664 PolarHBondContact O-N 2.86Å; F661-L665 HydrophobicContact CD1-CD1 4.1Å; F661-L665 HydrophobicContact CE1-CD1 3.56Å; F661-L665 HydrophobicContact CE1-CG 4.35Å; F661-L665 HydrophobicContact CZ-CD1 3.81Å; F661-L665 HydrophobicContact CZ-CD2 4.47Å; F661-L665 HydrophobicContact CZ-CG 4.22Å; F661-L665 PolarHBondContact O-N 3.06Å; F661-L680 HydrophobicContact CE1-CD1 4.1Å
662	V	95.4	Very high	92.3	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-63.5	-37.4	175	165.3	0	0	0	0	111.7	L658 D659 E660 L665 K666 I677 L680 V681 V685	L658-V662 WeakPolarHBondContact O-CB 3.43Å; L658-V662 WeakPolarHBondContact O-CG2 3.33Å; L658-V662 PolarHBondContact O-N 3.13Å; D659-V662 PolarHBondContact O-N 3.12Å; E660-V662 VanDerWaalsContact C-N 3.34Å; E660-V662 PolarHBondContact O-N 3.46Å; V662-L665 PolarHBondContact O-N 2.81Å; V662-K666 HydrophobicContact CG1-CD 4.16Å; V662-K666 HydrophobicContact CG1-CG 4.5Å; V662-K666 WeakPolarHBondContact O-CG 3.42Å; V662-K666 PolarHBondContact O-N 3.41Å; V662-I677 HydrophobicContact CG1-CG2 4.09Å; V662-L680 HydrophobicContact CG2-CB 3.93Å; V662-L680 HydrophobicContact CG2-CD1 4.2Å; V662-V681 HydrophobicContact CG1-CG2 3.7Å; V662-V685 HydrophobicContact CG2-CG2 3.81Å
663	S	96	Very high	92.5	Very high	58 Å²	58	57.4 Å²	57.4	41%	0.406	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-39.8	176.3	-65.6	0	0	0	0	112.2	D659 E660 F661 K666 A667	D659-S663 WeakPolarHBondContact O-CB 3.47Å; D659-S663 PolarHBondContact O-N 3Å; D659-S663 PolarHBondContact O-OG 3.34Å; E660-S663 WeakPolarHBondContact O-CB 3.48Å; E660-S663 PolarHBondContact O-N 3.37Å; E660-S663 VanDerWaalsContact O-N 3.15Å; F661-S663 VanDerWaalsContact C-N 3.31Å; F661-S663 PolarHBondContact O-N 2.87Å; S663-K666 PolarHBondContact O-N 2.89Å; S663-A667 PolarHBondContact O-N 2.96Å
664	R	95.3	Very high	92.6	Very high	94 Å²	94	61.4 Å²	61.4	36%	0.355	33%	0.329	S	S	.	.	H	α-helix	trans	-65.2	-39.9	173.8	-68	178	66.3	-172.1	0.6	112.2	E305 L306 E660 F661 A667	E305-R664 IonicContact OE2-NH2 3.17Å; E305-R664 PolarHBondContact OE2-NH2 2.9Å; L306-R664 HydrophobicContact CD1-CB 4.1Å; L306-R664 HydrophobicContact CD2-CB 3.7Å; L306-R664 HydrophobicContact CG-CB 4.5Å; E660-R664 WeakPolarHBondContact O-CG 3.37Å; E660-R664 PolarHBondContact O-N 3.2Å; F661-R664 PolarHBondContact O-N 2.86Å; R664-A667 PolarHBondContact O-N 3.32Å
665	L	94.9	Very high	92.6	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-43.2	173.2	-72.4	172.6	0	0	0	112	L287 L291 L306 F661 V662 A667 L668 I677 L680	L287-L665 HydrophobicContact CD1-CD1 4.13Å; L287-L665 HydrophobicContact CD1-CD2 3.97Å; L287-L665 HydrophobicContact CD2-CD1 3.95Å; L291-L665 HydrophobicContact CD1-CD2 4.17Å; L291-L665 HydrophobicContact CD2-CD2 4.3Å; L306-L665 HydrophobicContact CB-CD2 4.32Å; L306-L665 HydrophobicContact CD1-CD2 4.17Å; F661-L665 HydrophobicContact CD1-CD1 4.1Å; F661-L665 HydrophobicContact CE1-CD1 3.56Å; F661-L665 HydrophobicContact CE1-CG 4.35Å; F661-L665 HydrophobicContact CZ-CD1 3.81Å; F661-L665 HydrophobicContact CZ-CD2 4.47Å; F661-L665 HydrophobicContact CZ-CG 4.22Å; F661-L665 PolarHBondContact O-N 3.06Å; V662-L665 PolarHBondContact O-N 2.81Å; L665-A667 VanDerWaalsContact C-N 3.29Å; L665-A667 PolarHBondContact O-N 3.41Å; L665-L668 HydrophobicContact CD2-CD1 4.43Å; L665-L668 WeakPolarHBondContact O-CB 3.21Å; L665-L668 PolarHBondContact O-N 3.24Å; L665-I677 HydrophobicContact CB-CD1 4.01Å; L665-I677 HydrophobicContact CB-CG1 3.95Å; L665-I677 HydrophobicContact CD1-CG1 4.48Å; L665-L680 HydrophobicContact CD1-CD1 3.82Å
666	K	94.1	Very high	92.6	Very high	103 Å²	103	59.9 Å²	59.9	45%	0.448	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-38.8	176.1	-74.7	172.9	-179.5	172.5	0	111.7	V662 S663 L668 N669 I677	V662-K666 HydrophobicContact CG1-CD 4.16Å; V662-K666 HydrophobicContact CG1-CG 4.5Å; V662-K666 WeakPolarHBondContact O-CG 3.42Å; V662-K666 PolarHBondContact O-N 3.41Å; S663-K666 PolarHBondContact O-N 2.89Å; K666-L668 PolarHBondContact O-N 3.49Å; K666-L668 VanDerWaalsContact O-N 3.17Å; K666-N669 PolarHBondContact O-N 3.22Å; K666-N669 PolarHBondContact O-OD1 2.91Å; K666-I677 HydrophobicContact CD-CG2 4.27Å; K666-I677 VanDerWaalsContact CE-CG2 3.47Å; K666-I677 HydrophobicContact CG-CD1 3.97Å; K666-I677 HydrophobicContact CG-CG2 3.81Å
667	A	93.1	Very high	93	Very high	65 Å²	65	55.3 Å²	55.3	54%	0.537	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-17.7	178.7	0	0	0	0	0	114.2	K299 S663 R664 L665 N669	K299-A667 PolarHBondContact NZ-O 3.49Å; S663-A667 PolarHBondContact O-N 2.96Å; R664-A667 PolarHBondContact O-N 3.32Å; L665-A667 VanDerWaalsContact C-N 3.29Å; L665-A667 PolarHBondContact O-N 3.41Å; A667-N669 PolarHBondContact O-N 2.89Å
668	L	92.1	Very high	93.2	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.042	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.8	171	-61.8	178.1	0	0	0	112.3	L291 K299 E302 L306 L665 K666 M670 L673	L291-L668 HydrophobicContact CD2-CD1 3.6Å; K299-L668 HydrophobicContact CB-CD2 4.2Å; K299-L668 HydrophobicContact CD-CD2 4.02Å; K299-L668 PolarHBondContact NZ-O 3.46Å; E302-L668 HydrophobicContact CB-CD2 3.98Å; L306-L668 HydrophobicContact CD1-CD1 3.82Å; L306-L668 HydrophobicContact CD1-CD2 4.33Å; L306-L668 HydrophobicContact CD1-CG 4.1Å; L665-L668 HydrophobicContact CD2-CD1 4.43Å; L665-L668 WeakPolarHBondContact O-CB 3.21Å; L665-L668 PolarHBondContact O-N 3.24Å; K666-L668 PolarHBondContact O-N 3.49Å; K666-L668 VanDerWaalsContact O-N 3.17Å; L668-M670 HydrophobicContact CB-CG 4.11Å; L668-M670 HydrophobicContact CB-SD 3.92Å; L668-M670 HydrophobicContact CD1-SD 4.19Å; L668-M670 PolarHBondContact O-N 3.23Å; L668-L673 HydrophobicContact CB-CD1 4.06Å; L668-L673 HydrophobicContact CD1-CD1 3.6Å; L668-L673 HydrophobicContact CG-CD1 4.45Å
669	N	90.2	Very high	93.3	Very high	133 Å²	133	57.5 Å²	57.5	71%	0.711	32%	0.32	S	S	*	.			trans	52.4	38.2	178.8	-65.7	-27.6	0	0	0	113.3	K666 A667	K666-N669 PolarHBondContact O-N 3.22Å; K666-N669 PolarHBondContact O-OD1 2.91Å; A667-N669 PolarHBondContact O-N 2.89Å
670	M	90.6	Very high	93.4	Very high	17 Å²	17	53.2 Å²	53.2	8%	0.084	30%	0.297	C	S	.	.			trans	-101.2	119.7	-179.5	-65.9	167.4	56.6	0	0	110.5	G294 P296 L668 S672 L673	G294-M670 WeakPolarHBondContact O-CE 3.47Å; P296-M670 HydrophobicContact CG-CG 4.24Å; P296-M670 HydrophobicContact CG-SD 4.49Å; L668-M670 HydrophobicContact CB-CG 4.11Å; L668-M670 HydrophobicContact CB-SD 3.92Å; L668-M670 HydrophobicContact CD1-SD 4.19Å; L668-M670 PolarHBondContact O-N 3.23Å; M670-S672 PolarHBondContact O-N 3.44Å; M670-L673 HydrophobicContact CB-CB 4.35Å; M670-L673 HydrophobicContact CB-CD1 3.93Å; M670-L673 HydrophobicContact CB-CG 3.99Å; M670-L673 HydrophobicContact CE-CD1 4.21Å; M670-L673 HydrophobicContact CE-CG 4.2Å; M670-L673 HydrophobicContact CG-CD1 4.35Å; M670-L673 PolarHBondContact O-N 2.92Å; M670-L673 HydrophobicContact SD-CD1 3.78Å; M670-L673 HydrophobicContact SD-CG 4.39Å
671	N	89.6	Confident	93.5	Very high	152 Å²	152	49.8 Å²	49.8	81%	0.813	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-59.4	-29.9	178.6	-68.3	-19.8	0	0	0	113.2	L673 T674	N671-L673 VanDerWaalsContact C-N 3.27Å; N671-L673 PolarHBondContact O-N 2.83Å; N671-T674 WeakPolarHBondContact O-CB 3.35Å; N671-T674 PolarHBondContact O-N 2.75Å; N671-T674 PolarHBondContact O-OG1 3.41Å
672	S	91.3	Very high	93.4	Very high	58 Å²	58	54.1 Å²	54.1	41%	0.406	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-65.4	-28.6	176.4	51.7	0	0	0	0	112.9	M670 H676	M670-S672 PolarHBondContact O-N 3.44Å; S672-H676 PolarHBondContact O-CD2 2.9Å
673	L	93.2	Very high	93.3	Very high	0 Å²	0	55 Å²	55	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-79.9	-18.8	179.5	-69	176.6	0	0	0	113.4	L287 T290 L291 L668 M670 N671 S675 H676 I677	L287-L673 HydrophobicContact CD1-CD2 3.59Å; T290-L673 HydrophobicContact CG2-CD2 3.78Å; T290-L673 HydrophobicContact CG2-CG 4.36Å; L291-L673 HydrophobicContact CD2-CD1 3.98Å; L291-L673 HydrophobicContact CD2-CD2 4.04Å; L291-L673 HydrophobicContact CG-CD2 4.23Å; L668-L673 HydrophobicContact CB-CD1 4.06Å; L668-L673 HydrophobicContact CD1-CD1 3.6Å; L668-L673 HydrophobicContact CG-CD1 4.45Å; M670-L673 HydrophobicContact CB-CB 4.35Å; M670-L673 HydrophobicContact CB-CD1 3.93Å; M670-L673 HydrophobicContact CB-CG 3.99Å; M670-L673 HydrophobicContact CE-CD1 4.21Å; M670-L673 HydrophobicContact CE-CG 4.2Å; M670-L673 HydrophobicContact CG-CD1 4.35Å; M670-L673 PolarHBondContact O-N 2.92Å; M670-L673 HydrophobicContact SD-CD1 3.78Å; M670-L673 HydrophobicContact SD-CG 4.39Å; N671-L673 VanDerWaalsContact C-N 3.27Å; N671-L673 PolarHBondContact O-N 2.83Å; L673-S675 VanDerWaalsContact C-N 3.31Å; L673-S675 PolarHBondContact O-N 2.93Å; L673-H676 PolarHBondContact O-N 2.77Å; L673-I677 HydrophobicContact CB-CD1 3.81Å; L673-I677 HydrophobicContact CB-CG1 4.31Å; L673-I677 WeakPolarHBondContact O-CG1 3.44Å; L673-I677 PolarHBondContact O-N 3.21Å
674	T	93	Very high	93.1	Very high	84 Å²	84	52.3 Å²	52.3	52%	0.515	30%	0.297	S	S	.	.	H	α-helix	trans	-52.5	-45.9	-172.1	-56.4	0	0	0	0	113	N671 H676 I677 Q678	N671-T674 WeakPolarHBondContact O-CB 3.35Å; N671-T674 PolarHBondContact O-N 2.75Å; N671-T674 PolarHBondContact O-OG1 3.41Å; T674-H676 PolarHBondContact O-N 3.37Å; T674-I677 PolarHBondContact O-N 3.04Å; T674-Q678 WeakPolarHBondContact O-CB 3.48Å; T674-Q678 PolarHBondContact O-N 3.07Å
675	S	93.1	Very high	93	Very high	67 Å²	67	48.8 Å²	48.8	47%	0.469	29%	0.286	S	S	.	.	H	α-helix	trans	-67.2	-35.6	-180	68.7	0	0	0	0	113	L673 A679	L673-S675 VanDerWaalsContact C-N 3.31Å; L673-S675 PolarHBondContact O-N 2.93Å; S675-A679 PolarHBondContact O-N 2.92Å; S675-A679 VanDerWaalsContact O-N 3.09Å
676	H	93.6	Very high	92.9	Very high	12 Å²	12	54 Å²	54	6%	0.056	31%	0.309	C	S	.	.	H	α-helix	trans	-72.6	-41.8	178.1	-53.4	-45.1	0	0	0	111.4	L287 T290 S672 L673 T674 Q678 A679 L680	L287-H676 HydrophobicContact CD1-CB 4.15Å; T290-H676 PolarHBondContact OG1-NE2 3.43Å; T290-H676 VanDerWaalsContact OG1-NE2 3.17Å; S672-H676 PolarHBondContact O-CD2 2.9Å; L673-H676 PolarHBondContact O-N 2.77Å; T674-H676 PolarHBondContact O-N 3.37Å; H676-Q678 VanDerWaalsContact C-N 3.34Å; H676-A679 PolarHBondContact O-N 3.12Å; H676-L680 WeakPolarHBondContact O-CG 3.47Å; H676-L680 PolarHBondContact O-N 3.21Å
677	I	94.3	Very high	92.8	Very high	16 Å²	16	49.5 Å²	49.5	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-59.5	-46.7	173.9	-71.9	167.8	0	0	0	110	V662 L665 K666 L673 T674 A679 L680 V681	V662-I677 HydrophobicContact CG1-CG2 4.09Å; L665-I677 HydrophobicContact CB-CD1 4.01Å; L665-I677 HydrophobicContact CB-CG1 3.95Å; L665-I677 HydrophobicContact CD1-CG1 4.48Å; K666-I677 HydrophobicContact CD-CG2 4.27Å; K666-I677 VanDerWaalsContact CE-CG2 3.47Å; K666-I677 HydrophobicContact CG-CD1 3.97Å; K666-I677 HydrophobicContact CG-CG2 3.81Å; L673-I677 HydrophobicContact CB-CD1 3.81Å; L673-I677 HydrophobicContact CB-CG1 4.31Å; L673-I677 WeakPolarHBondContact O-CG1 3.44Å; L673-I677 PolarHBondContact O-N 3.21Å; T674-I677 PolarHBondContact O-N 3.04Å; I677-A679 PolarHBondContact O-N 2.9Å; I677-L680 PolarHBondContact O-N 2.82Å; I677-V681 HydrophobicContact CG2-CG2 4.43Å; I677-V681 WeakPolarHBondContact O-CG2 3.47Å; I677-V681 PolarHBondContact O-N 3.41Å
678	Q	94.5	Very high	92.7	Very high	95 Å²	95	47.6 Å²	47.6	44%	0.444	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-42.3	179.5	-168.8	60.9	31.1	0	0	111.8	T674 H676 L680 V681 D682	T674-Q678 WeakPolarHBondContact O-CB 3.48Å; T674-Q678 PolarHBondContact O-N 3.07Å; H676-Q678 VanDerWaalsContact C-N 3.34Å; Q678-L680 VanDerWaalsContact C-N 3.31Å; Q678-L680 PolarHBondContact O-N 3.39Å; Q678-V681 PolarHBondContact O-N 3.49Å; Q678-D682 WeakPolarHBondContact CG-OD2 3.34Å; Q678-D682 PolarHBondContact NE2-OD1 3.15Å; Q678-D682 PolarHBondContact NE2-OD2 3.16Å; Q678-D682 WeakPolarHBondContact O-CB 3.11Å; Q678-D682 PolarHBondContact O-N 3.3Å
679	A	94.2	Very high	92.6	Very high	38 Å²	38	51 Å²	51	31%	0.314	30%	0.299	S	S	.	.	H	α-helix	trans	-61.5	-36.8	175.3	0	0	0	0	0	112.8	I283 S675 H676 I677 G683	I283-A679 HydrophobicContact CD1-CB 3.95Å; I283-A679 HydrophobicContact CG1-CB 4.21Å; S675-A679 PolarHBondContact O-N 2.92Å; S675-A679 VanDerWaalsContact O-N 3.09Å; H676-A679 PolarHBondContact O-N 3.12Å; I677-A679 PolarHBondContact O-N 2.9Å; A679-G683 PolarHBondContact O-N 2.94Å
680	L	94.8	Very high	92.6	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-67.9	-41.3	173.1	-72.4	174.2	0	0	0	112.5	L280 I283 L287 L314 F661 V662 L665 H676 I677 Q678 P684 V685	L280-L680 HydrophobicContact CD1-CD2 4.18Å; I283-L680 HydrophobicContact CG2-CD2 3.72Å; I283-L680 HydrophobicContact CG2-CG 3.91Å; L287-L680 HydrophobicContact CD2-CD1 4.13Å; L314-L680 HydrophobicContact CD1-CD2 4.17Å; L314-L680 HydrophobicContact CD2-CD2 4.1Å; F661-L680 HydrophobicContact CE1-CD1 4.1Å; V662-L680 HydrophobicContact CG2-CB 3.93Å; V662-L680 HydrophobicContact CG2-CD1 4.2Å; L665-L680 HydrophobicContact CD1-CD1 3.82Å; H676-L680 WeakPolarHBondContact O-CG 3.47Å; H676-L680 PolarHBondContact O-N 3.21Å; I677-L680 PolarHBondContact O-N 2.82Å; Q678-L680 VanDerWaalsContact C-N 3.31Å; Q678-L680 PolarHBondContact O-N 3.39Å; L680-P684 HydrophobicContact CB-CG 4.45Å; L680-P684 HydrophobicContact CD2-CG 3.8Å; L680-P684 WeakPolarHBondContact O-CD 3.21Å; L680-P684 VanDerWaalsContact O-CG 3.27Å; L680-P684 WeakPolarHBondContact O-CG 3.49Å; L680-V685 WeakPolarHBondContact O-CB 3.11Å; L680-V685 VanDerWaalsContact O-CG2 3.28Å; L680-V685 WeakPolarHBondContact O-CG2 3.34Å; L680-V685 PolarHBondContact O-N 2.92Å
681	V	95.2	Very high	92.6	Very high	37 Å²	37	47.9 Å²	47.9	22%	0.224	28%	0.281	C	S	.	.	I	π-helix	trans	-65.2	-50.4	179	170.7	0	0	0	0	110.9	V662 I677 Q678 G683 K686	V662-V681 HydrophobicContact CG1-CG2 3.7Å; I677-V681 HydrophobicContact CG2-CG2 4.43Å; I677-V681 WeakPolarHBondContact O-CG2 3.47Å; I677-V681 PolarHBondContact O-N 3.41Å; Q678-V681 PolarHBondContact O-N 3.49Å; V681-G683 PolarHBondContact O-N 3.4Å; V681-K686 WeakPolarHBondContact O-CB 3.5Å; V681-K686 PolarHBondContact O-N 3.18Å; V681-K686 VanDerWaalsContact O-N 3.16Å
682	D	93.7	Very high	92.7	Very high	96 Å²	96	42.8 Å²	42.8	51%	0.513	26%	0.264	S	S	.	.	I	π-helix	trans	-74.1	-25.9	-173	-70.4	-22.8	0	0	0	113.5	Q678	Q678-D682 WeakPolarHBondContact CG-OD2 3.34Å; Q678-D682 PolarHBondContact NE2-OD1 3.15Å; Q678-D682 PolarHBondContact NE2-OD2 3.16Å; Q678-D682 WeakPolarHBondContact O-CB 3.11Å; Q678-D682 PolarHBondContact O-N 3.3Å
683	G	92.4	Very high	92.8	Very high	20 Å²	20	44.7 Å²	44.7	21%	0.206	27%	0.27	C	S	.	.	I	π-helix	trans	-98.7	-96	177.4	0	0	0	0	0	112.6	A679 V681 V685 K686 L687	A679-G683 PolarHBondContact O-N 2.94Å; V681-G683 PolarHBondContact O-N 3.4Å; G683-V685 PolarHBondContact O-N 3.16Å; G683-K686 PolarHBondContact O-N 3.42Å; G683-L687 WeakPolarHBondContact O-CB 3.49Å; G683-L687 PolarHBondContact O-N 3.32Å
684	P	92.1	Very high	92.8	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	27%	0.271	C	S	.	.	I	π-helix	trans	-64.4	-38.2	-167.2	24.4	-34.8	0	0	0	114.5	V276 L280 L652 L658 L680 D688	V276-P684 HydrophobicContact CG1-CB 3.89Å; L280-P684 HydrophobicContact CD1-CB 4.47Å; L280-P684 HydrophobicContact CD1-CG 4.11Å; L652-P684 HydrophobicContact CD2-CB 3.85Å; L658-P684 HydrophobicContact CD2-CB 3.65Å; L658-P684 HydrophobicContact CD2-CG 4.25Å; L680-P684 HydrophobicContact CB-CG 4.45Å; L680-P684 HydrophobicContact CD2-CG 3.8Å; L680-P684 WeakPolarHBondContact O-CD 3.21Å; L680-P684 VanDerWaalsContact O-CG 3.27Å; L680-P684 WeakPolarHBondContact O-CG 3.49Å; P684-D688 VanDerWaalsContact O-CB 3.27Å; P684-D688 WeakPolarHBondContact O-CB 3.3Å; P684-D688 PolarHBondContact O-N 3.45Å
685	V	93.4	Very high	92.8	Very high	21 Å²	21	44.6 Å²	44.6	13%	0.127	26%	0.261	C	S	.	.	I	π-helix	trans	-64.9	-51.2	178.1	174.6	0	0	0	0	110.7	L658 V662 L680 G683 L687 D688 A689	L658-V685 HydrophobicContact CB-CG2 3.91Å; L658-V685 HydrophobicContact CD2-CG2 4.32Å; V662-V685 HydrophobicContact CG2-CG2 3.81Å; L680-V685 WeakPolarHBondContact O-CB 3.11Å; L680-V685 VanDerWaalsContact O-CG2 3.28Å; L680-V685 WeakPolarHBondContact O-CG2 3.34Å; L680-V685 PolarHBondContact O-N 2.92Å; G683-V685 PolarHBondContact O-N 3.16Å; V685-L687 VanDerWaalsContact C-N 3.32Å; V685-L687 PolarHBondContact O-N 3.46Å; V685-D688 PolarHBondContact O-N 3.48Å; V685-A689 PolarHBondContact O-N 3.26Å
686	K	92.9	Very high	92.9	Very high	111 Å²	111	45.4 Å²	45.4	48%	0.483	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-43.3	179.3	-175.2	-177.6	-177.3	-171.9	0	111.5	V681 G683 A689 T690	V681-K686 WeakPolarHBondContact O-CB 3.5Å; V681-K686 PolarHBondContact O-N 3.18Å; V681-K686 VanDerWaalsContact O-N 3.16Å; G683-K686 PolarHBondContact O-N 3.42Å; K686-A689 PolarHBondContact O-N 3.1Å; K686-T690 PolarHBondContact O-N 3.39Å
687	L	91.8	Very high	92.9	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-45.5	178.2	-175.2	64	0	0	0	111.7	F269 L273 V276 L652 G683 V685 A689 T690	F269-L687 HydrophobicContact CD2-CD1 3.4Å; F269-L687 HydrophobicContact CD2-CG 4.3Å; F269-L687 HydrophobicContact CE2-CD1 3.63Å; F269-L687 HydrophobicContact CE2-CG 4.04Å; F269-L687 HydrophobicContact CG-CD1 4.2Å; L273-L687 VanDerWaalsContact CA-CD2 3.45Å; L273-L687 HydrophobicContact CB-CD2 3.95Å; L273-L687 HydrophobicContact CD1-CD2 4.04Å; V276-L687 HydrophobicContact CB-CD2 4.29Å; V276-L687 HydrophobicContact CG2-CD2 4.02Å; L652-L687 HydrophobicContact CD2-CD2 4.05Å; G683-L687 WeakPolarHBondContact O-CB 3.49Å; G683-L687 PolarHBondContact O-N 3.32Å; V685-L687 VanDerWaalsContact C-N 3.32Å; V685-L687 PolarHBondContact O-N 3.46Å; L687-A689 PolarHBondContact O-N 3.43Å; L687-T690 PolarHBondContact O-N 2.85Å; L687-T690 PolarHBondContact O-OG1 2.71Å
688	D	89.9	Confident	92.9	Very high	25 Å²	25	45.1 Å²	45.1	13%	0.134	26%	0.262	C	S	.	.	H	α-helix	trans	-59.1	-37.9	178.9	-160.5	85.1	0	0	0	111.5	L652 P684 V685 T690 R691	L652-D688 HydrophobicContact CB-CB 4.48Å; L652-D688 WeakPolarHBondContact CB-OD1 3.33Å; L652-D688 PolarHBondContact N-OD1 2.88Å; P684-D688 VanDerWaalsContact O-CB 3.27Å; P684-D688 WeakPolarHBondContact O-CB 3.3Å; P684-D688 PolarHBondContact O-N 3.45Å; V685-D688 PolarHBondContact O-N 3.48Å; D688-T690 PolarHBondContact O-N 3.05Å; D688-R691 WeakPolarHBondContact O-CB 3.23Å; D688-R691 VanDerWaalsContact O-CG 3.26Å; D688-R691 WeakPolarHBondContact O-CG 3.44Å; D688-R691 PolarHBondContact O-N 3.21Å; D688-R691 PolarHBondContact O-NE 3.07Å; D688-R691 WeakPolarHBondContact OD1-CD 3.37Å; D688-R691 IonicContact OD1-CZ 3.44Å; D688-R691 IonicContact OD1-NE 2.78Å; D688-R691 PolarHBondContact OD1-NE 2.78Å; D688-R691 IonicContact OD1-NH2 3.6Å; D688-R691 IonicContact OD2-CZ 3.48Å; D688-R691 IonicContact OD2-NE 3.85Å; D688-R691 PolarHBondContact OD2-NE 3.09Å; D688-R691 VanDerWaalsContact OD2-NE 3.12Å; D688-R691 IonicContact OD2-NH2 2.6Å; D688-R691 PolarHBondContact OD2-NH2 3.45Å; D688-R691 VanDerWaalsContact OD2-NH2 3.1Å
689	A	90.5	Very high	92.8	Very high	79 Å²	79	44.7 Å²	44.7	65%	0.653	26%	0.261	S	S	*	.	H	α-helix	trans	-63.3	-24.7	176.3	0	0	0	0	0	114	V685 K686 L687	V685-A689 PolarHBondContact O-N 3.26Å; K686-A689 PolarHBondContact O-N 3.1Å; L687-A689 PolarHBondContact O-N 3.43Å
690	T	91.2	Very high	92.8	Very high	39 Å²	39	47.5 Å²	47.5	24%	0.239	26%	0.264	C	S	.	.	H	α-helix	trans	-83.8	-12	178.5	64.6	0	0	0	0	114	F269 K686 L687 D688 G692 N693 I694	F269-T690 WeakPolarHBondContact CD2-OG1 3.33Å; K686-T690 PolarHBondContact O-N 3.39Å; L687-T690 PolarHBondContact O-N 2.85Å; L687-T690 PolarHBondContact O-OG1 2.71Å; D688-T690 PolarHBondContact O-N 3.05Å; T690-G692 VanDerWaalsContact C-N 3.27Å; T690-G692 PolarHBondContact O-N 3.44Å; T690-N693 PolarHBondContact O-N 3.22Å; T690-N693 VanDerWaalsContact O-N 3.08Å; T690-I694 PolarHBondContact O-N 3Å
691	R	90	Very high	92.7	Very high	45 Å²	45	47.6 Å²	47.6	17%	0.17	26%	0.264	C	S	.	.	H	α-helix	trans	-55.6	-39.4	-175.5	-69.9	-176.2	-47.6	117.1	-6	113.1	F269 V648 N649 T650 D688 N693 I694 Y695	F269-R691 HydrophobicContact CE2-CG 3.96Å; F269-R691 HydrophobicContact CZ-CG 4.1Å; V648-R691 HydrophobicContact CG2-CB 4.31Å; V648-R691 WeakPolarHBondContact O-CD 3.34Å; V648-R691 PolarHBondContact O-NH1 2.84Å; N649-R691 PolarHBondContact O-NH1 3.24Å; T650-R691 VanDerWaalsContact C-NH1 3.27Å; T650-R691 PolarHBondContact O-NH1 3.24Å; T650-R691 VanDerWaalsContact O-NH1 3.13Å; D688-R691 WeakPolarHBondContact O-CB 3.23Å; D688-R691 VanDerWaalsContact O-CG 3.26Å; D688-R691 WeakPolarHBondContact O-CG 3.44Å; D688-R691 PolarHBondContact O-N 3.21Å; D688-R691 PolarHBondContact O-NE 3.07Å; D688-R691 WeakPolarHBondContact OD1-CD 3.37Å; D688-R691 IonicContact OD1-CZ 3.44Å; D688-R691 IonicContact OD1-NE 2.78Å; D688-R691 PolarHBondContact OD1-NE 2.78Å; D688-R691 IonicContact OD1-NH2 3.6Å; D688-R691 IonicContact OD2-CZ 3.48Å; D688-R691 IonicContact OD2-NE 3.85Å; D688-R691 PolarHBondContact OD2-NE 3.09Å; D688-R691 VanDerWaalsContact OD2-NE 3.12Å; D688-R691 IonicContact OD2-NH2 2.6Å; D688-R691 PolarHBondContact OD2-NH2 3.45Å; D688-R691 VanDerWaalsContact OD2-NH2 3.1Å; R691-N693 PolarHBondContact O-N 2.91Å; R691-I694 PolarHBondContact O-N 2.76Å; R691-Y695 VanDerWaalsContact O-CB 3.31Å; R691-Y695 WeakPolarHBondContact O-CB 3.45Å; R691-Y695 PolarHBondContact O-N 3.27Å
692	G	90.8	Very high	92.5	Very high	45 Å²	45	47.4 Å²	47.4	46%	0.464	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-44.8	178.4	0	0	0	0	0	112.5	T690 Y695 T696	T690-G692 VanDerWaalsContact C-N 3.27Å; T690-G692 PolarHBondContact O-N 3.44Å; G692-Y695 WeakPolarHBondContact O-CB 3.25Å; G692-Y695 PolarHBondContact O-N 3.48Å; G692-T696 WeakPolarHBondContact O-CG2 3.49Å; G692-T696 PolarHBondContact O-N 3.3Å; G692-T696 VanDerWaalsContact O-N 3.09Å
693	N	93.6	Very high	92.5	Very high	98 Å²	98	44.3 Å²	44.3	52%	0.524	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-46.2	177.4	-68.3	-8.6	0	0	0	110.8	T690 R691 Y695 T696 L697	T690-N693 PolarHBondContact O-N 3.22Å; T690-N693 VanDerWaalsContact O-N 3.08Å; R691-N693 PolarHBondContact O-N 2.91Å; N693-Y695 VanDerWaalsContact C-N 3.32Å; N693-Y695 PolarHBondContact O-N 2.85Å; N693-T696 PolarHBondContact O-N 2.62Å; N693-T696 VanDerWaalsContact O-N 3.12Å; N693-T696 PolarHBondContact O-OG1 2.91Å; N693-L697 PolarHBondContact O-N 3.34Å
694	I	93.3	Very high	92.6	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-37.8	178.8	-57.6	-56.5	0	0	0	111.7	Q265 I266 F269 V648 T690 R691 T696 L697 F698	Q265-I694 HydrophobicContact CB-CD1 4.02Å; I266-I694 HydrophobicContact CG1-CD1 4.48Å; F269-I694 HydrophobicContact CB-CD1 3.88Å; F269-I694 HydrophobicContact CB-CG1 3.82Å; F269-I694 HydrophobicContact CD1-CG1 4.31Å; F269-I694 HydrophobicContact CD1-CG2 4.09Å; F269-I694 HydrophobicContact CD2-CG1 3.7Å; F269-I694 HydrophobicContact CE1-CG2 4.42Å; F269-I694 HydrophobicContact CE2-CG1 4.35Å; F269-I694 HydrophobicContact CG-CB 4.45Å; F269-I694 HydrophobicContact CG-CD1 4.3Å; F269-I694 HydrophobicContact CG-CG1 3.68Å; F269-I694 HydrophobicContact CG-CG2 4.3Å; V648-I694 HydrophobicContact CG2-CB 3.96Å; V648-I694 HydrophobicContact CG2-CG2 3.82Å; T690-I694 PolarHBondContact O-N 3Å; R691-I694 PolarHBondContact O-N 2.76Å; I694-T696 VanDerWaalsContact C-N 3.34Å; I694-T696 PolarHBondContact O-N 3.37Å; I694-L697 HydrophobicContact CD1-CD1 4.2Å; I694-L697 PolarHBondContact O-N 2.92Å; I694-F698 HydrophobicContact CG2-CD2 3.8Å; I694-F698 HydrophobicContact CG2-CE2 3.48Å; I694-F698 VanDerWaalsContact CG2-CE2 3.48Å; I694-F698 HydrophobicContact CG2-CZ 4.01Å; I694-F698 PolarHBondContact O-N 3.43Å
695	Y	93.5	Very high	92.7	Very high	78 Å²	78	44 Å²	44	31%	0.306	24%	0.242	S	C	.	.	H	α-helix	trans	-56.4	-46.9	171.5	178.2	-92.5	0	0	0	111.5	I645 V648 N649 R691 G692 N693 L697 F698 M699	I645-Y695 HydrophobicContact CG2-CD2 4.06Å; I645-Y695 HydrophobicContact CG2-CE2 3.5Å; I645-Y695 VanDerWaalsContact CG2-CE2 3.5Å; V648-Y695 HydrophobicContact CG1-CD2 3.69Å; V648-Y695 HydrophobicContact CG1-CG 4.21Å; N649-Y695 HydrophobicContact CB-CD2 4.13Å; N649-Y695 HydrophobicContact CB-CE2 4.22Å; R691-Y695 VanDerWaalsContact O-CB 3.31Å; R691-Y695 WeakPolarHBondContact O-CB 3.45Å; R691-Y695 PolarHBondContact O-N 3.27Å; G692-Y695 WeakPolarHBondContact O-CB 3.25Å; G692-Y695 PolarHBondContact O-N 3.48Å; N693-Y695 VanDerWaalsContact C-N 3.32Å; N693-Y695 PolarHBondContact O-N 2.85Å; Y695-L697 VanDerWaalsContact C-N 3.32Å; Y695-L697 PolarHBondContact O-N 2.67Å; Y695-F698 PolarHBondContact O-N 3.33Å; Y695-M699 HydrophobicContact CD1-CG 4.07Å; Y695-M699 HydrophobicContact CE1-CG 3.64Å; Y695-M699 HydrophobicContact CE1-SD 4.5Å; Y695-M699 HydrophobicContact CE2-CG 4.25Å; Y695-M699 WeakPolarHBondContact O-CB 3.3Å; Y695-M699 VanDerWaalsContact O-CG 3.31Å; Y695-M699 WeakPolarHBondContact O-CG 3.25Å; Y695-M699 PolarHBondContact O-N 3.37Å
696	T	94.9	Very high	92.8	Very high	84 Å²	84	48.2 Å²	48.2	52%	0.515	26%	0.264	S	S	.	.	H	α-helix	trans	-63.8	-37	177.4	65.6	0	0	0	0	112.7	G692 N693 I694 M699 R700	G692-T696 WeakPolarHBondContact O-CG2 3.49Å; G692-T696 PolarHBondContact O-N 3.3Å; G692-T696 VanDerWaalsContact O-N 3.09Å; N693-T696 PolarHBondContact O-N 2.62Å; N693-T696 VanDerWaalsContact O-N 3.12Å; N693-T696 PolarHBondContact O-OG1 2.91Å; I694-T696 VanDerWaalsContact C-N 3.34Å; I694-T696 PolarHBondContact O-N 3.37Å; T696-M699 PolarHBondContact O-N 3.04Å; T696-R700 WeakPolarHBondContact O-CB 3.46Å; T696-R700 PolarHBondContact O-N 2.94Å
697	L	94.4	Very high	92.9	Very high	22 Å²	22	45.5 Å²	45.5	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-66	-46.6	175.9	-67.2	-180	0	0	0	111.4	F256 A262 Q265 I266 N693 I694 Y695 M699 R700 F701	F256-L697 HydrophobicContact CE1-CB 4.4Å; F256-L697 WeakPolarHBondContact CZ-O 3.27Å; A262-L697 HydrophobicContact CB-CD1 4.19Å; A262-L697 HydrophobicContact CB-CD2 3.8Å; Q265-L697 HydrophobicContact CB-CD1 3.97Å; I266-L697 HydrophobicContact CD1-CB 4.19Å; I266-L697 HydrophobicContact CD1-CD1 4.44Å; I266-L697 HydrophobicContact CG1-CB 4.43Å; I266-L697 HydrophobicContact CG1-CD1 4.09Å; N693-L697 PolarHBondContact O-N 3.34Å; I694-L697 HydrophobicContact CD1-CD1 4.2Å; I694-L697 PolarHBondContact O-N 2.92Å; Y695-L697 VanDerWaalsContact C-N 3.32Å; Y695-L697 PolarHBondContact O-N 2.67Å; L697-M699 PolarHBondContact O-N 3.14Å; L697-R700 PolarHBondContact O-N 2.64Å; L697-F701 WeakPolarHBondContact O-CB 3.23Å; L697-F701 PolarHBondContact O-N 3.23Å
698	F	92.9	Very high	93	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-41.3	175.8	-75.3	-33	0	0	0	112.2	I266 F323 I325 V328 I641 A644 I645 V648 I694 Y695 R700 F701 N702	I266-F698 HydrophobicContact CD1-CD1 4.26Å; I266-F698 HydrophobicContact CD1-CE1 4.02Å; I266-F698 HydrophobicContact CG1-CE1 4.24Å; I266-F698 HydrophobicContact CG2-CE1 4.1Å; I266-F698 HydrophobicContact CG2-CZ 4.29Å; F323-F698 AromaticContact CD1-CE2 3.97Å; F323-F698 HydrophobicContact CD1-CE2 3.97Å; F323-F698 HydrophobicContact CD1-CZ 4.48Å; I325-F698 HydrophobicContact CD1-CE1 4.44Å; I325-F698 HydrophobicContact CD1-CZ 3.95Å; V328-F698 HydrophobicContact CG2-CE1 4.2Å; I641-F698 HydrophobicContact CD1-CB 3.77Å; I641-F698 HydrophobicContact CD1-CD1 3.71Å; I641-F698 HydrophobicContact CD1-CG 4.03Å; I641-F698 VanDerWaalsContact CD1-O 3.28Å; I641-F698 WeakPolarHBondContact CD1-O 3.42Å; A644-F698 HydrophobicContact CB-CD2 4.42Å; A644-F698 HydrophobicContact CB-CE2 4.28Å; I645-F698 HydrophobicContact CD1-CB 4.49Å; I645-F698 HydrophobicContact CG1-CB 3.68Å; V648-F698 HydrophobicContact CB-CD2 4.29Å; V648-F698 HydrophobicContact CB-CE2 4.4Å; V648-F698 HydrophobicContact CG1-CD2 4.1Å; I694-F698 HydrophobicContact CG2-CD2 3.8Å; I694-F698 HydrophobicContact CG2-CE2 3.48Å; I694-F698 VanDerWaalsContact CG2-CE2 3.48Å; I694-F698 HydrophobicContact CG2-CZ 4.01Å; I694-F698 PolarHBondContact O-N 3.43Å; Y695-F698 PolarHBondContact O-N 3.33Å; F698-R700 VanDerWaalsContact C-N 3.32Å; F698-R700 PolarHBondContact O-N 3.28Å; F698-F701 PolarHBondContact O-N 3.22Å; F698-N702 VanDerWaalsContact O-CB 3.26Å; F698-N702 WeakPolarHBondContact O-CB 3.16Å; F698-N702 PolarHBondContact O-N 3.06Å
699	M	92.9	Very high	93.3	Very high	86 Å²	86	47.9 Å²	47.9	42%	0.424	27%	0.265	S	S	.	.	H	α-helix	trans	-59.3	-43.6	173.4	-74.8	-64.9	-66.3	0	0	111.9	I645 Y695 T696 L697 N702 S703	I645-M699 HydrophobicContact CD1-SD 3.84Å; I645-M699 HydrophobicContact CG1-SD 4.37Å; I645-M699 HydrophobicContact CG2-CG 4.45Å; I645-M699 HydrophobicContact CG2-SD 3.74Å; Y695-M699 HydrophobicContact CD1-CG 4.07Å; Y695-M699 HydrophobicContact CE1-CG 3.64Å; Y695-M699 HydrophobicContact CE1-SD 4.5Å; Y695-M699 HydrophobicContact CE2-CG 4.25Å; Y695-M699 WeakPolarHBondContact O-CB 3.3Å; Y695-M699 VanDerWaalsContact O-CG 3.31Å; Y695-M699 WeakPolarHBondContact O-CG 3.25Å; Y695-M699 PolarHBondContact O-N 3.37Å; T696-M699 PolarHBondContact O-N 3.04Å; L697-M699 PolarHBondContact O-N 3.14Å; M699-N702 PolarHBondContact O-N 2.86Å; M699-S703 PolarHBondContact O-N 3.37Å; M699-S703 VanDerWaalsContact O-N 3.08Å
700	R	93.6	Very high	93.5	Very high	98 Å²	98	48.9 Å²	48.9	37%	0.37	26%	0.256	S	S	.	.	H	α-helix	trans	-65.3	-42.6	177.5	-171	179.3	175.3	-179.6	-4.6	111.7	T251 F256 T696 L697 F698 S703	T251-R700 PolarHBondContact O-NH2 3.29Å; F256-R700 HydrophobicContact CE2-CB 4.23Å; F256-R700 HydrophobicContact CE2-CG 4.04Å; F256-R700 HydrophobicContact CZ-CB 4.19Å; F256-R700 HydrophobicContact CZ-CG 4.43Å; T696-R700 WeakPolarHBondContact O-CB 3.46Å; T696-R700 PolarHBondContact O-N 2.94Å; L697-R700 PolarHBondContact O-N 2.64Å; F698-R700 VanDerWaalsContact C-N 3.32Å; F698-R700 PolarHBondContact O-N 3.28Å; R700-S703 PolarHBondContact O-N 2.94Å; R700-S703 PolarHBondContact O-OG 3.44Å
701	F	93.1	Very high	93.8	Very high	2 Å²	2	47 Å²	47	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-46	175.9	-173	-100	0	0	0	111.7	F256 V328 I331 V639 I641 L697 F698 S703 I704	F256-F701 HydrophobicContact CB-CD2 3.95Å; F256-F701 HydrophobicContact CB-CE2 4.11Å; F256-F701 HydrophobicContact CD1-CB 4.37Å; F256-F701 AromaticContact CD1-CD2 3.65Å; F256-F701 HydrophobicContact CD1-CD2 3.65Å; F256-F701 HydrophobicContact CD1-CE2 4.4Å; F256-F701 HydrophobicContact CD1-CG 4.42Å; F256-F701 HydrophobicContact CD2-CB 4.39Å; F256-F701 AromaticContact CD2-CD2 3.78Å; F256-F701 HydrophobicContact CD2-CD2 3.78Å; F256-F701 HydrophobicContact CE1-CB 3.9Å; F256-F701 HydrophobicContact CE1-CD2 4.06Å; F256-F701 HydrophobicContact CE1-CG 4.41Å; F256-F701 HydrophobicContact CE2-CB 3.93Å; F256-F701 HydrophobicContact CE2-CD2 4.18Å; F256-F701 AromaticContact CG-CD2 3.52Å; F256-F701 HydrophobicContact CG-CD2 3.52Å; F256-F701 HydrophobicContact CG-CE2 4.18Å; F256-F701 HydrophobicContact CZ-CB 3.68Å; F256-F701 HydrophobicContact CZ-CD2 4.33Å; V328-F701 HydrophobicContact CB-CE1 4.47Å; V328-F701 HydrophobicContact CB-CZ 4.34Å; V328-F701 HydrophobicContact CG1-CE1 4.46Å; V328-F701 HydrophobicContact CG1-CE2 4.15Å; V328-F701 HydrophobicContact CG1-CZ 4.09Å; V328-F701 HydrophobicContact CG2-CD1 4.35Å; V328-F701 HydrophobicContact CG2-CE1 3.96Å; V328-F701 HydrophobicContact CG2-CZ 4.32Å; I331-F701 HydrophobicContact CB-CZ 3.81Å; I331-F701 HydrophobicContact CD1-CE1 3.87Å; I331-F701 HydrophobicContact CD1-CZ 3.72Å; I331-F701 HydrophobicContact CG1-CZ 4.41Å; I331-F701 HydrophobicContact CG2-CE2 4.07Å; I331-F701 HydrophobicContact CG2-CZ 3.61Å; V639-F701 HydrophobicContact CG1-CD1 3.86Å; V639-F701 HydrophobicContact CG1-CE1 3.39Å; V639-F701 HydrophobicContact CG1-CZ 4.24Å; I641-F701 HydrophobicContact CD1-CB 4.06Å; I641-F701 HydrophobicContact CD1-CD1 3.52Å; I641-F701 HydrophobicContact CD1-CE1 4.44Å; I641-F701 HydrophobicContact CD1-CG 4.24Å; I641-F701 HydrophobicContact CG1-CD1 4.1Å; I641-F701 HydrophobicContact CG2-CD1 4.38Å; I641-F701 HydrophobicContact CG2-CE1 4.29Å; L697-F701 WeakPolarHBondContact O-CB 3.23Å; L697-F701 PolarHBondContact O-N 3.23Å; F698-F701 PolarHBondContact O-N 3.22Å; F701-S703 PolarHBondContact O-N 3.4Å; F701-I704 HydrophobicContact CD2-CD1 3.93Å; F701-I704 HydrophobicContact CE2-CD1 4.39Å; F701-I704 WeakPolarHBondContact O-CB 3.29Å; F701-I704 WeakPolarHBondContact O-CG1 3.41Å; F701-I704 PolarHBondContact O-N 3.24Å; F701-I704 VanDerWaalsContact O-N 3.13Å
702	N	92.5	Very high	94.1	Very high	33 Å²	33	46.5 Å²	46.5	18%	0.176	25%	0.247	C	C	.	.	H	α-helix	trans	-66.7	-15.6	177.7	-161.9	81.5	0	0	0	113.4	I641 I645 F698 M699 P705	I641-N702 HydrophobicContact CD1-CB 4.08Å; I641-N702 HydrophobicContact CG1-CB 3.69Å; I641-N702 WeakPolarHBondContact CG1-OD1 3.46Å; I641-N702 PolarHBondContact N-OD1 3.38Å; I645-N702 HydrophobicContact CD1-CB 3.62Å; F698-N702 VanDerWaalsContact O-CB 3.26Å; F698-N702 WeakPolarHBondContact O-CB 3.16Å; F698-N702 PolarHBondContact O-N 3.06Å; M699-N702 PolarHBondContact O-N 2.86Å; N702-P705 WeakPolarHBondContact O-CD 3.47Å
703	S	93.3	Very high	94.4	Very high	31 Å²	31	49.5 Å²	49.5	22%	0.217	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.3	175.4	78.2	0	0	0	0	114	M699 R700 F701 P705 D706 Q707	M699-S703 PolarHBondContact O-N 3.37Å; M699-S703 VanDerWaalsContact O-N 3.08Å; R700-S703 PolarHBondContact O-N 2.94Å; R700-S703 PolarHBondContact O-OG 3.44Å; F701-S703 PolarHBondContact O-N 3.4Å; S703-P705 VanDerWaalsContact C-CD 3.44Å; S703-D706 PolarHBondContact O-N 3.37Å; S703-Q707 WeakPolarHBondContact O-CG 3.22Å; S703-Q707 PolarHBondContact O-N 2.89Å
704	I	94.7	Very high	94.6	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.015	23%	0.231	C	C	.	.	H	α-helix	trans	-56.1	-45.3	179.7	-66.6	172.5	0	0	0	112.6	F249 F256 L636 F701 D706 Q707 M708	F249-I704 HydrophobicContact CD2-CG2 4.23Å; F249-I704 HydrophobicContact CE2-CG2 3.81Å; F256-I704 HydrophobicContact CD2-CD1 3.96Å; F256-I704 HydrophobicContact CE2-CD1 4.49Å; L636-I704 HydrophobicContact CB-CG2 4.41Å; L636-I704 HydrophobicContact CD1-CG2 3.92Å; L636-I704 HydrophobicContact CD2-CG2 4.32Å; L636-I704 HydrophobicContact CG-CG2 4.46Å; F701-I704 HydrophobicContact CD2-CD1 3.93Å; F701-I704 HydrophobicContact CE2-CD1 4.39Å; F701-I704 WeakPolarHBondContact O-CB 3.29Å; F701-I704 WeakPolarHBondContact O-CG1 3.41Å; F701-I704 PolarHBondContact O-N 3.24Å; F701-I704 VanDerWaalsContact O-N 3.13Å; I704-D706 VanDerWaalsContact C-N 3.33Å; I704-D706 PolarHBondContact O-N 3.24Å; I704-Q707 PolarHBondContact O-N 3.34Å; I704-M708 WeakPolarHBondContact O-CB 3.33Å; I704-M708 PolarHBondContact O-N 3.36Å
705	P	94.1	Very high	94.7	Very high	12 Å²	12	45.6 Å²	45.6	8%	0.078	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-43.4	177.6	-17.9	28.5	0	0	0	112.2	L636 V639 N702 S703 M708 N709	L636-P705 VanDerWaalsContact O-CG 3.32Å; L636-P705 WeakPolarHBondContact O-CG 3.1Å; V639-P705 HydrophobicContact CB-CG 4.2Å; N702-P705 WeakPolarHBondContact O-CD 3.47Å; S703-P705 VanDerWaalsContact C-CD 3.44Å; P705-M708 WeakPolarHBondContact O-CB 3.37Å; P705-M708 PolarHBondContact O-N 3.43Å; P705-N709 WeakPolarHBondContact O-CB 3.43Å; P705-N709 VanDerWaalsContact O-CG 3.31Å; P705-N709 PolarHBondContact O-N 3.33Å; P705-N709 PolarHBondContact O-ND2 3.08Å
706	D	94.1	Very high	94.9	Very high	109 Å²	109	44.9 Å²	44.9	58%	0.583	23%	0.232	S	C	*	.	H	α-helix	trans	-67.1	-41.4	179.4	-69.7	-29	0	0	0	111.6	S703 I704 M708 N709 H710	S703-D706 PolarHBondContact O-N 3.37Å; I704-D706 VanDerWaalsContact C-N 3.33Å; I704-D706 PolarHBondContact O-N 3.24Å; D706-M708 VanDerWaalsContact C-N 3.35Å; D706-N709 PolarHBondContact O-N 2.9Å; D706-H710 VanDerWaalsContact O-CB 3.23Å; D706-H710 WeakPolarHBondContact O-CB 3.45Å; D706-H710 PolarHBondContact O-N 3.23Å
707	Q	95.3	Very high	94.9	Very high	55 Å²	55	45.8 Å²	45.8	26%	0.257	23%	0.229	S	C	.	.	H	α-helix	trans	-63.4	-40.9	175.1	-71.8	-179.3	-11	0	0	111.9	G248 F249 S252 S703 I704 H710 A711	G248-Q707 PolarHBondContact O-OE1 3.19Å; F249-Q707 HydrophobicContact CB-CB 4.25Å; S252-Q707 PolarHBondContact OG-NE2 3.05Å; S252-Q707 PolarHBondContact OG-OE1 3.45Å; S703-Q707 WeakPolarHBondContact O-CG 3.22Å; S703-Q707 PolarHBondContact O-N 2.89Å; I704-Q707 PolarHBondContact O-N 3.34Å; Q707-H710 PolarHBondContact O-N 3.18Å; Q707-A711 PolarHBondContact O-N 3.27Å
708	M	95.1	Very high	94.9	Very high	7 Å²	7	45 Å²	45	3%	0.034	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-50.4	175	-170.7	-178.1	69.1	0	0	111	F249 F630 L633 L636 I704 P705 D706 H710 A711 V712	F249-M708 HydrophobicContact CD2-CB 3.73Å; F249-M708 HydrophobicContact CD2-CG 4.29Å; F249-M708 HydrophobicContact CE2-CB 3.7Å; F249-M708 HydrophobicContact CE2-CG 3.94Å; F249-M708 HydrophobicContact CE2-SD 4.36Å; F249-M708 HydrophobicContact CZ-CG 4.39Å; F630-M708 HydrophobicContact CD1-CG 3.49Å; F630-M708 VanDerWaalsContact CD1-CG 3.49Å; F630-M708 HydrophobicContact CD1-SD 4.25Å; F630-M708 HydrophobicContact CE1-CG 3.78Å; F630-M708 HydrophobicContact CG-CG 4.48Å; L633-M708 HydrophobicContact CB-SD 4.12Å; L636-M708 HydrophobicContact CB-CE 4.48Å; L636-M708 HydrophobicContact CB-SD 4.19Å; L636-M708 HydrophobicContact CD1-SD 4.44Å; I704-M708 WeakPolarHBondContact O-CB 3.33Å; I704-M708 PolarHBondContact O-N 3.36Å; P705-M708 WeakPolarHBondContact O-CB 3.37Å; P705-M708 PolarHBondContact O-N 3.43Å; D706-M708 VanDerWaalsContact C-N 3.35Å; M708-H710 VanDerWaalsContact C-N 3.3Å; M708-H710 PolarHBondContact O-N 3.32Å; M708-A711 PolarHBondContact O-N 3.38Å; M708-A711 VanDerWaalsContact O-N 3.16Å; M708-V712 WeakPolarHBondContact O-CG2 3.49Å; M708-V712 PolarHBondContact O-N 3Å
709	N	94.9	Very high	95	Very high	75 Å²	75	47.7 Å²	47.7	40%	0.401	24%	0.238	S	C	.	.	H	α-helix	trans	-60	-41.4	177.1	-74.7	-27.7	0	0	0	111.5	P705 D706 A711 V712 I713	P705-N709 WeakPolarHBondContact O-CB 3.43Å; P705-N709 VanDerWaalsContact O-CG 3.31Å; P705-N709 PolarHBondContact O-N 3.33Å; P705-N709 PolarHBondContact O-ND2 3.08Å; D706-N709 PolarHBondContact O-N 2.9Å; N709-A711 PolarHBondContact O-N 3.13Å; N709-V712 PolarHBondContact O-N 2.68Å; N709-I713 WeakPolarHBondContact O-CB 3.4Å; N709-I713 VanDerWaalsContact O-CG1 3.25Å; N709-I713 WeakPolarHBondContact O-CG1 3.37Å; N709-I713 PolarHBondContact O-N 3.23Å
710	H	96.1	Very high	95	Very high	101 Å²	101	51.2 Å²	51.2	47%	0.468	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-42.1	175.6	-176.6	-115.9	0	0	0	111.9	D706 Q707 M708 I713 N714	D706-H710 VanDerWaalsContact O-CB 3.23Å; D706-H710 WeakPolarHBondContact O-CB 3.45Å; D706-H710 PolarHBondContact O-N 3.23Å; Q707-H710 PolarHBondContact O-N 3.18Å; M708-H710 VanDerWaalsContact C-N 3.3Å; M708-H710 PolarHBondContact O-N 3.32Å; H710-I713 PolarHBondContact O-N 3.2Å; H710-N714 PolarHBondContact CD2-ND2 3.14Å; H710-N714 PolarHBondContact CE1-ND2 3.43Å; H710-N714 PolarHBondContact ND1-ND2 3.39Å; H710-N714 PolarHBondContact NE2-ND2 3.01Å; H710-N714 WeakPolarHBondContact O-CB 3.33Å; H710-N714 PolarHBondContact O-N 3.38Å; H710-N714 PolarHBondContact O-ND2 2.78Å
711	A	96.8	Very high	95	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-42.9	174.8	0	0	0	0	0	112.2	A245 I246 F630 Q707 M708 N709 N714 L715	A245-A711 HydrophobicContact CB-CB 4.08Å; I246-A711 HydrophobicContact CG1-CB 4.34Å; F630-A711 HydrophobicContact CE1-CB 4.29Å; F630-A711 HydrophobicContact CE2-CB 3.98Å; F630-A711 HydrophobicContact CZ-CB 3.53Å; Q707-A711 PolarHBondContact O-N 3.27Å; M708-A711 PolarHBondContact O-N 3.38Å; M708-A711 VanDerWaalsContact O-N 3.16Å; N709-A711 PolarHBondContact O-N 3.13Å; A711-N714 PolarHBondContact O-N 3.16Å; A711-L715 WeakPolarHBondContact O-CB 3.42Å; A711-L715 WeakPolarHBondContact O-CG 3.3Å; A711-L715 PolarHBondContact O-N 3.31Å
712	V	97.1	Very high	95.1	Very high	34 Å²	34	49.1 Å²	49.1	21%	0.206	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-43.8	176.3	171.2	0	0	0	0	111.8	L627 F630 M708 N709 N714 L715 N716	L627-V712 HydrophobicContact CD2-CG1 4.01Å; F630-V712 HydrophobicContact CB-CG2 3.72Å; F630-V712 HydrophobicContact CD1-CG2 4.26Å; F630-V712 HydrophobicContact CD2-CG2 3.73Å; F630-V712 HydrophobicContact CE2-CG2 4.39Å; F630-V712 HydrophobicContact CG-CG2 3.65Å; M708-V712 WeakPolarHBondContact O-CG2 3.49Å; M708-V712 PolarHBondContact O-N 3Å; N709-V712 PolarHBondContact O-N 2.68Å; V712-N714 PolarHBondContact O-N 3.2Å; V712-L715 PolarHBondContact O-N 2.6Å; V712-N716 WeakPolarHBondContact O-CB 3.42Å; V712-N716 PolarHBondContact O-N 2.69Å; V712-N716 PolarHBondContact O-ND2 3.18Å; V712-N716 VanDerWaalsContact O-ND2 3.12Å
713	I	97.1	Very high	95.1	Very high	107 Å²	107	49.9 Å²	49.9	55%	0.549	26%	0.26	S	S	.	.	H	α-helix	trans	-60.6	-46.3	176	-71.3	165.5	0	0	0	110.3	N709 H710 N716 K717	N709-I713 WeakPolarHBondContact O-CB 3.4Å; N709-I713 VanDerWaalsContact O-CG1 3.25Å; N709-I713 WeakPolarHBondContact O-CG1 3.37Å; N709-I713 PolarHBondContact O-N 3.23Å; H710-I713 PolarHBondContact O-N 3.2Å; I713-N716 PolarHBondContact O-N 2.66Å; I713-K717 WeakPolarHBondContact O-CB 3.36Å; I713-K717 PolarHBondContact O-N 2.8Å
714	N	96.5	Very high	95.1	Very high	20 Å²	20	52.7 Å²	52.7	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-40.6	178.8	-77.3	-56.2	0	0	0	112.1	V242 H710 A711 V712 K717 Y718	V242-N714 HydrophobicContact CG2-CB 4.12Å; H710-N714 PolarHBondContact CD2-ND2 3.14Å; H710-N714 PolarHBondContact CE1-ND2 3.43Å; H710-N714 PolarHBondContact ND1-ND2 3.39Å; H710-N714 PolarHBondContact NE2-ND2 3.01Å; H710-N714 WeakPolarHBondContact O-CB 3.33Å; H710-N714 PolarHBondContact O-N 3.38Å; H710-N714 PolarHBondContact O-ND2 2.78Å; A711-N714 PolarHBondContact O-N 3.16Å; V712-N714 PolarHBondContact O-N 3.2Å; N714-K717 PolarHBondContact O-N 3.16Å; N714-Y718 WeakPolarHBondContact O-CB 3.42Å; N714-Y718 PolarHBondContact O-N 3.44Å
715	L	96.6	Very high	95	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-45.4	173.7	-83.2	168.5	0	0	0	112.3	V242 I246 F348 I623 C626 L627 F630 A711 V712 Y718 N719	V242-L715 HydrophobicContact CG1-CD2 3.61Å; V242-L715 HydrophobicContact CG1-CG 3.87Å; I246-L715 HydrophobicContact CD1-CD2 4.48Å; F348-L715 HydrophobicContact CD2-CD2 4.14Å; F348-L715 HydrophobicContact CE2-CD2 4.28Å; I623-L715 HydrophobicContact CG1-CD2 4.21Å; I623-L715 HydrophobicContact CG2-CD2 4.37Å; C626-L715 HydrophobicContact CB-CD1 3.77Å; C626-L715 HydrophobicContact CB-CD2 4.33Å; L627-L715 HydrophobicContact CD2-CB 4.1Å; L627-L715 HydrophobicContact CD2-CD1 4.2Å; F630-L715 HydrophobicContact CD2-CD1 3.82Å; F630-L715 HydrophobicContact CE2-CD1 3.56Å; A711-L715 WeakPolarHBondContact O-CB 3.42Å; A711-L715 WeakPolarHBondContact O-CG 3.3Å; A711-L715 PolarHBondContact O-N 3.31Å; V712-L715 PolarHBondContact O-N 2.6Å; L715-Y718 PolarHBondContact O-N 2.84Å; L715-N719 WeakPolarHBondContact O-CB 3.34Å; L715-N719 PolarHBondContact O-N 3.4Å
716	N	96.1	Very high	94.9	Very high	64 Å²	64	53 Å²	53	34%	0.342	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-43.6	178.4	-78.2	-43.4	0	0	0	111.9	V712 I713 N719 Q720	V712-N716 WeakPolarHBondContact O-CB 3.42Å; V712-N716 PolarHBondContact O-N 2.69Å; V712-N716 PolarHBondContact O-ND2 3.18Å; V712-N716 VanDerWaalsContact O-ND2 3.12Å; I713-N716 PolarHBondContact O-N 2.66Å; N716-N719 WeakPolarHBondContact O-CB 3.46Å; N716-N719 PolarHBondContact O-N 3.26Å; N716-Q720 WeakPolarHBondContact O-CG 3.36Å; N716-Q720 PolarHBondContact O-N 3.22Å; N716-Q720 VanDerWaalsContact O-N 3.1Å
717	K	95.1	Very high	94.7	Very high	103 Å²	103	53.6 Å²	53.6	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-45.6	175.1	-175.9	-179.5	178.5	-174	0	111.2	I713 N714 N719 Q720 T721	I713-K717 WeakPolarHBondContact O-CB 3.36Å; I713-K717 PolarHBondContact O-N 2.8Å; N714-K717 PolarHBondContact O-N 3.16Å; K717-N719 VanDerWaalsContact C-N 3.33Å; K717-N719 PolarHBondContact O-N 3.23Å; K717-Q720 PolarHBondContact O-N 2.95Å; K717-T721 PolarHBondContact O-N 2.87Å; K717-T721 VanDerWaalsContact O-N 3.17Å; K717-T721 PolarHBondContact O-OG1 2.86Å
718	Y	95.2	Very high	94.5	Very high	5 Å²	5	53.5 Å²	53.5	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-58.8	-44.5	176.4	-175.3	-88.3	0	0	0	111.5	F233 S237 A239 V242 F348 F619 I623 N714 L715 Q720 T721 L722	F233-Y718 WeakPolarHBondContact CE1-OH 3.32Å; F233-Y718 WeakPolarHBondContact CZ-OH 3.47Å; S237-Y718 VanDerWaalsContact CB-CE2 3.46Å; S237-Y718 WeakPolarHBondContact O-CD2 3.37Å; S237-Y718 WeakPolarHBondContact O-CE2 3.31Å; S237-Y718 WeakPolarHBondContact OG-CE2 3.31Å; A239-Y718 HydrophobicContact CB-CE2 3.78Å; V242-Y718 HydrophobicContact CG2-CD2 3.81Å; V242-Y718 HydrophobicContact CG2-CG 3.9Å; F348-Y718 HydrophobicContact CE2-CD1 4.1Å; F348-Y718 AromaticContact CE2-CE1 3.93Å; F348-Y718 HydrophobicContact CE2-CE1 3.93Å; F348-Y718 HydrophobicContact CZ-CD1 4.34Å; F348-Y718 HydrophobicContact CZ-CD2 4.32Å; F348-Y718 HydrophobicContact CZ-CE1 4.14Å; F348-Y718 HydrophobicContact CZ-CE2 4.11Å; F348-Y718 HydrophobicContact CZ-CG 4.44Å; F619-Y718 HydrophobicContact CD1-CE1 4Å; F619-Y718 WeakPolarHBondContact CE1-OH 3.32Å; I623-Y718 HydrophobicContact CD1-CD1 3.64Å; I623-Y718 HydrophobicContact CD1-CE1 3.98Å; I623-Y718 HydrophobicContact CG1-CD1 4.32Å; N714-Y718 WeakPolarHBondContact O-CB 3.42Å; N714-Y718 PolarHBondContact O-N 3.44Å; L715-Y718 PolarHBondContact O-N 2.84Å; Y718-Q720 VanDerWaalsContact C-N 3.31Å; Y718-Q720 PolarHBondContact O-N 3.49Å; Y718-T721 PolarHBondContact O-N 3.5Å; Y718-T721 PolarHBondContact O-OG1 2.88Å; Y718-L722 HydrophobicContact CE1-CD1 3.92Å; Y718-L722 WeakPolarHBondContact O-CB 3.45Å; Y718-L722 PolarHBondContact O-N 3.19Å
719	N	94.5	Very high	94.3	Very high	57 Å²	57	53.1 Å²	53.1	31%	0.305	28%	0.281	S	S	.	.	H	α-helix	trans	-60.5	-38.5	177.2	-166.5	37.7	0	0	0	112.8	I623 L715 N716 K717	I623-N719 HydrophobicContact CD1-CB 4.13Å; I623-N719 HydrophobicContact CG2-CB 4.14Å; L715-N719 WeakPolarHBondContact O-CB 3.34Å; L715-N719 PolarHBondContact O-N 3.4Å; N716-N719 WeakPolarHBondContact O-CB 3.46Å; N716-N719 PolarHBondContact O-N 3.26Å; K717-N719 VanDerWaalsContact C-N 3.33Å; K717-N719 PolarHBondContact O-N 3.23Å
720	Q	93.6	Very high	93.9	Very high	159 Å²	159	50.3 Å²	50.3	74%	0.743	27%	0.265	S	S	*	.	H	α-helix	trans	-67.7	-36.7	177.7	-71.5	173.5	-6.9	0	0	112.5	N716 K717 Y718	N716-Q720 WeakPolarHBondContact O-CG 3.36Å; N716-Q720 PolarHBondContact O-N 3.22Å; N716-Q720 VanDerWaalsContact O-N 3.1Å; K717-Q720 PolarHBondContact O-N 2.95Å; Y718-Q720 VanDerWaalsContact C-N 3.31Å; Y718-Q720 PolarHBondContact O-N 3.49Å
721	T	93.9	Very high	93.6	Very high	56 Å²	56	48.6 Å²	48.6	34%	0.344	26%	0.26	S	S	.	.	H	α-helix	trans	-90.6	-12.1	-178.1	54.9	0	0	0	0	113.9	K717 Y718 S723 T724 S725	K717-T721 PolarHBondContact O-N 2.87Å; K717-T721 VanDerWaalsContact O-N 3.17Å; K717-T721 PolarHBondContact O-OG1 2.86Å; Y718-T721 PolarHBondContact O-N 3.5Å; Y718-T721 PolarHBondContact O-OG1 2.88Å; T721-S723 PolarHBondContact O-N 2.66Å; T721-T724 PolarHBondContact O-N 3.22Å; T721-S725 PolarHBondContact O-N 3.4Å; T721-S725 PolarHBondContact O-OG 3.3Å
722	L	94.1	Very high	93.3	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-50.7	-51.8	-171.1	177	60.3	0	0	0	112.8	F233 F619 R620 I623 Y718 T724 S725 V726	F233-L722 HydrophobicContact CE2-CD1 4.46Å; F233-L722 HydrophobicContact CZ-CD1 4.02Å; F619-L722 HydrophobicContact CB-CD1 4.04Å; F619-L722 HydrophobicContact CB-CD2 3.75Å; F619-L722 HydrophobicContact CG-CD1 4.29Å; R620-L722 HydrophobicContact CG-CD2 3.81Å; I623-L722 HydrophobicContact CD1-CD2 4.24Å; Y718-L722 HydrophobicContact CE1-CD1 3.92Å; Y718-L722 WeakPolarHBondContact O-CB 3.45Å; Y718-L722 PolarHBondContact O-N 3.19Å; L722-T724 PolarHBondContact O-N 2.87Å; L722-S725 PolarHBondContact O-N 2.84Å; L722-V726 HydrophobicContact CD1-CG2 4.03Å; L722-V726 HydrophobicContact CG-CG2 4.47Å; L722-V726 WeakPolarHBondContact O-CG2 3.38Å; L722-V726 PolarHBondContact O-N 3.05Å
723	S	93	Very high	92.9	Very high	48 Å²	48	52 Å²	52	34%	0.336	27%	0.27	S	S	.	.	H	α-helix	trans	-60.7	-45.3	-176.7	-169.6	0	0	0	0	112.1	E616 T721 S725 V726 Q727	E616-S723 VanDerWaalsContact OE1-CA 3.31Å; E616-S723 WeakPolarHBondContact OE1-CA 3.33Å; E616-S723 WeakPolarHBondContact OE1-CB 3.41Å; E616-S723 PolarHBondContact OE1-OG 2.98Å; T721-S723 PolarHBondContact O-N 2.66Å; S723-S725 PolarHBondContact O-N 2.9Å; S723-V726 PolarHBondContact O-N 3.37Å; S723-Q727 PolarHBondContact O-N 3.48Å
724	T	93.3	Very high	92.5	Very high	90 Å²	90	47.5 Å²	47.5	55%	0.552	25%	0.247	S	C	*	.	H	α-helix	trans	-64	-40.1	177	-48.6	0	0	0	0	112	T721 L722 S728	T721-T724 PolarHBondContact O-N 3.22Å; L722-T724 PolarHBondContact O-N 2.87Å; T724-S728 VanDerWaalsContact O-CB 3.29Å; T724-S728 WeakPolarHBondContact O-CB 3.26Å; T724-S728 PolarHBondContact O-N 3.24Å; T724-S728 PolarHBondContact O-OG 2.94Å
725	S	92.8	Very high	92.1	Very high	9 Å²	9	51.8 Å²	51.8	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-43.7	177.3	-62.3	0	0	0	0	111.5	L236 S237 T721 L722 S723 S728 S729	L236-S725 PolarHBondContact O-OG 3.31Å; S237-S725 WeakPolarHBondContact CA-OG 3.41Å; T721-S725 PolarHBondContact O-N 3.4Å; T721-S725 PolarHBondContact O-OG 3.3Å; L722-S725 PolarHBondContact O-N 2.84Å; S723-S725 PolarHBondContact O-N 2.9Å; S725-S728 PolarHBondContact O-N 3.31Å; S725-S729 WeakPolarHBondContact O-CB 3.4Å; S725-S729 PolarHBondContact O-N 3.14Å; S725-S729 PolarHBondContact O-OG 3.31Å; S725-S729 VanDerWaalsContact O-OG 3.07Å
726	V	91.2	Very high	91.8	Very high	12 Å²	12	56.3 Å²	56.3	7%	0.073	29%	0.29	C	S	.	.	H	α-helix	trans	-56.7	-52.3	174.1	168.6	0	0	0	0	110.4	F233 L615 E616 L722 S723 S728 S729 M730	F233-V726 HydrophobicContact CE2-CG2 3.68Å; F233-V726 HydrophobicContact CZ-CG2 4.38Å; L615-V726 HydrophobicContact CB-CG1 4.06Å; L615-V726 HydrophobicContact CB-CG2 4.21Å; L615-V726 HydrophobicContact CD1-CG1 4.41Å; E616-V726 HydrophobicContact CG-CB 4.45Å; E616-V726 HydrophobicContact CG-CG2 4.08Å; L722-V726 HydrophobicContact CD1-CG2 4.03Å; L722-V726 HydrophobicContact CG-CG2 4.47Å; L722-V726 WeakPolarHBondContact O-CG2 3.38Å; L722-V726 PolarHBondContact O-N 3.05Å; S723-V726 PolarHBondContact O-N 3.37Å; V726-S728 VanDerWaalsContact C-N 3.35Å; V726-S728 PolarHBondContact O-N 3.14Å; V726-S729 PolarHBondContact O-N 2.97Å; V726-M730 WeakPolarHBondContact O-CB 3.21Å; V726-M730 PolarHBondContact O-N 3.34Å
727	Q	90.1	Very high	91.3	Very high	122 Å²	122	54.1 Å²	54.1	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-61.8	-42.1	-178.5	-169.5	-179	9.2	0	0	112.3	S723 N731	S723-Q727 PolarHBondContact O-N 3.48Å; Q727-N731 PolarHBondContact O-N 3Å; Q727-N731 PolarHBondContact O-ND2 3.06Å
728	S	91.4	Very high	91	Very high	53 Å²	53	53.8 Å²	53.8	37%	0.371	27%	0.274	S	S	.	.	H	α-helix	trans	-67.4	-45.6	-179.6	-60.4	0	0	0	0	112.1	T724 S725 V726 M730 R732	T724-S728 VanDerWaalsContact O-CB 3.29Å; T724-S728 WeakPolarHBondContact O-CB 3.26Å; T724-S728 PolarHBondContact O-N 3.24Å; T724-S728 PolarHBondContact O-OG 2.94Å; S725-S728 PolarHBondContact O-N 3.31Å; V726-S728 VanDerWaalsContact C-N 3.35Å; V726-S728 PolarHBondContact O-N 3.14Å; S728-M730 VanDerWaalsContact C-N 3.33Å; S728-R732 WeakPolarHBondContact O-CB 3.44Å; S728-R732 PolarHBondContact O-N 3Å
729	S	90.2	Very high	90.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-39.4	177.1	-65.6	0	0	0	0	111.6	F233 L236 S725 V726 R732 G733	F233-S729 VanDerWaalsContact CA-OG 3.26Å; F233-S729 WeakPolarHBondContact CA-OG 3.29Å; L236-S729 WeakPolarHBondContact CD1-OG 3.39Å; S725-S729 WeakPolarHBondContact O-CB 3.4Å; S725-S729 PolarHBondContact O-N 3.14Å; S725-S729 PolarHBondContact O-OG 3.31Å; S725-S729 VanDerWaalsContact O-OG 3.07Å; V726-S729 PolarHBondContact O-N 2.97Å; S729-R732 PolarHBondContact O-N 2.81Å; S729-G733 PolarHBondContact O-N 3.44Å
730	M	87.9	Confident	90.2	Very high	15 Å²	15	59 Å²	59	7%	0.074	31%	0.306	C	S	.	.	H	α-helix	trans	-65.4	-46.4	179.6	177.1	163.4	-98.8	0	0	112	F229 F610 K611 V726 S728 R732 G733 V734	F229-M730 HydrophobicContact CE2-CB 4.49Å; F610-M730 HydrophobicContact CD1-CE 3.73Å; F610-M730 HydrophobicContact CD1-CG 3.8Å; F610-M730 HydrophobicContact CE1-CB 4.23Å; F610-M730 HydrophobicContact CE1-CE 3.88Å; F610-M730 HydrophobicContact CE1-CG 3.67Å; F610-M730 HydrophobicContact CG-CE 4.29Å; F610-M730 WeakPolarHBondContact O-CE 3.35Å; K611-M730 HydrophobicContact CB-SD 4.23Å; K611-M730 HydrophobicContact CG-CG 4.19Å; K611-M730 HydrophobicContact CG-SD 3.96Å; V726-M730 WeakPolarHBondContact O-CB 3.21Å; V726-M730 PolarHBondContact O-N 3.34Å; S728-M730 VanDerWaalsContact C-N 3.33Å; M730-R732 VanDerWaalsContact C-N 3.32Å; M730-R732 PolarHBondContact O-N 3.23Å; M730-G733 PolarHBondContact O-N 3.12Å; M730-V734 WeakPolarHBondContact O-CG2 3.34Å; M730-V734 PolarHBondContact O-N 3.42Å
731	N	89.9	Confident	89.7	Confident	65 Å²	65	51.8 Å²	51.8	35%	0.348	27%	0.272	S	S	.	.	H	α-helix	trans	-62.4	-39.7	175.1	-74.5	-31.7	0	0	0	112.1	Q727 N735	Q727-N731 PolarHBondContact O-N 3Å; Q727-N731 PolarHBondContact O-ND2 3.06Å; N731-N735 WeakPolarHBondContact O-CB 3.28Å; N731-N735 PolarHBondContact O-N 3.28Å; N731-N735 PolarHBondContact O-ND2 3.34Å
732	R	90.5	Very high	89.1	Confident	103 Å²	103	50.9 Å²	50.9	39%	0.389	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-45.2	176.3	-175.3	179.9	-71.8	-169.2	-0.5	111.9	D232 S728 S729 M730 N735 K736	D232-R732 WeakPolarHBondContact OD1-CD 3.5Å; D232-R732 IonicContact OD1-CZ 2.76Å; D232-R732 IonicContact OD1-NH1 2.66Å; D232-R732 PolarHBondContact OD1-NH1 3.27Å; D232-R732 WeakPolarHBondContact OD2-CD 3.28Å; S728-R732 WeakPolarHBondContact O-CB 3.44Å; S728-R732 PolarHBondContact O-N 3Å; S729-R732 PolarHBondContact O-N 2.81Å; M730-R732 VanDerWaalsContact C-N 3.32Å; M730-R732 PolarHBondContact O-N 3.23Å; R732-N735 PolarHBondContact O-N 3.39Å; R732-K736 HydrophobicContact CG-CD 4.35Å; R732-K736 WeakPolarHBondContact O-CG 3.45Å; R732-K736 PolarHBondContact O-N 2.99Å
733	G	88.2	Confident	88.5	Confident	3 Å²	3	57 Å²	57	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-49.4	177.2	0	0	0	0	0	111.8	S729 M730 N735 K736 L737	S729-G733 PolarHBondContact O-N 3.44Å; M730-G733 PolarHBondContact O-N 3.12Å; G733-N735 PolarHBondContact O-N 3.11Å; G733-K736 PolarHBondContact O-N 3.09Å; G733-L737 WeakPolarHBondContact O-CB 3.27Å; G733-L737 PolarHBondContact O-N 3.08Å
734	V	87.8	Confident	87.9	Confident	12 Å²	12	55.9 Å²	55.9	7%	0.073	28%	0.283	C	S	.	.	H	α-helix	trans	-57.4	-48.7	175.6	165.5	0	0	0	0	111.5	I607 F610 M730 K736 L737 R738	I607-V734 HydrophobicContact CB-CG1 4.43Å; I607-V734 HydrophobicContact CD1-CG1 3.79Å; I607-V734 HydrophobicContact CG1-CG1 3.74Å; I607-V734 HydrophobicContact CG1-CG2 4.5Å; I607-V734 HydrophobicContact CG2-CG1 3.86Å; I607-V734 HydrophobicContact CG2-CG2 4.2Å; F610-V734 HydrophobicContact CD1-CG2 3.6Å; F610-V734 HydrophobicContact CE1-CG2 4.07Å; M730-V734 WeakPolarHBondContact O-CG2 3.34Å; M730-V734 PolarHBondContact O-N 3.42Å; V734-K736 VanDerWaalsContact C-N 3.3Å; V734-K736 PolarHBondContact O-N 3.35Å; V734-L737 PolarHBondContact O-N 2.79Å; V734-R738 VanDerWaalsContact O-CB 3.3Å; V734-R738 WeakPolarHBondContact O-CB 3.18Å; V734-R738 PolarHBondContact O-N 3.41Å
735	N	88.6	Confident	87.1	Confident	111 Å²	111	51.6 Å²	51.6	59%	0.594	26%	0.257	S	S	*	.	H	α-helix	trans	-65.6	-32.2	-177.7	-72.8	-19.2	0	0	0	113	N731 R732 G733 P739	N731-N735 WeakPolarHBondContact O-CB 3.28Å; N731-N735 PolarHBondContact O-N 3.28Å; N731-N735 PolarHBondContact O-ND2 3.34Å; R732-N735 PolarHBondContact O-N 3.39Å; G733-N735 PolarHBondContact O-N 3.11Å; N735-P739 VanDerWaalsContact O-CD 3.25Å; N735-P739 WeakPolarHBondContact O-CD 3.26Å
736	K	89.6	Confident	86.3	Confident	94 Å²	94	53.5 Å²	53.5	41%	0.409	27%	0.265	S	S	.	.	H	α-helix	trans	-72.3	-43.6	174.1	-77.8	177.4	170.4	-179.8	0	112.3	S228 D232 R732 G733 V734 P739	S228-K736 PolarHBondContact OG-NZ 3.05Å; D232-K736 IonicContact OD1-NZ 2.76Å; D232-K736 IonicContact OD2-NZ 3.77Å; D232-K736 PolarHBondContact OD2-NZ 3.2Å; R732-K736 HydrophobicContact CG-CD 4.35Å; R732-K736 WeakPolarHBondContact O-CG 3.45Å; R732-K736 PolarHBondContact O-N 2.99Å; G733-K736 PolarHBondContact O-N 3.09Å; V734-K736 VanDerWaalsContact C-N 3.3Å; V734-K736 PolarHBondContact O-N 3.35Å; K736-P739 WeakPolarHBondContact O-CD 3.43Å
737	L	87.2	Confident	85.6	Confident	18 Å²	18	55.9 Å²	55.9	9%	0.094	28%	0.277	C	S	.	.	H	α-helix	trans	-72	-36.9	-177.9	-83.6	171.2	0	0	0	112.7	I221 I222 G733 V734 L740 L741	I221-L737 HydrophobicContact CG2-CD2 3.93Å; I221-L737 WeakPolarHBondContact O-CD2 3.31Å; I222-L737 HydrophobicContact CD1-CD2 4.44Å; G733-L737 WeakPolarHBondContact O-CB 3.27Å; G733-L737 PolarHBondContact O-N 3.08Å; V734-L737 PolarHBondContact O-N 2.79Å; L737-L740 PolarHBondContact O-N 3.44Å; L737-L740 VanDerWaalsContact O-N 3.09Å; L737-L741 HydrophobicContact CB-CD1 4.16Å; L737-L741 WeakPolarHBondContact O-CG 3.43Å; L737-L741 PolarHBondContact O-N 3.41Å
738	R	87.8	Confident	84.8	Confident	96 Å²	96	50.1 Å²	50.1	36%	0.362	25%	0.25	S	C	.	.	H	α-helix	trans	-48.1	-55.4	-173.8	-166.4	-177.1	-175.3	166.6	1.8	114.4	D600 L603 I607 V734 L740 T742	D600-R738 IonicContact OD1-CZ 2.59Å; D600-R738 IonicContact OD1-NH2 3.84Å; D600-R738 PolarHBondContact OD1-NH2 3.24Å; L603-R738 HydrophobicContact CD1-CG 4.23Å; L603-R738 HydrophobicContact CD2-CG 3.41Å; L603-R738 VanDerWaalsContact CD2-CG 3.41Å; L603-R738 HydrophobicContact CG-CG 4Å; I607-R738 HydrophobicContact CD1-CG 4.39Å; V734-R738 VanDerWaalsContact O-CB 3.3Å; V734-R738 WeakPolarHBondContact O-CB 3.18Å; V734-R738 PolarHBondContact O-N 3.41Å; R738-L740 PolarHBondContact O-N 3.36Å; R738-T742 WeakPolarHBondContact O-CB 3.33Å; R738-T742 PolarHBondContact O-N 2.9Å; R738-T742 PolarHBondContact O-OG1 2.9Å
739	P	87	Confident	83.8	Confident	79 Å²	79	47.7 Å²	47.7	51%	0.513	23%	0.233	S	C	.	.	H	α-helix	trans	-67.5	-34	-179.1	26.8	-35.6	0	0	0	113.1	N735 K736 K743	N735-P739 VanDerWaalsContact O-CD 3.25Å; N735-P739 WeakPolarHBondContact O-CD 3.26Å; K736-P739 WeakPolarHBondContact O-CD 3.43Å; P739-K743 PolarHBondContact O-N 2.99Å; P739-K743 VanDerWaalsContact O-N 3.15Å
740	L	85.8	Confident	82.9	Confident	92 Å²	92	49.4 Å²	49.4	48%	0.482	24%	0.242	S	C	.	.	H	α-helix	trans	-66.9	-46.8	179.4	-62.9	178.3	0	0	0	111.1	I221 L737 R738 K743 E744	I221-L740 HydrophobicContact CD1-CB 4.4Å; I221-L740 HydrophobicContact CG2-CB 3.76Å; I221-L740 HydrophobicContact CG2-CD1 4.26Å; L737-L740 PolarHBondContact O-N 3.44Å; L737-L740 VanDerWaalsContact O-N 3.09Å; R738-L740 PolarHBondContact O-N 3.36Å; L740-K743 PolarHBondContact O-N 2.88Å; L740-E744 PolarHBondContact O-N 2.79Å
741	L	83.6	Confident	82.2	Confident	8 Å²	8	50 Å²	50	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-42.5	176.5	-62.5	176.4	0	0	0	111.3	F218 I221 I222 L603 L737 K743 E744 L745	F218-L741 HydrophobicContact CD2-CD2 3.88Å; F218-L741 HydrophobicContact CE2-CD2 3.59Å; F218-L741 HydrophobicContact CZ-CD2 4.24Å; I221-L741 HydrophobicContact CB-CD2 4.49Å; I221-L741 HydrophobicContact CG2-CD2 3.84Å; I221-L741 HydrophobicContact CG2-CG 4.48Å; I222-L741 HydrophobicContact CD1-CD1 3.87Å; I222-L741 HydrophobicContact CD1-CD2 3.66Å; I222-L741 HydrophobicContact CD1-CG 4.35Å; I222-L741 HydrophobicContact CG1-CD2 4.08Å; L603-L741 HydrophobicContact CD1-CB 3.93Å; L603-L741 HydrophobicContact CD1-CD1 4.04Å; L737-L741 HydrophobicContact CB-CD1 4.16Å; L737-L741 WeakPolarHBondContact O-CG 3.43Å; L737-L741 PolarHBondContact O-N 3.41Å; L741-K743 VanDerWaalsContact C-N 3.28Å; L741-K743 PolarHBondContact O-N 2.99Å; L741-E744 PolarHBondContact O-N 3.28Å; L741-L745 WeakPolarHBondContact O-CB 3.45Å; L741-L745 WeakPolarHBondContact O-CG 3.4Å; L741-L745 PolarHBondContact O-N 3.38Å
742	T	82.1	Confident	81.2	Confident	38 Å²	38	47.6 Å²	47.6	23%	0.233	24%	0.236	C	C	.	.	H	α-helix	trans	-54.2	-46.8	177.2	-57.4	0	0	0	0	111	I599 L603 R738 L745 Q746	I599-T742 HydrophobicContact CG2-CG2 4.07Å; L603-T742 WeakPolarHBondContact CD2-OG1 2.86Å; R738-T742 WeakPolarHBondContact O-CB 3.33Å; R738-T742 PolarHBondContact O-N 2.9Å; R738-T742 PolarHBondContact O-OG1 2.9Å; T742-L745 PolarHBondContact O-N 2.94Å; T742-Q746 WeakPolarHBondContact O-CG 3.47Å; T742-Q746 PolarHBondContact O-N 3.22Å
743	K	81.6	Confident	80.2	Confident	128 Å²	128	42.9 Å²	42.9	56%	0.557	22%	0.219	S	C	*	.	H	α-helix	trans	-64.4	-46.6	-179.9	-175.4	-178.6	177.4	-176.1	0	112.6	P739 L740 L741 L745 Q746 L747	P739-K743 PolarHBondContact O-N 2.99Å; P739-K743 VanDerWaalsContact O-N 3.15Å; L740-K743 PolarHBondContact O-N 2.88Å; L741-K743 VanDerWaalsContact C-N 3.28Å; L741-K743 PolarHBondContact O-N 2.99Å; K743-L745 VanDerWaalsContact C-N 3.35Å; K743-Q746 WeakPolarHBondContact O-CB 3.21Å; K743-Q746 PolarHBondContact O-N 3.44Å; K743-L747 WeakPolarHBondContact O-CG 3.28Å; K743-L747 PolarHBondContact O-N 2.93Å
744	E	79.4	Confident	79.5	Confident	25 Å²	25	46.6 Å²	46.6	12%	0.117	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-36.8	179.4	-72.4	-52.2	133.2	0	0	112.4	I221 L740 L741 Q746 L747 A748	I221-E744 HydrophobicContact CD1-CB 4.36Å; I221-E744 HydrophobicContact CD1-CG 3.21Å; L740-E744 PolarHBondContact O-N 2.79Å; L741-E744 PolarHBondContact O-N 3.28Å; E744-Q746 VanDerWaalsContact C-N 3.32Å; E744-Q746 PolarHBondContact O-N 3.08Å; E744-L747 PolarHBondContact O-N 3.3Å; E744-A748 WeakPolarHBondContact O-CB 3.21Å; E744-A748 PolarHBondContact O-N 3.45Å
745	L	76.5	Confident	78.8	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-37.7	174.8	-65.6	170.3	0	0	0	111.3	F218 L374 I599 I602 L741 T742 K743 A748 V749	F218-L745 HydrophobicContact CD2-CD2 4.21Å; F218-L745 HydrophobicContact CE2-CD2 3.96Å; F218-L745 HydrophobicContact CE2-CG 4.32Å; L374-L745 HydrophobicContact CD1-CD2 4.48Å; L374-L745 HydrophobicContact CD2-CB 4.41Å; L374-L745 HydrophobicContact CD2-CD2 3.45Å; L374-L745 VanDerWaalsContact CD2-CD2 3.45Å; L374-L745 HydrophobicContact CG-CD2 4.42Å; I599-L745 HydrophobicContact CD1-CB 3.75Å; I599-L745 HydrophobicContact CG1-CB 3.81Å; I599-L745 HydrophobicContact CG2-CB 4.14Å; I599-L745 HydrophobicContact CG2-CD1 3.91Å; I602-L745 HydrophobicContact CG2-CD1 4.19Å; L741-L745 WeakPolarHBondContact O-CB 3.45Å; L741-L745 WeakPolarHBondContact O-CG 3.4Å; L741-L745 PolarHBondContact O-N 3.38Å; T742-L745 PolarHBondContact O-N 2.94Å; K743-L745 VanDerWaalsContact C-N 3.35Å; L745-A748 PolarHBondContact O-N 3.22Å; L745-V749 WeakPolarHBondContact O-CG2 3.43Å; L745-V749 PolarHBondContact O-N 3.03Å; L745-V749 VanDerWaalsContact O-N 3.15Å
746	Q	76	Confident	78.3	Confident	48 Å²	48	45.6 Å²	45.6	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-61.9	-45.3	173.4	-75.1	177.1	-19.6	0	0	111.8	S592 L595 I599 T742 K743 E744 A748 V749 I750	S592-Q746 PolarHBondContact OG-NE2 2.63Å; L595-Q746 HydrophobicContact CD2-CB 4.49Å; L595-Q746 HydrophobicContact CD2-CG 4.31Å; I599-Q746 HydrophobicContact CD1-CB 4.1Å; I599-Q746 HydrophobicContact CD1-CG 3.35Å; T742-Q746 WeakPolarHBondContact O-CG 3.47Å; T742-Q746 PolarHBondContact O-N 3.22Å; K743-Q746 WeakPolarHBondContact O-CB 3.21Å; K743-Q746 PolarHBondContact O-N 3.44Å; E744-Q746 VanDerWaalsContact C-N 3.32Å; E744-Q746 PolarHBondContact O-N 3.08Å; Q746-A748 VanDerWaalsContact C-N 3.34Å; Q746-A748 PolarHBondContact O-N 3.44Å; Q746-V749 PolarHBondContact O-N 2.91Å; Q746-I750 WeakPolarHBondContact O-CG1 3.5Å; Q746-I750 PolarHBondContact O-N 3.23Å
747	L	76	Confident	77.9	Confident	63 Å²	63	44.4 Å²	44.4	33%	0.33	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-37.3	177.5	-69.2	174.4	0	0	0	112.4	K743 E744 V749 I750 A751	K743-L747 WeakPolarHBondContact O-CG 3.28Å; K743-L747 PolarHBondContact O-N 2.93Å; E744-L747 PolarHBondContact O-N 3.3Å; L747-V749 VanDerWaalsContact C-N 3.3Å; L747-V749 PolarHBondContact O-N 3.2Å; L747-I750 PolarHBondContact O-N 3.5Å; L747-A751 WeakPolarHBondContact O-CB 3.22Å; L747-A751 PolarHBondContact O-N 3.38Å
748	A	73.7	Confident	77.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-40.4	176.5	0	0	0	0	0	111.8	L211 Q214 W371 L374 E744 L745 Q746 A751 T752	L211-A748 HydrophobicContact CD2-CB 4.04Å; Q214-A748 HydrophobicContact CB-CB 4.43Å; Q214-A748 HydrophobicContact CG-CB 4.05Å; W371-A748 HydrophobicContact CH2-CB 3.98Å; L374-A748 HydrophobicContact CD2-CB 3.71Å; E744-A748 WeakPolarHBondContact O-CB 3.21Å; E744-A748 PolarHBondContact O-N 3.45Å; L745-A748 PolarHBondContact O-N 3.22Å; Q746-A748 VanDerWaalsContact C-N 3.34Å; Q746-A748 PolarHBondContact O-N 3.44Å; A748-A751 WeakPolarHBondContact O-CB 3.31Å; A748-A751 PolarHBondContact O-N 2.89Å; A748-T752 WeakPolarHBondContact O-CG2 3.31Å; A748-T752 PolarHBondContact O-N 3.44Å
749	V	71	Confident	78.1	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-75.8	-38.9	179.4	173.9	0	0	0	0	111.8	L374 L384 L595 L745 Q746 L747 A751 T752	L374-V749 HydrophobicContact CD1-CG2 3.71Å; L374-V749 HydrophobicContact CD2-CG2 4.35Å; L374-V749 HydrophobicContact CG-CG2 4.15Å; L384-V749 HydrophobicContact CD2-CG1 3.58Å; L595-V749 HydrophobicContact CD1-CB 4.09Å; L595-V749 HydrophobicContact CD1-CG1 3.7Å; L595-V749 HydrophobicContact CD1-CG2 3.79Å; L595-V749 HydrophobicContact CD2-CB 3.31Å; L595-V749 HydrophobicContact CD2-CG1 3.48Å; L595-V749 VanDerWaalsContact CD2-CG1 3.48Å; L595-V749 HydrophobicContact CD2-CG2 3.65Å; L595-V749 HydrophobicContact CG-CB 4.28Å; L595-V749 HydrophobicContact CG-CG1 4.16Å; L595-V749 HydrophobicContact CG-CG2 4.24Å; L745-V749 WeakPolarHBondContact O-CG2 3.43Å; L745-V749 PolarHBondContact O-N 3.03Å; L745-V749 VanDerWaalsContact O-N 3.15Å; Q746-V749 PolarHBondContact O-N 2.91Å; L747-V749 VanDerWaalsContact C-N 3.3Å; L747-V749 PolarHBondContact O-N 3.2Å; V749-A751 PolarHBondContact O-N 2.99Å; V749-T752 WeakPolarHBondContact O-CB 3.43Å; V749-T752 PolarHBondContact O-N 2.7Å; V749-T752 PolarHBondContact O-OG1 3.01Å
750	I	70.6	Confident	78.4	Confident	35 Å²	35	44 Å²	44	18%	0.179	24%	0.235	C	C	.	.	H	α-helix	trans	-55.9	-42.9	170.3	-71.5	166.2	0	0	0	110.1	V582 V591 Q746 L747 T752 W753	V582-I750 HydrophobicContact CG1-CG2 3.86Å; V591-I750 HydrophobicContact CB-CG1 4.33Å; V591-I750 HydrophobicContact CG1-CG1 4.26Å; V591-I750 HydrophobicContact CG2-CG1 4.14Å; Q746-I750 WeakPolarHBondContact O-CG1 3.5Å; Q746-I750 PolarHBondContact O-N 3.23Å; L747-I750 PolarHBondContact O-N 3.5Å; I750-T752 PolarHBondContact O-N 3.05Å; I750-W753 PolarHBondContact O-N 3.43Å; I750-W753 VanDerWaalsContact O-N 3.11Å
751	A	72.9	Confident	78.6	Confident	27 Å²	27	39.7 Å²	39.7	22%	0.223	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-18.6	176.2	0	0	0	0	0	113.7	T209 L747 A748 V749 W753	T209-A751 WeakPolarHBondContact CG2-O 3.17Å; T209-A751 PolarHBondContact OG1-O 2.97Å; L747-A751 WeakPolarHBondContact O-CB 3.22Å; L747-A751 PolarHBondContact O-N 3.38Å; A748-A751 WeakPolarHBondContact O-CB 3.31Å; A748-A751 PolarHBondContact O-N 2.89Å; V749-A751 PolarHBondContact O-N 2.99Å; A751-W753 PolarHBondContact O-N 3.47Å
752	T	69.6	Low	79.1	Confident	15 Å²	15	40.3 Å²	40.3	9%	0.092	21%	0.214	C	C	.	.	H	α-helix	trans	-70.1	-19.7	173.6	65.6	0	0	0	0	113.6	T206 T209 L211 A748 V749 I750	T206-T752 WeakPolarHBondContact CG2-O 3.34Å; T209-T752 WeakPolarHBondContact OG1-CA 3.36Å; L211-T752 HydrophobicContact CD1-CG2 4.16Å; L211-T752 HydrophobicContact CD2-CG2 4.39Å; A748-T752 WeakPolarHBondContact O-CG2 3.31Å; A748-T752 PolarHBondContact O-N 3.44Å; V749-T752 WeakPolarHBondContact O-CB 3.43Å; V749-T752 PolarHBondContact O-N 2.7Å; V749-T752 PolarHBondContact O-OG1 3.01Å; I750-T752 PolarHBondContact O-N 3.05Å
753	W	69	Low	79.8	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.015	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	11.5	-176.9	-76.9	36	0	0	0	112.7	A203 L384 A385 F388 V582 I750 A751 D755 I756	A203-W753 HydrophobicContact CB-CD2 4.04Å; A203-W753 HydrophobicContact CB-CE3 4Å; A203-W753 HydrophobicContact CB-CH2 3.21Å; A203-W753 HydrophobicContact CB-CZ2 3.28Å; A203-W753 HydrophobicContact CB-CZ3 3.53Å; L384-W753 HydrophobicContact CB-CZ2 3.99Å; L384-W753 HydrophobicContact CD2-CD2 4.04Å; L384-W753 VanDerWaalsContact CD2-CE2 3.49Å; L384-W753 HydrophobicContact CD2-CG 4.18Å; L384-W753 HydrophobicContact CD2-CZ2 3.9Å; L384-W753 HydrophobicContact CG-CD2 4.43Å; L384-W753 HydrophobicContact CG-CH2 4.26Å; L384-W753 HydrophobicContact CG-CZ2 3.54Å; A385-W753 HydrophobicContact CB-CZ2 4.25Å; F388-W753 HydrophobicContact CB-CH2 3.95Å; F388-W753 HydrophobicContact CB-CZ3 4.3Å; F388-W753 HydrophobicContact CD1-CH2 4.22Å; F388-W753 AromaticContact CD1-CZ3 3.71Å; F388-W753 HydrophobicContact CD1-CZ3 3.71Å; F388-W753 HydrophobicContact CD2-CE3 4.13Å; F388-W753 AromaticContact CD2-CH2 3.12Å; F388-W753 HydrophobicContact CD2-CH2 3.12Å; F388-W753 HydrophobicContact CD2-CZ2 4.28Å; F388-W753 AromaticContact CD2-CZ3 3.07Å; F388-W753 HydrophobicContact CD2-CZ3 3.07Å; F388-W753 HydrophobicContact CE1-CE3 4.35Å; F388-W753 HydrophobicContact CE1-CH2 4.5Å; F388-W753 AromaticContact CE1-CZ3 3.6Å; F388-W753 HydrophobicContact CE1-CZ3 3.6Å; F388-W753 AromaticContact CE2-CE3 3.65Å; F388-W753 HydrophobicContact CE2-CE3 3.65Å; F388-W753 AromaticContact CE2-CH2 3.55Å; F388-W753 HydrophobicContact CE2-CH2 3.55Å; F388-W753 AromaticContact CE2-CZ3 3Å; F388-W753 HydrophobicContact CE2-CZ3 3Å; F388-W753 AromaticContact CG-CH2 3.5Å; F388-W753 HydrophobicContact CG-CH2 3.5Å; F388-W753 AromaticContact CG-CZ3 3.42Å; F388-W753 HydrophobicContact CG-CZ3 3.42Å; F388-W753 VanDerWaalsContact CG-CZ3 3.42Å; F388-W753 AromaticContact CZ-CE3 3.77Å; F388-W753 HydrophobicContact CZ-CE3 3.77Å; F388-W753 HydrophobicContact CZ-CH2 4.22Å; F388-W753 AromaticContact CZ-CZ3 3.28Å; F388-W753 HydrophobicContact CZ-CZ3 3.28Å; V582-W753 HydrophobicContact CB-CB 4.41Å; V582-W753 HydrophobicContact CG2-CB 3.49Å; V582-W753 VanDerWaalsContact CG2-CB 3.49Å; V582-W753 HydrophobicContact CG2-CD2 4.43Å; V582-W753 HydrophobicContact CG2-CE3 3.93Å; V582-W753 HydrophobicContact CG2-CG 4.35Å; I750-W753 PolarHBondContact O-N 3.43Å; I750-W753 VanDerWaalsContact O-N 3.11Å; A751-W753 PolarHBondContact O-N 3.47Å; W753-D755 PolarHBondContact O-N 2.89Å; W753-I756 HydrophobicContact CB-CD1 3.85Å; W753-I756 HydrophobicContact CB-CG1 4.49Å; W753-I756 HydrophobicContact CD2-CD1 3.57Å; W753-I756 HydrophobicContact CE3-CD1 3.35Å; W753-I756 HydrophobicContact CG-CD1 3.78Å; W753-I756 HydrophobicContact CZ3-CD1 4.01Å; W753-I756 PolarHBondContact O-N 3.38Å
754	H	74.2	Confident	80.4	Confident	81 Å²	81	36.1 Å²	36.1	38%	0.375	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.3	-179.4	-178.5	76.9	0	0	0	112.5	P580 E583 I756	P580-H754 WeakPolarHBondContact CB-O 3.45Å; P580-H754 WeakPolarHBondContact CG-O 3.27Å; E583-H754 IonicContact OE1-CE1 3.65Å; E583-H754 PolarHBondContact OE1-CE1 3.3Å; E583-H754 IonicContact OE1-ND1 2.69Å; E583-H754 PolarHBondContact OE1-ND1 3.01Å; E583-H754 IonicContact OE2-CE1 3.38Å; H754-I756 VanDerWaalsContact C-N 3.34Å; H754-I756 PolarHBondContact O-N 3.43Å
755	D	73.4	Confident	81.1	Confident	99 Å²	99	35.9 Å²	35.9	53%	0.529	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5.5	-176	-62.4	-30.9	0	0	0	114.2	T209 W753 P757	T209-D755 VanDerWaalsContact CG2-OD2 3.28Å; T209-D755 WeakPolarHBondContact CG2-OD2 3.34Å; W753-D755 PolarHBondContact O-N 2.89Å; D755-P757 VanDerWaalsContact O-CD 3.24Å; D755-P757 WeakPolarHBondContact O-CD 3.41Å
756	I	78.1	Confident	82	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.015	22%	0.218	C	C	.	.			trans	-78.7	112	-178.2	-60.2	177.2	0	0	0	109.9	M199 M202 A203 F581 W753 H754	M199-I756 HydrophobicContact CB-CG2 4.1Å; M199-I756 HydrophobicContact CG-CG2 3.6Å; M199-I756 HydrophobicContact SD-CG2 4.42Å; M202-I756 HydrophobicContact CG-CG1 4.42Å; A203-I756 HydrophobicContact CB-CD1 3.75Å; F581-I756 PolarHBondContact N-O 3.36Å; W753-I756 HydrophobicContact CB-CD1 3.85Å; W753-I756 HydrophobicContact CB-CG1 4.49Å; W753-I756 HydrophobicContact CD2-CD1 3.57Å; W753-I756 HydrophobicContact CE3-CD1 3.35Å; W753-I756 HydrophobicContact CG-CD1 3.78Å; W753-I756 HydrophobicContact CZ3-CD1 4.01Å; W753-I756 PolarHBondContact O-N 3.38Å; H754-I756 VanDerWaalsContact C-N 3.34Å; H754-I756 PolarHBondContact O-N 3.43Å
757	P	81.2	Confident	83	Confident	70 Å²	70	41.1 Å²	41.1	46%	0.455	22%	0.218	S	C	.	.			trans	-71.9	140.5	-179.2	31.6	-32.9	0	0	0	110.3	M202 D755	M202-P757 HydrophobicContact CE-CG 4.14Å; M202-P757 WeakPolarHBondContact SD-CD 3.24Å; M202-P757 HydrophobicContact SD-CG 4.16Å; D755-P757 VanDerWaalsContact O-CD 3.24Å; D755-P757 WeakPolarHBondContact O-CD 3.41Å
758	C	87.2	Confident	83.8	Confident	3 Å²	3	39 Å²	39	2%	0.02	21%	0.212	C	C	.	.			trans	-110.1	-2.2	177.8	-172.2	0	0	0	0	113.5	C576 F581 S760 L761 R762	C576-C758 HydrophobicContact CB-CB 3.44Å; C576-C758 VanDerWaalsContact CB-CB 3.44Å; C576-C758 WeakPolarHBondContact CB-SG 3.32Å; C576-C758 WeakPolarHBondContact SG-CB 3.35Å; C576-C758 CovalentContact SG-SG 2.01Å; C576-C758 PolarHBondContact SG-SG 3.28Å; F581-C758 HydrophobicContact CB-CB 3.97Å; F581-C758 HydrophobicContact CD2-CB 4.35Å; F581-C758 VanDerWaalsContact CD2-SG 3.56Å; C758-S760 VanDerWaalsContact C-N 3.34Å; C758-S760 PolarHBondContact O-N 2.97Å; C758-L761 WeakPolarHBondContact O-CB 3.3Å; C758-L761 PolarHBondContact O-N 3.13Å; C758-L761 VanDerWaalsContact O-N 3.09Å; C758-R762 PolarHBondContact O-N 2.92Å; C758-R762 VanDerWaalsContact O-N 3.13Å
759	Q	91.1	Very high	84.8	Confident	107 Å²	107	40 Å²	40	50%	0.5	22%	0.218	S	C	.	.	H	α-helix	trans	-60.5	-40.7	-171.4	-172.4	177.4	3.4	0	0	113.1	L761 R762 L763	Q759-L761 VanDerWaalsContact C-N 3.31Å; Q759-L761 PolarHBondContact O-N 3.12Å; Q759-R762 WeakPolarHBondContact O-CB 3.31Å; Q759-R762 PolarHBondContact O-N 3.3Å; Q759-L763 HydrophobicContact CG-CD1 4.31Å; Q759-L763 WeakPolarHBondContact O-CG 3.36Å; Q759-L763 PolarHBondContact O-N 3.18Å
760	S	92.5	Very high	86	Confident	74 Å²	74	42 Å²	42	52%	0.517	23%	0.228	S	C	.	.	H	α-helix	trans	-62.4	-38.4	177.6	-53.9	0	0	0	0	112.1	C758 L763 A764	C758-S760 VanDerWaalsContact C-N 3.34Å; C758-S760 PolarHBondContact O-N 2.97Å; S760-L763 PolarHBondContact O-N 3.24Å; S760-A764 WeakPolarHBondContact O-CB 3.34Å; S760-A764 PolarHBondContact O-N 3.28Å
761	L	91.5	Very high	87.2	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-45.2	175.6	-163.9	60.3	0	0	0	111.8	F192 A195 L196 M199 I572 F581 C758 Q759 A764 A765	F192-L761 HydrophobicContact CD1-CD1 4.14Å; F192-L761 HydrophobicContact CD2-CD1 3.55Å; F192-L761 HydrophobicContact CD2-CG 4.28Å; F192-L761 HydrophobicContact CE1-CD1 4.02Å; F192-L761 HydrophobicContact CE2-CD1 3.36Å; F192-L761 HydrophobicContact CE2-CG 3.83Å; F192-L761 HydrophobicContact CG-CD1 3.95Å; F192-L761 HydrophobicContact CZ-CD1 3.63Å; F192-L761 HydrophobicContact CZ-CG 4.3Å; A195-L761 HydrophobicContact CB-CB 4.47Å; A195-L761 HydrophobicContact CB-CD1 4.32Å; L196-L761 HydrophobicContact CD2-CD1 3.81Å; L196-L761 HydrophobicContact CD2-CD2 4.3Å; L196-L761 HydrophobicContact CG-CD1 3.74Å; M199-L761 HydrophobicContact CE-CB 3.46Å; M199-L761 VanDerWaalsContact CE-CB 3.46Å; M199-L761 HydrophobicContact CE-CD1 4.09Å; M199-L761 HydrophobicContact CE-CD2 3.89Å; M199-L761 HydrophobicContact CE-CG 4.01Å; M199-L761 HydrophobicContact SD-CD2 4.34Å; I572-L761 HydrophobicContact CD1-CD2 4.32Å; I572-L761 HydrophobicContact CG1-CD2 4.13Å; I572-L761 HydrophobicContact CG2-CD2 4.49Å; I572-L761 HydrophobicContact CG2-CG 4.18Å; F581-L761 HydrophobicContact CD2-CD2 4.14Å; F581-L761 HydrophobicContact CE2-CD2 3.81Å; C758-L761 WeakPolarHBondContact O-CB 3.3Å; C758-L761 PolarHBondContact O-N 3.13Å; C758-L761 VanDerWaalsContact O-N 3.09Å; Q759-L761 VanDerWaalsContact C-N 3.31Å; Q759-L761 PolarHBondContact O-N 3.12Å; L761-A764 PolarHBondContact O-N 3.3Å; L761-A765 WeakPolarHBondContact O-CB 3.34Å; L761-A765 PolarHBondContact O-N 2.9Å
762	R	94.6	Very high	88.1	Confident	22 Å²	22	42.8 Å²	42.8	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-47.8	177	179.1	-177.5	82.3	109.7	-4.7	111	I572 C576 E577 C758 Q759 A764 A765 K766	I572-R762 WeakPolarHBondContact O-CB 3.39Å; I572-R762 WeakPolarHBondContact O-CG 3.42Å; C576-R762 HydrophobicContact CB-CB 4.07Å; E577-R762 VanDerWaalsContact CD-NH1 3.33Å; E577-R762 IonicContact OE1-CZ 3.16Å; E577-R762 IonicContact OE1-NH1 3.04Å; E577-R762 PolarHBondContact OE1-NH1 3.1Å; E577-R762 IonicContact OE1-NH2 2.77Å; E577-R762 PolarHBondContact OE1-NH2 2.9Å; E577-R762 IonicContact OE2-NH1 2.76Å; C758-R762 PolarHBondContact O-N 2.92Å; C758-R762 VanDerWaalsContact O-N 3.13Å; Q759-R762 WeakPolarHBondContact O-CB 3.31Å; Q759-R762 PolarHBondContact O-N 3.3Å; R762-A764 VanDerWaalsContact C-N 3.31Å; R762-A764 PolarHBondContact O-N 3.47Å; R762-A765 PolarHBondContact O-N 3.42Å; R762-K766 WeakPolarHBondContact O-CB 3.34Å; R762-K766 PolarHBondContact O-N 3.39Å
763	L	95.4	Very high	89.4	Confident	77 Å²	77	42.2 Å²	42.2	40%	0.403	23%	0.229	S	C	.	.	H	α-helix	trans	-60.8	-43	-179.6	-70.8	173.1	0	0	0	111.1	Q759 S760 K766 R767	Q759-L763 HydrophobicContact CG-CD1 4.31Å; Q759-L763 WeakPolarHBondContact O-CG 3.36Å; Q759-L763 PolarHBondContact O-N 3.18Å; S760-L763 PolarHBondContact O-N 3.24Å; L763-K766 PolarHBondContact O-N 3.17Å; L763-R767 WeakPolarHBondContact O-CB 3.26Å; L763-R767 PolarHBondContact O-N 3.37Å
764	A	94.8	Very high	90.6	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-49.9	174.9	0	0	0	0	0	112.2	S188 E191 F192 S760 L761 R762 K766 R767 G768	S188-A764 WeakPolarHBondContact CB-O 3.49Å; E191-A764 HydrophobicContact CB-CB 3.82Å; F192-A764 HydrophobicContact CB-CB 3.78Å; F192-A764 HydrophobicContact CD2-CB 4.2Å; F192-A764 HydrophobicContact CG-CB 4.47Å; S760-A764 WeakPolarHBondContact O-CB 3.34Å; S760-A764 PolarHBondContact O-N 3.28Å; L761-A764 PolarHBondContact O-N 3.3Å; R762-A764 VanDerWaalsContact C-N 3.31Å; R762-A764 PolarHBondContact O-N 3.47Å; A764-K766 PolarHBondContact O-N 3.06Å; A764-R767 PolarHBondContact O-N 3.32Å; A764-G768 PolarHBondContact O-N 3.26Å; A764-G768 VanDerWaalsContact O-N 3.14Å
765	A	93.6	Very high	91.6	Very high	20 Å²	20	42 Å²	42	17%	0.165	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-44	178	0	0	0	0	0	112.3	F192 I572 L573 L761 R762 R767 G768 V769	F192-A765 HydrophobicContact CD2-CB 4.15Å; F192-A765 HydrophobicContact CE2-CB 4.05Å; I572-A765 HydrophobicContact CG2-CB 3.5Å; L573-A765 HydrophobicContact CD2-CB 3.88Å; L761-A765 WeakPolarHBondContact O-CB 3.34Å; L761-A765 PolarHBondContact O-N 2.9Å; R762-A765 PolarHBondContact O-N 3.42Å; A765-R767 VanDerWaalsContact C-N 3.33Å; A765-R767 PolarHBondContact O-N 2.96Å; A765-G768 PolarHBondContact O-N 3.3Å; A765-G768 VanDerWaalsContact O-N 3.11Å; A765-V769 PolarHBondContact O-N 3.27Å
766	K	95.7	Very high	92.6	Very high	97 Å²	97	39.3 Å²	39.3	42%	0.422	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-41.5	177.1	-179.4	169.9	-179.7	169.3	0	111.4	L573 R762 L763 A764 G768 V769 D770	L573-K766 HydrophobicContact CD2-CB 4.37Å; R762-K766 WeakPolarHBondContact O-CB 3.34Å; R762-K766 PolarHBondContact O-N 3.39Å; L763-K766 PolarHBondContact O-N 3.17Å; A764-K766 PolarHBondContact O-N 3.06Å; K766-G768 VanDerWaalsContact C-N 3.28Å; K766-G768 PolarHBondContact O-N 3.09Å; K766-V769 WeakPolarHBondContact O-CB 3.27Å; K766-V769 PolarHBondContact O-N 3.25Å; K766-D770 WeakPolarHBondContact O-CB 3.43Å; K766-D770 VanDerWaalsContact O-CG 3.31Å; K766-D770 PolarHBondContact O-N 3.45Å
767	R	96.1	Very high	93.4	Very high	61 Å²	61	39.2 Å²	39.2	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-37.5	174.7	-170.6	-179.8	-58.7	96.9	-15.2	112.2	Q184 E191 L763 A764 A765 D770 S771	Q184-R767 HydrophobicContact CG-CG 3.66Å; E191-R767 VanDerWaalsContact CD-CZ 3.42Å; E191-R767 VanDerWaalsContact CD-NH2 3.26Å; E191-R767 IonicContact OE1-CZ 2.67Å; E191-R767 IonicContact OE1-NE 2.79Å; E191-R767 IonicContact OE1-NH1 2.78Å; E191-R767 PolarHBondContact OE1-NH1 2.88Å; E191-R767 IonicContact OE1-NH2 3.13Å; E191-R767 PolarHBondContact OE1-NH2 2.93Å; E191-R767 IonicContact OE2-CZ 3.18Å; E191-R767 IonicContact OE2-NH1 3.27Å; E191-R767 PolarHBondContact OE2-NH1 3.34Å; E191-R767 IonicContact OE2-NH2 2.91Å; E191-R767 PolarHBondContact OE2-NH2 3.02Å; L763-R767 WeakPolarHBondContact O-CB 3.26Å; L763-R767 PolarHBondContact O-N 3.37Å; A764-R767 PolarHBondContact O-N 3.32Å; A765-R767 VanDerWaalsContact C-N 3.33Å; A765-R767 PolarHBondContact O-N 2.96Å; R767-D770 PolarHBondContact O-N 3.16Å; R767-S771 WeakPolarHBondContact O-CB 3.5Å; R767-S771 PolarHBondContact O-N 3Å
768	G	93.8	Very high	94.1	Very high	19 Å²	19	36.3 Å²	36.3	20%	0.196	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-41.7	174.1	0	0	0	0	0	112.5	S188 A764 A765 K766 S771 V772	S188-G768 VanDerWaalsContact CB-N 3.32Å; S188-G768 VanDerWaalsContact OG-CA 3.3Å; S188-G768 WeakPolarHBondContact OG-CA 3.38Å; A764-G768 PolarHBondContact O-N 3.26Å; A764-G768 VanDerWaalsContact O-N 3.14Å; A765-G768 PolarHBondContact O-N 3.3Å; A765-G768 VanDerWaalsContact O-N 3.11Å; K766-G768 VanDerWaalsContact C-N 3.28Å; K766-G768 PolarHBondContact O-N 3.09Å; G768-S771 WeakPolarHBondContact O-CB 3.26Å; G768-V772 PolarHBondContact O-N 3.38Å
769	V	95.5	Very high	94.5	Very high	20 Å²	20	36.2 Å²	36.2	12%	0.121	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-49.1	173	172.4	0	0	0	0	110.9	L508 T509 L573 A765 K766 S771 V772 C773	L508-V769 HydrophobicContact CB-CG1 3.63Å; L508-V769 HydrophobicContact CB-CG2 4.16Å; L508-V769 HydrophobicContact CD1-CG2 4.25Å; T509-V769 HydrophobicContact CG2-CG1 3.84Å; L573-V769 HydrophobicContact CD1-CG2 4.18Å; L573-V769 HydrophobicContact CD2-CG2 4.27Å; A765-V769 PolarHBondContact O-N 3.27Å; K766-V769 WeakPolarHBondContact O-CB 3.27Å; K766-V769 PolarHBondContact O-N 3.25Å; V769-S771 VanDerWaalsContact C-N 3.29Å; V769-S771 PolarHBondContact O-N 3.2Å; V769-V772 PolarHBondContact O-N 3.41Å; V769-V772 VanDerWaalsContact O-N 3.17Å; V769-C773 HydrophobicContact CG1-CB 4.38Å; V769-C773 VanDerWaalsContact O-CB 3.23Å; V769-C773 WeakPolarHBondContact O-CB 3.35Å; V769-C773 PolarHBondContact O-N 3.47Å; V769-C773 PolarHBondContact O-SG 2.87Å
770	D	95.7	Very high	94.8	Very high	45 Å²	45	32.5 Å²	32.5	24%	0.241	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-35.3	-178	-70.7	-19.6	0	0	0	111.6	K766 R767 V772 Y774 T775	K766-D770 WeakPolarHBondContact O-CB 3.43Å; K766-D770 VanDerWaalsContact O-CG 3.31Å; K766-D770 PolarHBondContact O-N 3.45Å; R767-D770 PolarHBondContact O-N 3.16Å; D770-V772 VanDerWaalsContact C-N 3.33Å; D770-V772 PolarHBondContact O-N 3.35Å; D770-Y774 CarbonylContact O-C 3.56Å; D770-Y774 WeakPolarHBondContact O-CA 3.32Å; D770-Y774 WeakPolarHBondContact O-CB 3.12Å; D770-Y774 PolarHBondContact O-N 2.88Å; D770-T775 PolarHBondContact O-N 3.42Å
771	S	95.1	Very high	95	Very high	3 Å²	3	29 Å²	29	2%	0.021	15%	0.146	C	C	.	.	I	π-helix	trans	-53.5	-47.7	172.2	166.2	0	0	0	0	112.9	A181 A185 R767 G768 V769 T775 F776	A181-S771 PolarHBondContact O-OG 3.19Å; A185-S771 PolarHBondContact N-OG 3.19Å; R767-S771 WeakPolarHBondContact O-CB 3.5Å; R767-S771 PolarHBondContact O-N 3Å; G768-S771 WeakPolarHBondContact O-CB 3.26Å; V769-S771 VanDerWaalsContact C-N 3.29Å; V769-S771 PolarHBondContact O-N 3.2Å; S771-T775 WeakPolarHBondContact O-CB 3.44Å; S771-F776 PolarHBondContact O-N 2.86Å
772	V	93.2	Very high	95.2	Very high	76 Å²	76	29 Å²	29	46%	0.461	15%	0.147	S	C	.	.	I	π-helix	trans	-79.8	-47.8	-178.8	-179.6	0	0	0	0	110.8	G768 V769 D770 L777	G768-V772 PolarHBondContact O-N 3.38Å; V769-V772 PolarHBondContact O-N 3.41Å; V769-V772 VanDerWaalsContact O-N 3.17Å; D770-V772 VanDerWaalsContact C-N 3.33Å; D770-V772 PolarHBondContact O-N 3.35Å; V772-L777 HydrophobicContact CG1-CD1 4.47Å; V772-L777 WeakPolarHBondContact O-CB 3.28Å; V772-L777 WeakPolarHBondContact O-CG 3.47Å; V772-L777 PolarHBondContact O-N 2.99Å
773	C	95.7	Very high	95.3	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.027	15%	0.146	C	C	.	.	I	π-helix	trans	-85.3	-32.3	-166.7	-67.4	0	0	0	0	114.7	C505 T509 V769 M778	C505-C773 WeakPolarHBondContact CA-SG 3.34Å; C505-C773 HydrophobicContact CB-CB 3.5Å; C505-C773 VanDerWaalsContact CB-CB 3.5Å; C505-C773 WeakPolarHBondContact CB-SG 3.14Å; C505-C773 WeakPolarHBondContact SG-CA 3.33Å; C505-C773 WeakPolarHBondContact SG-CB 3.24Å; C505-C773 CovalentContact SG-SG 2.03Å; C505-C773 PolarHBondContact SG-SG 3.18Å; T509-C773 HydrophobicContact CG2-CB 3.55Å; V769-C773 HydrophobicContact CG1-CB 4.38Å; V769-C773 VanDerWaalsContact O-CB 3.23Å; V769-C773 WeakPolarHBondContact O-CB 3.35Å; V769-C773 PolarHBondContact O-N 3.47Å; V769-C773 PolarHBondContact O-SG 2.87Å; C773-M778 WeakPolarHBondContact O-CG 3.41Å
774	Y	94.4	Very high	95.3	Very high	77 Å²	77	25.6 Å²	25.6	30%	0.302	13%	0.129	S	C	.	.	I	π-helix	trans	-100.8	-59.3	-179.9	-169.1	-89	0	0	0	109.4	D770 M778	D770-Y774 CarbonylContact O-C 3.56Å; D770-Y774 WeakPolarHBondContact O-CA 3.32Å; D770-Y774 WeakPolarHBondContact O-CB 3.12Å; D770-Y774 PolarHBondContact O-N 2.88Å; Y774-M778 HydrophobicContact CD1-CE 3.51Å; Y774-M778 HydrophobicContact CD2-CE 3.1Å; Y774-M778 HydrophobicContact CD2-SD 3.41Å; Y774-M778 WeakPolarHBondContact CD2-SD 3.41Å; Y774-M778 HydrophobicContact CE1-CE 3.48Å; Y774-M778 VanDerWaalsContact CE1-CE 3.48Å; Y774-M778 HydrophobicContact CE2-CE 3.1Å; Y774-M778 HydrophobicContact CE2-SD 3.67Å; Y774-M778 HydrophobicContact CG-CE 3.3Å; Y774-M778 HydrophobicContact CG-SD 4Å; Y774-M778 VanDerWaalsContact O-CB 3.29Å; Y774-M778 WeakPolarHBondContact O-CB 3.23Å; Y774-M778 WeakPolarHBondContact O-CE 3.39Å; Y774-M778 WeakPolarHBondContact O-CG 3.3Å; Y774-M778 PolarHBondContact O-N 3.41Å
775	T	94.8	Very high	95.3	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.012	13%	0.132	C	C	.	.	I	π-helix	trans	-70.4	-44.6	-170	-61.4	0	0	0	0	113.1	R38 A171 I179 A181 Q184 D770 S771 P779	R38-T775 PolarHBondContact NH2-O 3.43Å; A171-T775 HydrophobicContact CB-CG2 4.16Å; A171-T775 WeakPolarHBondContact CB-O 3.24Å; I179-T775 WeakPolarHBondContact O-CG2 3.25Å; A181-T775 HydrophobicContact CB-CG2 3.92Å; Q184-T775 PolarHBondContact OE1-OG1 3.27Å; D770-T775 PolarHBondContact O-N 3.42Å; S771-T775 WeakPolarHBondContact O-CB 3.44Å; T775-P779 WeakPolarHBondContact O-CG 3.27Å
776	F	94.9	Very high	95.4	Very high	44 Å²	44	25.5 Å²	25.5	19%	0.193	13%	0.128	C	C	.	.	I	π-helix	trans	-86.8	-56.3	178.1	173.9	-86.6	0	0	0	113	F168 L172 A181 S771 M778 F780	F168-F776 AromaticContact CE2-CD2 3.77Å; F168-F776 HydrophobicContact CE2-CD2 3.77Å; F168-F776 AromaticContact CE2-CE2 3.57Å; F168-F776 HydrophobicContact CE2-CE2 3.57Å; F168-F776 HydrophobicContact CE2-CG 4.36Å; F168-F776 AromaticContact CE2-CZ 3.97Å; F168-F776 HydrophobicContact CE2-CZ 3.97Å; F168-F776 AromaticContact CZ-CE2 3.94Å; F168-F776 HydrophobicContact CZ-CE2 3.94Å; F168-F776 HydrophobicContact CZ-CZ 4.26Å; L172-F776 HydrophobicContact CD2-CD2 3.67Å; L172-F776 HydrophobicContact CD2-CE2 3.66Å; A181-F776 HydrophobicContact CB-CB 3.9Å; S771-F776 PolarHBondContact O-N 2.86Å; F776-M778 PolarHBondContact O-N 3.16Å; F776-F780 WeakPolarHBondContact O-CB 3.15Å
777	L	95.8	Very high	95.4	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-73.6	-30.6	-167.1	-85.3	175.3	0	0	0	114.9	L500 C505 V772 N781	L500-L777 HydrophobicContact CB-CD1 3.84Å; L500-L777 HydrophobicContact CB-CD2 4.2Å; L500-L777 HydrophobicContact CD1-CD2 4.25Å; C505-L777 WeakPolarHBondContact SG-CD1 3.29Å; V772-L777 HydrophobicContact CG1-CD1 4.47Å; V772-L777 WeakPolarHBondContact O-CB 3.28Å; V772-L777 WeakPolarHBondContact O-CG 3.47Å; V772-L777 PolarHBondContact O-N 2.99Å; L777-N781 VanDerWaalsContact O-CB 3.25Å; L777-N781 WeakPolarHBondContact O-CB 3.48Å; L777-N781 VanDerWaalsContact O-CG 3.26Å; L777-N781 PolarHBondContact O-N 3.37Å; L777-N781 PolarHBondContact O-ND2 3.49Å; L777-N781 VanDerWaalsContact O-ND2 3.13Å
778	M	95.3	Very high	95.4	Very high	9 Å²	9	19.1 Å²	19.1	4%	0.044	11%	0.108	C	C	.	.	H	α-helix	trans	-69.5	-51.4	-176.4	-65.3	-165.9	-44.4	0	0	114.1	Y45 C773 Y774 F776 F780 N781 A782	Y45-M778 HydrophobicContact CD1-CB 3.66Å; Y45-M778 HydrophobicContact CD2-CB 4.13Å; Y45-M778 HydrophobicContact CD2-CE 3.31Å; Y45-M778 HydrophobicContact CD2-SD 3.92Å; Y45-M778 HydrophobicContact CE1-CB 3.95Å; Y45-M778 HydrophobicContact CE2-CB 4.39Å; Y45-M778 HydrophobicContact CE2-CE 3.57Å; Y45-M778 HydrophobicContact CG-CB 3.77Å; Y45-M778 HydrophobicContact CG-CE 3.93Å; Y45-M778 HydrophobicContact CG-CG 4.41Å; Y45-M778 HydrophobicContact CG-SD 4Å; C773-M778 WeakPolarHBondContact O-CG 3.41Å; Y774-M778 HydrophobicContact CD1-CE 3.51Å; Y774-M778 HydrophobicContact CD2-CE 3.1Å; Y774-M778 HydrophobicContact CD2-SD 3.41Å; Y774-M778 WeakPolarHBondContact CD2-SD 3.41Å; Y774-M778 HydrophobicContact CE1-CE 3.48Å; Y774-M778 VanDerWaalsContact CE1-CE 3.48Å; Y774-M778 HydrophobicContact CE2-CE 3.1Å; Y774-M778 HydrophobicContact CE2-SD 3.67Å; Y774-M778 HydrophobicContact CG-CE 3.3Å; Y774-M778 HydrophobicContact CG-SD 4Å; Y774-M778 VanDerWaalsContact O-CB 3.29Å; Y774-M778 WeakPolarHBondContact O-CB 3.23Å; Y774-M778 WeakPolarHBondContact O-CE 3.39Å; Y774-M778 WeakPolarHBondContact O-CG 3.3Å; Y774-M778 PolarHBondContact O-N 3.41Å; F776-M778 PolarHBondContact O-N 3.16Å; M778-F780 VanDerWaalsContact C-N 3.27Å; M778-F780 PolarHBondContact O-N 2.96Å; M778-N781 PolarHBondContact O-N 3.13Å; M778-N781 VanDerWaalsContact O-N 3.14Å; M778-A782 WeakPolarHBondContact O-CB 3.44Å; M778-A782 PolarHBondContact O-N 3.37Å
779	P	96.3	Very high	95.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.8	-38.2	175.1	24.9	-34	0	0	0	111.6	Y45 N164 L167 F168 T775 N781 A782 F783	Y45-P779 HydrophobicContact CE1-CB 4.26Å; N164-P779 WeakPolarHBondContact O-CB 3.5Å; L167-P779 HydrophobicContact CB-CB 4.05Å; F168-P779 HydrophobicContact CB-CB 4.04Å; F168-P779 HydrophobicContact CB-CG 4.31Å; T775-P779 WeakPolarHBondContact O-CG 3.27Å; P779-N781 VanDerWaalsContact C-N 3.31Å; P779-N781 PolarHBondContact O-N 2.87Å; P779-A782 PolarHBondContact O-N 3.45Å; P779-F783 WeakPolarHBondContact O-CB 3.33Å; P779-F783 PolarHBondContact O-N 3.21Å
780	F	95.9	Very high	95.4	Very high	29 Å²	29	22 Å²	22	13%	0.127	11%	0.114	C	C	.	.	H	α-helix	trans	-56.9	-43.9	172.8	-173.7	-99.8	0	0	0	112.4	F168 P493 F496 F776 M778 W784	F168-F780 HydrophobicContact CD1-CD2 4.38Å; F168-F780 HydrophobicContact CD2-CB 3.82Å; F168-F780 HydrophobicContact CD2-CD2 4.13Å; F168-F780 HydrophobicContact CD2-CG 4.47Å; F168-F780 AromaticContact CE1-CD2 3.93Å; F168-F780 HydrophobicContact CE1-CD2 3.93Å; F168-F780 HydrophobicContact CE1-CE2 4.44Å; F168-F780 HydrophobicContact CE2-CB 3.89Å; F168-F780 AromaticContact CE2-CD2 3.65Å; F168-F780 HydrophobicContact CE2-CD2 3.65Å; F168-F780 HydrophobicContact CE2-CG 4.16Å; F168-F780 HydrophobicContact CG-CD2 4.46Å; F168-F780 AromaticContact CZ-CD2 3.54Å; F168-F780 HydrophobicContact CZ-CD2 3.54Å; F168-F780 HydrophobicContact CZ-CE2 4.12Å; F168-F780 HydrophobicContact CZ-CG 4.47Å; P493-F780 HydrophobicContact CB-CE1 3.73Å; P493-F780 HydrophobicContact CB-CE2 4.27Å; P493-F780 HydrophobicContact CB-CZ 3.56Å; P493-F780 HydrophobicContact CG-CZ 4.2Å; P493-F780 WeakPolarHBondContact O-CE1 3.42Å; F496-F780 AromaticContact CD1-CE1 3.99Å; F496-F780 HydrophobicContact CD1-CE1 3.99Å; F496-F780 HydrophobicContact CD1-CZ 4.14Å; F776-F780 WeakPolarHBondContact O-CB 3.15Å; M778-F780 VanDerWaalsContact C-N 3.27Å; M778-F780 PolarHBondContact O-N 2.96Å; F780-W784 VanDerWaalsContact O-CD1 3.26Å
781	N	96.6	Very high	95.5	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-74.5	-35.9	180	-77.2	-34.8	0	0	0	113.8	G497 G498 L777 M778 P779 F783 W784 T785	G497-N781 VanDerWaalsContact CA-OD1 3.27Å; G497-N781 WeakPolarHBondContact CA-OD1 3.41Å; G497-N781 PolarHBondContact O-ND2 3.47Å; G497-N781 VanDerWaalsContact O-ND2 3.13Å; G497-N781 PolarHBondContact O-OD1 3.32Å; G498-N781 PolarHBondContact N-OD1 3.16Å; L777-N781 VanDerWaalsContact O-CB 3.25Å; L777-N781 WeakPolarHBondContact O-CB 3.48Å; L777-N781 VanDerWaalsContact O-CG 3.26Å; L777-N781 PolarHBondContact O-N 3.37Å; L777-N781 PolarHBondContact O-ND2 3.49Å; L777-N781 VanDerWaalsContact O-ND2 3.13Å; M778-N781 PolarHBondContact O-N 3.13Å; M778-N781 VanDerWaalsContact O-N 3.14Å; P779-N781 VanDerWaalsContact C-N 3.31Å; P779-N781 PolarHBondContact O-N 2.87Å; N781-F783 VanDerWaalsContact C-N 3.35Å; N781-W784 VanDerWaalsContact CA-NE1 3.32Å; N781-W784 HydrophobicContact CB-CZ2 4.4Å; N781-W784 PolarHBondContact O-NE1 2.87Å; N781-W784 PolarHBondContact OD1-NE1 3.2Å; N781-T785 WeakPolarHBondContact O-CB 3.43Å; N781-T785 PolarHBondContact O-N 2.96Å; N781-T785 VanDerWaalsContact O-N 3.13Å; N781-T785 PolarHBondContact O-OG1 2.89Å
782	A	96.7	Very high	95.5	Very high	2 Å²	2	25 Å²	25	2%	0.017	13%	0.129	C	C	.	.	H	α-helix	trans	-71.2	-30.3	176.9	0	0	0	0	0	113	Y45 S48 N164 M778 P779 T785 G786	Y45-A782 HydrophobicContact CD1-CB 3.73Å; Y45-A782 HydrophobicContact CE1-CB 3.96Å; S48-A782 WeakPolarHBondContact OG-CA 3.15Å; N164-A782 HydrophobicContact CB-CB 4.04Å; N164-A782 VanDerWaalsContact CG-CB 3.45Å; N164-A782 WeakPolarHBondContact ND2-CB 3.43Å; M778-A782 WeakPolarHBondContact O-CB 3.44Å; M778-A782 PolarHBondContact O-N 3.37Å; P779-A782 PolarHBondContact O-N 3.45Å; A782-T785 PolarHBondContact O-N 3.3Å; A782-G786 PolarHBondContact O-N 3.19Å
783	F	95.9	Very high	95.6	Very high	14 Å²	14	23.4 Å²	23.4	6%	0.061	12%	0.118	C	C	.	.	H	α-helix	trans	-55.4	-58.8	171.9	161.8	-105.8	0	0	0	111.9	A161 N164 H165 L433 P779 N781 T785 G786 L787	A161-F783 HydrophobicContact CB-CD2 4.28Å; N164-F783 HydrophobicContact CB-CB 4.44Å; H165-F783 HydrophobicContact CB-CD2 3.82Å; H165-F783 HydrophobicContact CB-CE2 4.29Å; L433-F783 HydrophobicContact CD1-CD2 4.4Å; L433-F783 HydrophobicContact CD1-CE2 3.96Å; L433-F783 HydrophobicContact CD2-CE2 4.03Å; L433-F783 HydrophobicContact CG-CE2 4.08Å; P779-F783 WeakPolarHBondContact O-CB 3.33Å; P779-F783 PolarHBondContact O-N 3.21Å; N781-F783 VanDerWaalsContact C-N 3.35Å; F783-T785 VanDerWaalsContact C-N 3.28Å; F783-T785 PolarHBondContact O-N 3.14Å; F783-G786 PolarHBondContact O-N 3.48Å; F783-L787 HydrophobicContact CZ-CD2 4.42Å; F783-L787 PolarHBondContact O-N 3.29Å; F783-L787 VanDerWaalsContact O-N 3.1Å
784	W	95.5	Very high	95.7	Very high	13 Å²	13	23.2 Å²	23.2	5%	0.049	12%	0.117	C	C	.	.	H	α-helix	trans	-71.6	-27	-177.3	68.2	-105.9	0	0	0	112.2	F51 L52 P493 F494 F780 N781 G788	F51-W784 AromaticContact CD1-CH2 3.84Å; F51-W784 HydrophobicContact CD1-CH2 3.84Å; F51-W784 HydrophobicContact CD1-CZ3 4.21Å; F51-W784 AromaticContact CE1-CH2 3.95Å; F51-W784 HydrophobicContact CE1-CH2 3.95Å; F51-W784 HydrophobicContact CE1-CZ3 4.03Å; L52-W784 HydrophobicContact CD1-CZ2 4.28Å; L52-W784 HydrophobicContact CD2-CH2 3.97Å; L52-W784 HydrophobicContact CD2-CZ2 3.89Å; L52-W784 HydrophobicContact CG-CH2 4.37Å; L52-W784 HydrophobicContact CG-CZ2 4.26Å; P493-W784 HydrophobicContact CB-CB 3.96Å; P493-W784 HydrophobicContact CB-CG 4Å; F494-W784 HydrophobicContact CB-CD2 3.91Å; F494-W784 HydrophobicContact CB-CE3 3.96Å; F494-W784 HydrophobicContact CB-CG 4.44Å; F494-W784 HydrophobicContact CB-CZ3 4.33Å; F494-W784 HydrophobicContact CD2-CD2 4.42Å; F494-W784 HydrophobicContact CD2-CE3 4.09Å; F494-W784 AromaticContact CD2-CH2 3.42Å; F494-W784 HydrophobicContact CD2-CH2 3.42Å; F494-W784 VanDerWaalsContact CD2-CH2 3.42Å; F494-W784 AromaticContact CD2-CZ2 3.72Å; F494-W784 HydrophobicContact CD2-CZ2 3.72Å; F494-W784 AromaticContact CD2-CZ3 3.58Å; F494-W784 HydrophobicContact CD2-CZ3 3.58Å; F494-W784 HydrophobicContact CE2-CH2 4.01Å; F494-W784 HydrophobicContact CE2-CZ3 4.32Å; F494-W784 HydrophobicContact CG-CE3 4.43Å; F494-W784 HydrophobicContact CG-CH2 4.46Å; F494-W784 HydrophobicContact CG-CZ3 4.32Å; F780-W784 VanDerWaalsContact O-CD1 3.26Å; N781-W784 VanDerWaalsContact CA-NE1 3.32Å; N781-W784 HydrophobicContact CB-CZ2 4.4Å; N781-W784 PolarHBondContact O-NE1 2.87Å; N781-W784 PolarHBondContact OD1-NE1 3.2Å; W784-G788 PolarHBondContact O-N 3.28Å
785	T	96	Very high	95.7	Very high	11 Å²	11	23.6 Å²	23.6	7%	0.067	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-48.9	173.6	-62.8	0	0	0	0	110.5	I47 S48 N781 A782 F783 G788 F789	I47-T785 HydrophobicContact CG2-CG2 4.23Å; S48-T785 WeakPolarHBondContact OG-CB 3.25Å; S48-T785 PolarHBondContact OG-OG1 3.03Å; N781-T785 WeakPolarHBondContact O-CB 3.43Å; N781-T785 PolarHBondContact O-N 2.96Å; N781-T785 VanDerWaalsContact O-N 3.13Å; N781-T785 PolarHBondContact O-OG1 2.89Å; A782-T785 PolarHBondContact O-N 3.3Å; F783-T785 VanDerWaalsContact C-N 3.28Å; F783-T785 PolarHBondContact O-N 3.14Å; T785-G788 PolarHBondContact O-N 2.94Å; T785-F789 HydrophobicContact CG2-CD2 3.88Å; T785-F789 HydrophobicContact CG2-CE2 3.77Å; T785-F789 VanDerWaalsContact O-CD2 3.3Å; T785-F789 WeakPolarHBondContact O-CD2 3.37Å; T785-F789 PolarHBondContact O-N 2.8Å
786	G	95.1	Very high	95.8	Very high	8 Å²	8	25.3 Å²	25.3	8%	0.082	13%	0.134	C	C	.	.	H	α-helix	trans	-60.9	-45	176.5	0	0	0	0	0	112.7	A782 F783 G788 F789 T790	A782-G786 PolarHBondContact O-N 3.19Å; F783-G786 PolarHBondContact O-N 3.48Å; G786-G788 VanDerWaalsContact C-N 3.33Å; G786-G788 PolarHBondContact O-N 3.33Å; G786-F789 PolarHBondContact O-N 3.45Å; G786-T790 PolarHBondContact O-N 3.06Å; G786-T790 VanDerWaalsContact O-N 3.16Å; G786-T790 PolarHBondContact O-OG1 2.87Å
787	L	95.4	Very high	95.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.3	-39.3	175.6	-174.8	61.1	0	0	0	112.1	L433 L486 C490 F783 T790 L791	L433-L787 HydrophobicContact CD2-CD1 4.39Å; L486-L787 HydrophobicContact CD2-CD1 4.37Å; C490-L787 VanDerWaalsContact SG-CB 3.59Å; C490-L787 VanDerWaalsContact SG-CD2 3.56Å; C490-L787 WeakPolarHBondContact SG-CG 3.49Å; F783-L787 HydrophobicContact CZ-CD2 4.42Å; F783-L787 PolarHBondContact O-N 3.29Å; F783-L787 VanDerWaalsContact O-N 3.1Å; L787-T790 WeakPolarHBondContact O-CB 3.4Å; L787-T790 PolarHBondContact O-N 3.45Å; L787-L791 HydrophobicContact CG-CD1 4.35Å; L787-L791 WeakPolarHBondContact O-CG 3.41Å; L787-L791 PolarHBondContact O-N 3.39Å
788	G	95.2	Very high	95.9	Very high	23 Å²	23	24 Å²	24	24%	0.237	13%	0.129	C	C	.	.	H	α-helix	trans	-63.6	-43.8	177.5	0	0	0	0	0	112.9	C490 W784 T785 G786 T790 L791 L792	C490-G788 PolarHBondContact SG-N 3Å; W784-G788 PolarHBondContact O-N 3.28Å; T785-G788 PolarHBondContact O-N 2.94Å; G786-G788 VanDerWaalsContact C-N 3.33Å; G786-G788 PolarHBondContact O-N 3.33Å; G788-T790 VanDerWaalsContact C-N 3.31Å; G788-T790 PolarHBondContact O-N 3.15Å; G788-L791 PolarHBondContact O-N 3.28Å; G788-L792 PolarHBondContact O-N 3.39Å
789	F	95.2	Very high	95.9	Very high	100 Å²	100	27.4 Å²	27.4	44%	0.439	15%	0.147	S	C	.	.	H	α-helix	trans	-60.2	-41.7	173.9	-89.8	-72.5	0	0	0	112.1	I47 A157 T785 G786 L791 L792 L793	I47-F789 HydrophobicContact CG2-CE2 3.85Å; I47-F789 HydrophobicContact CG2-CZ 4.32Å; A157-F789 HydrophobicContact CB-CB 4.19Å; T785-F789 HydrophobicContact CG2-CD2 3.88Å; T785-F789 HydrophobicContact CG2-CE2 3.77Å; T785-F789 VanDerWaalsContact O-CD2 3.3Å; T785-F789 WeakPolarHBondContact O-CD2 3.37Å; T785-F789 PolarHBondContact O-N 2.8Å; G786-F789 PolarHBondContact O-N 3.45Å; F789-L791 PolarHBondContact O-N 2.91Å; F789-L792 PolarHBondContact O-N 3.22Å; F789-L793 WeakPolarHBondContact O-CG 3.35Å; F789-L793 PolarHBondContact O-N 3.03Å
790	T	95.7	Very high	95.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.9	-46.2	175.5	-72.4	0	0	0	0	112.3	Q154 A157 V158 P436 F440 G786 L787 G788 L793 F794	Q154-T790 HydrophobicContact CB-CG2 4.46Å; Q154-T790 PolarHBondContact NE2-O 2.92Å; Q154-T790 PolarHBondContact O-OG1 2.96Å; A157-T790 WeakPolarHBondContact CB-OG1 3.34Å; V158-T790 HydrophobicContact CG2-CG2 3.66Å; V158-T790 WeakPolarHBondContact CG2-OG1 3.46Å; P436-T790 HydrophobicContact CB-CG2 4.28Å; F440-T790 HydrophobicContact CE1-CG2 4.39Å; F440-T790 HydrophobicContact CZ-CG2 3.65Å; G786-T790 PolarHBondContact O-N 3.06Å; G786-T790 VanDerWaalsContact O-N 3.16Å; G786-T790 PolarHBondContact O-OG1 2.87Å; L787-T790 WeakPolarHBondContact O-CB 3.4Å; L787-T790 PolarHBondContact O-N 3.45Å; G788-T790 VanDerWaalsContact C-N 3.31Å; G788-T790 PolarHBondContact O-N 3.15Å; T790-L793 PolarHBondContact O-N 3.39Å; T790-F794 HydrophobicContact CG2-CE1 3.83Å; T790-F794 HydrophobicContact CG2-CZ 4.23Å; T790-F794 WeakPolarHBondContact O-CD1 3.27Å; T790-F794 PolarHBondContact O-N 2.93Å
791	L	96.3	Very high	95.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-40.2	179.5	-71	167.4	0	0	0	112.3	F104 L486 M487 L787 G788 F789 L793 F794	F104-L791 HydrophobicContact CE1-CB 4.31Å; F104-L791 HydrophobicContact CE1-CD2 4.14Å; F104-L791 HydrophobicContact CZ-CB 4.09Å; F104-L791 HydrophobicContact CZ-CD2 4.34Å; F104-L791 WeakPolarHBondContact CZ-O 3.46Å; L486-L791 HydrophobicContact CB-CD1 4.09Å; L486-L791 HydrophobicContact CB-CD2 3.67Å; L486-L791 HydrophobicContact CB-CG 4.36Å; L486-L791 HydrophobicContact CD1-CD2 4.12Å; M487-L791 HydrophobicContact CB-CD1 4.18Å; M487-L791 HydrophobicContact CE-CB 4.14Å; M487-L791 HydrophobicContact CE-CD1 4.01Å; M487-L791 HydrophobicContact SD-CD1 4.28Å; L787-L791 HydrophobicContact CG-CD1 4.35Å; L787-L791 WeakPolarHBondContact O-CG 3.41Å; L787-L791 PolarHBondContact O-N 3.39Å; G788-L791 PolarHBondContact O-N 3.28Å; F789-L791 PolarHBondContact O-N 2.91Å; L791-L793 PolarHBondContact O-N 3.01Å; L791-F794 HydrophobicContact CD2-CD2 3.79Å; L791-F794 HydrophobicContact CD2-CE2 3.52Å; L791-F794 HydrophobicContact CD2-CZ 4.25Å; L791-F794 VanDerWaalsContact O-CB 3.31Å; L791-F794 WeakPolarHBondContact O-CB 3.49Å; L791-F794 PolarHBondContact O-N 3.48Å
792	L	94.7	Very high	95.6	Very high	112 Å²	112	29.7 Å²	29.7	59%	0.586	16%	0.159	S	C	*	.	H	α-helix	trans	-59.5	-39.3	176.3	-174.3	145.9	0	0	0	111.3	G788 F789 F794	G788-L792 PolarHBondContact O-N 3.39Å; F789-L792 PolarHBondContact O-N 3.22Å; L792-F794 VanDerWaalsContact C-N 3.29Å; L792-F794 PolarHBondContact O-N 3.36Å
793	L	96.8	Very high	95.3	Very high	42 Å²	42	34.6 Å²	34.6	22%	0.22	18%	0.18	C	C	.	.	H	α-helix	trans	-76.4	-8.5	177.4	-69.9	179.2	0	0	0	114.2	I150 F153 Q154 F789 T790 L791 I795 P796 A797	I150-L793 HydrophobicContact CG2-CB 4.12Å; F153-L793 HydrophobicContact CB-CD1 3.99Å; Q154-L793 HydrophobicContact CG-CB 3.46Å; Q154-L793 VanDerWaalsContact CG-CB 3.46Å; Q154-L793 HydrophobicContact CG-CD1 3.72Å; Q154-L793 HydrophobicContact CG-CG 4.25Å; Q154-L793 VanDerWaalsContact NE2-CB 3.33Å; Q154-L793 PolarHBondContact NE2-O 3.18Å; F789-L793 WeakPolarHBondContact O-CG 3.35Å; F789-L793 PolarHBondContact O-N 3.03Å; T790-L793 PolarHBondContact O-N 3.39Å; L791-L793 PolarHBondContact O-N 3.01Å; L793-I795 VanDerWaalsContact C-N 3.28Å; L793-I795 PolarHBondContact O-N 2.77Å; L793-P796 HydrophobicContact CD2-CG 4.21Å; L793-P796 VanDerWaalsContact O-CD 3.3Å; L793-P796 WeakPolarHBondContact O-CD 3.13Å; L793-P796 WeakPolarHBondContact O-CG 3.37Å; L793-A797 VanDerWaalsContact O-CB 3.24Å; L793-A797 WeakPolarHBondContact O-CB 3.03Å; L793-A797 PolarHBondContact O-N 2.87Å; L793-A797 VanDerWaalsContact O-N 3.13Å
794	F	96.8	Very high	95.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-38.1	171.5	-76.4	-8.1	0	0	0	111.6	M108 I439 F440 M479 L486 T790 L791 L792 A797 I798	M108-F794 HydrophobicContact CE-CB 4.11Å; M108-F794 HydrophobicContact CE-CD2 4.37Å; I439-F794 HydrophobicContact CD1-CZ 4.11Å; F440-F794 HydrophobicContact CE1-CE1 4.18Å; M479-F794 HydrophobicContact CB-CD2 4.19Å; M479-F794 HydrophobicContact CB-CE2 4.44Å; M479-F794 HydrophobicContact CB-CG 4.39Å; M479-F794 HydrophobicContact CG-CD1 3.96Å; M479-F794 HydrophobicContact CG-CD2 4.17Å; M479-F794 HydrophobicContact CG-CE1 4.1Å; M479-F794 HydrophobicContact CG-CE2 4.25Å; M479-F794 HydrophobicContact CG-CG 4.05Å; M479-F794 HydrophobicContact CG-CZ 4.25Å; M479-F794 HydrophobicContact SD-CB 4.08Å; M479-F794 HydrophobicContact SD-CD1 3.62Å; M479-F794 HydrophobicContact SD-CE1 4.21Å; M479-F794 HydrophobicContact SD-CG 3.88Å; L486-F794 HydrophobicContact CD1-CE2 4.15Å; L486-F794 HydrophobicContact CD1-CZ 4.25Å; T790-F794 HydrophobicContact CG2-CE1 3.83Å; T790-F794 HydrophobicContact CG2-CZ 4.23Å; T790-F794 WeakPolarHBondContact O-CD1 3.27Å; T790-F794 PolarHBondContact O-N 2.93Å; L791-F794 HydrophobicContact CD2-CD2 3.79Å; L791-F794 HydrophobicContact CD2-CE2 3.52Å; L791-F794 HydrophobicContact CD2-CZ 4.25Å; L791-F794 VanDerWaalsContact O-CB 3.31Å; L791-F794 WeakPolarHBondContact O-CB 3.49Å; L791-F794 PolarHBondContact O-N 3.48Å; L792-F794 VanDerWaalsContact C-N 3.29Å; L792-F794 PolarHBondContact O-N 3.36Å; F794-A797 PolarHBondContact O-N 3.09Å; F794-I798 HydrophobicContact CB-CD1 4.41Å; F794-I798 WeakPolarHBondContact O-CB 3.34Å; F794-I798 WeakPolarHBondContact O-CD1 3.22Å; F794-I798 WeakPolarHBondContact O-CG1 3.45Å; F794-I798 PolarHBondContact O-N 2.96Å
795	I	95.1	Very high	94.8	Very high	85 Å²	85	33.4 Å²	33.4	44%	0.436	18%	0.175	S	C	.	.	H	α-helix	trans	-59.3	-57.2	-177.6	-59.4	173.9	0	0	0	111.7	F104 M108 L793 A797 I798 I799	F104-I795 HydrophobicContact CD2-CD1 4.21Å; F104-I795 HydrophobicContact CE2-CD1 4.09Å; F104-I795 HydrophobicContact CE2-CG1 4.03Å; M108-I795 HydrophobicContact SD-CG1 4.45Å; L793-I795 VanDerWaalsContact C-N 3.28Å; L793-I795 PolarHBondContact O-N 2.77Å; I795-A797 VanDerWaalsContact C-N 3.34Å; I795-A797 PolarHBondContact O-N 2.86Å; I795-I798 PolarHBondContact O-N 2.86Å; I795-I799 HydrophobicContact CG2-CD1 4.33Å; I795-I799 WeakPolarHBondContact O-CG1 3.49Å; I795-I799 PolarHBondContact O-N 3.31Å
796	P	97.1	Very high	94.3	Very high	38 Å²	38	34.4 Å²	34.4	25%	0.247	19%	0.187	C	C	.	.	H	α-helix	trans	-66	-35.6	177.4	27.3	-35.8	0	0	0	112.2	I150 L793 I798 I799 F800	I150-P796 HydrophobicContact CD1-CB 3.92Å; I150-P796 HydrophobicContact CD1-CG 4.38Å; L793-P796 HydrophobicContact CD2-CG 4.21Å; L793-P796 VanDerWaalsContact O-CD 3.3Å; L793-P796 WeakPolarHBondContact O-CD 3.13Å; L793-P796 WeakPolarHBondContact O-CG 3.37Å; P796-I798 PolarHBondContact O-N 3.37Å; P796-I799 PolarHBondContact O-N 3.32Å; P796-F800 WeakPolarHBondContact O-CD2 3.46Å; P796-F800 PolarHBondContact O-N 2.93Å
797	A	97.2	Very high	94	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-45.6	175.8	0	0	0	0	0	111.9	L147 I150 M479 L793 F794 I795 I799 F800 A801	L147-A797 HydrophobicContact CD1-CB 4.19Å; I150-A797 HydrophobicContact CG2-CB 3.84Å; M479-A797 HydrophobicContact CE-CB 4.47Å; M479-A797 HydrophobicContact SD-CB 4.27Å; L793-A797 VanDerWaalsContact O-CB 3.24Å; L793-A797 WeakPolarHBondContact O-CB 3.03Å; L793-A797 PolarHBondContact O-N 2.87Å; L793-A797 VanDerWaalsContact O-N 3.13Å; F794-A797 PolarHBondContact O-N 3.09Å; I795-A797 VanDerWaalsContact C-N 3.34Å; I795-A797 PolarHBondContact O-N 2.86Å; A797-I799 PolarHBondContact O-N 3.17Å; A797-F800 PolarHBondContact O-N 3.42Å; A797-A801 WeakPolarHBondContact O-CB 3.39Å; A797-A801 PolarHBondContact O-N 3.4Å
798	I	95.6	Very high	93.6	Very high	16 Å²	16	34.6 Å²	34.6	8%	0.082	19%	0.187	C	C	.	.	H	α-helix	trans	-59.1	-46.4	176.8	-71.6	165.8	0	0	0	110.7	M108 V476 M479 F480 F794 I795 P796 F800 A801 V802	M108-I798 HydrophobicContact CE-CD1 3.68Å; M108-I798 HydrophobicContact SD-CD1 4.43Å; V476-I798 HydrophobicContact CG1-CG1 4.37Å; V476-I798 HydrophobicContact CG1-CG2 3.98Å; V476-I798 HydrophobicContact CG2-CG1 4.46Å; M479-I798 HydrophobicContact CB-CD1 4.1Å; M479-I798 HydrophobicContact CB-CG1 4.26Å; M479-I798 HydrophobicContact CE-CG1 3.55Å; M479-I798 HydrophobicContact SD-CD1 4.44Å; M479-I798 HydrophobicContact SD-CG1 3.84Å; F480-I798 HydrophobicContact CD1-CD1 4.13Å; F480-I798 HydrophobicContact CE1-CD1 3.69Å; F480-I798 HydrophobicContact CE2-CD1 4.47Å; F480-I798 HydrophobicContact CE2-CG2 4.2Å; F480-I798 HydrophobicContact CZ-CD1 3.89Å; F480-I798 HydrophobicContact CZ-CG2 3.76Å; F794-I798 HydrophobicContact CB-CD1 4.41Å; F794-I798 WeakPolarHBondContact O-CB 3.34Å; F794-I798 WeakPolarHBondContact O-CD1 3.22Å; F794-I798 WeakPolarHBondContact O-CG1 3.45Å; F794-I798 PolarHBondContact O-N 2.96Å; I795-I798 PolarHBondContact O-N 2.86Å; P796-I798 PolarHBondContact O-N 3.37Å; I798-F800 PolarHBondContact O-N 3.38Å; I798-A801 PolarHBondContact O-N 2.87Å; I798-V802 HydrophobicContact CG2-CG2 4.32Å; I798-V802 WeakPolarHBondContact O-CB 3.41Å; I798-V802 VanDerWaalsContact O-CG2 3.24Å; I798-V802 WeakPolarHBondContact O-CG2 3.43Å; I798-V802 PolarHBondContact O-N 3.07Å
799	I	94.3	Very high	93.1	Very high	82 Å²	82	36.6 Å²	36.6	42%	0.421	19%	0.187	S	C	.	.	H	α-helix	trans	-60.9	-49.2	-178.8	-65.4	166.5	0	0	0	110.8	I795 P796 A797 K803	I795-I799 HydrophobicContact CG2-CD1 4.33Å; I795-I799 WeakPolarHBondContact O-CG1 3.49Å; I795-I799 PolarHBondContact O-N 3.31Å; P796-I799 PolarHBondContact O-N 3.32Å; A797-I799 PolarHBondContact O-N 3.17Å; I799-K803 HydrophobicContact CG2-CD 4.28Å; I799-K803 WeakPolarHBondContact O-CB 3.33Å; I799-K803 WeakPolarHBondContact O-CG 3.45Å; I799-K803 PolarHBondContact O-N 2.9Å; I799-K803 VanDerWaalsContact O-N 3.09Å
800	F	96	Very high	92.6	Very high	47 Å²	47	32.2 Å²	32.2	21%	0.206	17%	0.168	C	C	.	.	H	α-helix	trans	-69.6	-40.5	-179.8	-72.3	-65.6	0	0	0	112	Y143 C146 L147 I150 P796 A797 I798 V802 K803 L804	Y143-F800 AromaticContact CD1-CD1 3.65Å; Y143-F800 HydrophobicContact CD1-CD1 3.65Å; Y143-F800 AromaticContact CD1-CE1 3.7Å; Y143-F800 HydrophobicContact CD1-CE1 3.7Å; Y143-F800 HydrophobicContact CE1-CD1 4.34Å; Y143-F800 HydrophobicContact CE1-CE1 4.11Å; Y143-F800 HydrophobicContact CG-CD1 4.04Å; C146-F800 HydrophobicContact CB-CD1 4.05Å; C146-F800 HydrophobicContact CB-CD2 4.09Å; C146-F800 HydrophobicContact CB-CE1 3.91Å; C146-F800 HydrophobicContact CB-CE2 3.96Å; C146-F800 HydrophobicContact CB-CG 4.15Å; C146-F800 HydrophobicContact CB-CZ 3.86Å; L147-F800 HydrophobicContact CB-CB 4.19Å; L147-F800 HydrophobicContact CD1-CB 4.3Å; I150-F800 HydrophobicContact CD1-CD2 3.52Å; I150-F800 HydrophobicContact CD1-CE2 3.8Å; P796-F800 WeakPolarHBondContact O-CD2 3.46Å; P796-F800 PolarHBondContact O-N 2.93Å; A797-F800 PolarHBondContact O-N 3.42Å; I798-F800 PolarHBondContact O-N 3.38Å; F800-V802 PolarHBondContact O-N 3.02Å; F800-K803 PolarHBondContact O-N 3.44Å; F800-L804 WeakPolarHBondContact O-CB 3.21Å; F800-L804 PolarHBondContact O-N 3.19Å
801	A	95.2	Very high	91.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.9	-44.9	177.1	0	0	0	0	0	111.9	L147 L443 L472 V476 A797 I798 L804 A805	L147-A801 HydrophobicContact CD1-CB 4.35Å; L147-A801 HydrophobicContact CD2-CB 4.03Å; L443-A801 HydrophobicContact CD2-CB 4.32Å; L472-A801 HydrophobicContact CB-CB 4.47Å; V476-A801 HydrophobicContact CG2-CB 3.63Å; A797-A801 WeakPolarHBondContact O-CB 3.39Å; A797-A801 PolarHBondContact O-N 3.4Å; I798-A801 PolarHBondContact O-N 2.87Å; A801-L804 PolarHBondContact O-N 2.82Å; A801-A805 VanDerWaalsContact O-CB 3.23Å; A801-A805 WeakPolarHBondContact O-CB 3.47Å; A801-A805 PolarHBondContact O-N 3.47Å
802	V	91.9	Very high	90.5	Very high	30 Å²	30	37.8 Å²	37.8	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-45.1	178	171.7	0	0	0	0	111.5	F115 L473 V476 I798 F800 L804 A805 G806	F115-V802 HydrophobicContact CE1-CG2 4.26Å; F115-V802 HydrophobicContact CE2-CG1 3.75Å; F115-V802 HydrophobicContact CE2-CG2 3.91Å; F115-V802 HydrophobicContact CZ-CB 4.34Å; F115-V802 HydrophobicContact CZ-CG1 3.82Å; F115-V802 HydrophobicContact CZ-CG2 3.48Å; F115-V802 VanDerWaalsContact CZ-CG2 3.48Å; L473-V802 HydrophobicContact CD2-CG2 4.32Å; V476-V802 HydrophobicContact CG1-CG2 4.09Å; V476-V802 HydrophobicContact CG2-CG2 4.1Å; I798-V802 HydrophobicContact CG2-CG2 4.32Å; I798-V802 WeakPolarHBondContact O-CB 3.41Å; I798-V802 VanDerWaalsContact O-CG2 3.24Å; I798-V802 WeakPolarHBondContact O-CG2 3.43Å; I798-V802 PolarHBondContact O-N 3.07Å; F800-V802 PolarHBondContact O-N 3.02Å; V802-L804 VanDerWaalsContact C-N 3.35Å; V802-A805 PolarHBondContact O-N 3.3Å; V802-G806 PolarHBondContact O-N 3.37Å; V802-G806 VanDerWaalsContact O-N 3.17Å
803	K	90.5	Very high	89.4	Confident	106 Å²	106	39.6 Å²	39.6	46%	0.461	20%	0.2	S	C	.	.	H	α-helix	trans	-63.7	-42.1	177.5	-75.9	-177.5	177.5	179.7	0	111.7	Y143 I799 F800 G806 L807	Y143-K803 HydrophobicContact CD2-CB 3.84Å; Y143-K803 HydrophobicContact CE2-CB 3.78Å; Y143-K803 HydrophobicContact CE2-CD 3.97Å; Y143-K803 HydrophobicContact CE2-CG 4.43Å; I799-K803 HydrophobicContact CG2-CD 4.28Å; I799-K803 WeakPolarHBondContact O-CB 3.33Å; I799-K803 WeakPolarHBondContact O-CG 3.45Å; I799-K803 PolarHBondContact O-N 2.9Å; I799-K803 VanDerWaalsContact O-N 3.09Å; F800-K803 PolarHBondContact O-N 3.44Å; K803-G806 PolarHBondContact O-N 3.15Å; K803-L807 PolarHBondContact O-N 3.04Å
804	L	91.7	Very high	88.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-68.5	-40.8	179.6	-173.2	58.9	0	0	0	111.7	R140 L147 L447 L472 F800 A801 V802 G806 L807 Y808	R140-L804 HydrophobicContact CG-CD1 3.93Å; L147-L804 HydrophobicContact CD2-CD2 4Å; L447-L804 HydrophobicContact CD2-CD2 3.9Å; L472-L804 HydrophobicContact CD1-CB 4.11Å; L472-L804 HydrophobicContact CD1-CD2 3.93Å; L472-L804 HydrophobicContact CD1-CG 3.96Å; F800-L804 WeakPolarHBondContact O-CB 3.21Å; F800-L804 PolarHBondContact O-N 3.19Å; A801-L804 PolarHBondContact O-N 2.82Å; V802-L804 VanDerWaalsContact C-N 3.35Å; L804-G806 PolarHBondContact O-N 2.97Å; L804-L807 WeakPolarHBondContact O-CB 3.33Å; L804-L807 PolarHBondContact O-N 2.95Å; L804-Y808 HydrophobicContact CD1-CD1 4.22Å; L804-Y808 HydrophobicContact CD1-CE1 3.65Å; L804-Y808 HydrophobicContact CD1-CE2 4.13Å; L804-Y808 HydrophobicContact CD2-CE2 3.89Å; L804-Y808 HydrophobicContact CG-CD2 4.13Å; L804-Y808 HydrophobicContact CG-CE1 4.07Å; L804-Y808 HydrophobicContact CG-CE2 3.59Å; L804-Y808 PolarHBondContact O-N 2.87Å
805	A	90.1	Very high	86.7	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-58.2	-37.5	173.2	0	0	0	0	0	112.2	A469 L472 L473 A801 V802 Y808 R809	A469-A805 HydrophobicContact CB-CB 4.05Å; A469-A805 WeakPolarHBondContact CB-O 3.43Å; L472-A805 HydrophobicContact CB-CB 4.31Å; L473-A805 HydrophobicContact CD1-CB 4.11Å; L473-A805 HydrophobicContact CD2-CB 4.09Å; L473-A805 HydrophobicContact CG-CB 3.79Å; A801-A805 VanDerWaalsContact O-CB 3.23Å; A801-A805 WeakPolarHBondContact O-CB 3.47Å; A801-A805 PolarHBondContact O-N 3.47Å; V802-A805 PolarHBondContact O-N 3.3Å; A805-Y808 PolarHBondContact O-N 3.48Å; A805-R809 WeakPolarHBondContact O-CG 3.37Å; A805-R809 PolarHBondContact O-N 3.2Å
806	G	85.5	Confident	85.1	Confident	32 Å²	32	47.9 Å²	47.9	33%	0.33	23%	0.229	S	C	.	.	H	α-helix	trans	-61.5	-41.1	172.5	0	0	0	0	0	113.2	V802 K803 L804	V802-G806 PolarHBondContact O-N 3.37Å; V802-G806 VanDerWaalsContact O-N 3.17Å; K803-G806 PolarHBondContact O-N 3.15Å; L804-G806 PolarHBondContact O-N 2.97Å
807	L	87.4	Confident	83.5	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-73.6	-27.6	178.3	-66.4	171.4	0	0	0	113.4	D136 K139 R140 Y143 K803 L804	D136-L807 HydrophobicContact CB-CD2 3.86Å; K139-L807 HydrophobicContact CB-CD1 3.91Å; R140-L807 HydrophobicContact CB-CD1 4.09Å; R140-L807 PolarHBondContact NH2-O 3.47Å; Y143-L807 HydrophobicContact CD2-CD1 3.68Å; Y143-L807 HydrophobicContact CE2-CD1 4.04Å; K803-L807 PolarHBondContact O-N 3.04Å; L804-L807 WeakPolarHBondContact O-CB 3.33Å; L804-L807 PolarHBondContact O-N 2.95Å
808	Y	88	Confident	81.7	Confident	1 Å²	1	52.9 Å²	52.9	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-78	-22.8	177.7	-75.1	-14.6	0	0	0	113.5	R140 T144 G450 T451 R465 L472 L804 A805 K810	R140-Y808 HydrophobicContact CG-CD1 4.13Å; R140-Y808 HydrophobicContact CG-CE1 3.67Å; T144-Y808 PolarHBondContact OG1-OH 3.01Å; G450-Y808 VanDerWaalsContact C-CZ 3.41Å; G450-Y808 VanDerWaalsContact CA-CZ 3.45Å; G450-Y808 WeakPolarHBondContact O-CE1 3.46Å; T451-Y808 WeakPolarHBondContact CG2-OH 3.5Å; R465-Y808 HydrophobicContact CB-CG 4.42Å; R465-Y808 VanDerWaalsContact CB-O 3.25Å; R465-Y808 WeakPolarHBondContact CB-O 3.41Å; R465-Y808 WeakPolarHBondContact O-CB 3.26Å; L472-Y808 HydrophobicContact CD1-CD2 3.89Å; L472-Y808 HydrophobicContact CD1-CE2 3.7Å; L804-Y808 HydrophobicContact CD1-CD1 4.22Å; L804-Y808 HydrophobicContact CD1-CE1 3.65Å; L804-Y808 HydrophobicContact CD1-CE2 4.13Å; L804-Y808 HydrophobicContact CD2-CE2 3.89Å; L804-Y808 HydrophobicContact CG-CD2 4.13Å; L804-Y808 HydrophobicContact CG-CE1 4.07Å; L804-Y808 HydrophobicContact CG-CE2 3.59Å; L804-Y808 PolarHBondContact O-N 2.87Å; A805-Y808 PolarHBondContact O-N 3.48Å; Y808-K810 VanDerWaalsContact C-N 3.32Å
809	R	84.6	Confident	80	Confident	64 Å²	64	58.2 Å²	58.2	24%	0.242	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.8	176.6	-76.1	-176.8	162.2	-154	-5.9	114.8	R119 V128 A469 N470 A805 T811	R119-R809 VanDerWaalsContact NH2-NH1 3.12Å; V128-R809 HydrophobicContact CG1-CB 4.05Å; V128-R809 WeakPolarHBondContact CG1-O 3.27Å; A469-R809 HydrophobicContact CB-CG 3.77Å; N470-R809 PolarHBondContact OD1-NH2 3.15Å; A805-R809 WeakPolarHBondContact O-CG 3.37Å; A805-R809 PolarHBondContact O-N 3.2Å; R809-T811 PolarHBondContact O-N 2.87Å
810	K	83.9	Confident	78.3	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.035	28%	0.278	C	S	.	.			trans	-71.6	127.1	-179.9	-57.8	-162.3	161.6	-155.8	0	110.8	Q129 V131 D132 D136 Y808	Q129-K810 WeakPolarHBondContact O-CG 3.39Å; V131-K810 PolarHBondContact O-NZ 2.83Å; D132-K810 WeakPolarHBondContact OD1-CD 3.33Å; D136-K810 WeakPolarHBondContact OD2-CE 3.09Å; D136-K810 IonicContact OD2-NZ 3.56Å; D136-K810 PolarHBondContact OD2-NZ 3.37Å; Y808-K810 VanDerWaalsContact C-N 3.32Å
811	T	75.8	Confident	76.4	Confident	45 Å²	45	62 Å²	62	28%	0.276	30%	0.299	S	S	.	.			trans	-89.3	-30.2	-172.8	57.3	0	0	0	0	112.3	F130 R455 P456 R809	F130-T811 HydrophobicContact CD1-CG2 4.31Å; F130-T811 PolarHBondContact O-N 3.17Å; F130-T811 PolarHBondContact O-OG1 3.18Å; R455-T811 WeakPolarHBondContact CD-O 3.39Å; P456-T811 HydrophobicContact CG-CG2 4.26Å; P456-T811 WeakPolarHBondContact O-CG2 3.45Å; R809-T811 PolarHBondContact O-N 2.87Å
812	E	73.3	Confident	74.6	Confident	72 Å²	72	68 Å²	68	34%	0.336	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-117.2	147.2	-170.5	-70.4	173.6	-161.9	0	0	113.3	F130 V131 D132 Y818	F130-E812 PolarHBondContact O-N 3.42Å; V131-E812 HydrophobicContact CG2-CB 4.37Å; D132-E812 PolarHBondContact N-O 2.86Å; E812-Y818 PolarHBondContact OE2-OH 3.3Å
813	K	71.2	Confident	72.9	Confident	150 Å²	150	70 Å²	70	65%	0.652	34%	0.336	S	S	*	.			trans	-73.3	149.1	172.7	-75.6	177.1	-178.5	175	0	109.9	R455 S815 Y818	R455-K813 VanDerWaalsContact NH2-CG 3.32Å; K813-S815 PolarHBondContact O-N 2.88Å; K813-S815 VanDerWaalsContact O-N 3.16Å; K813-Y818 WeakPolarHBondContact O-CE2 3.5Å
814	Y	70.1	Confident	71.2	Confident	75 Å²	75	70 Å²	70	29%	0.294	34%	0.34	S	S	.	.			trans	-57	118.8	162.4	176.3	-98.6	0	0	0	109	D132 K134 E819	D132-Y814 WeakPolarHBondContact O-CA 3.33Å; D132-Y814 VanDerWaalsContact O-CB 3.27Å; D132-Y814 WeakPolarHBondContact O-CB 3.38Å; K134-Y814 HydrophobicContact CB-CD2 4.47Å; K134-Y814 HydrophobicContact CB-CE2 4.19Å; Y814-E819 PolarHBondContact OH-OE1 2.92Å
815	S	66.7	Low	69.5	Low	37 Å²	37	73.2 Å²	73.2	26%	0.259	36%	0.362	S	S	.	.			trans	-106.8	149.6	160.4	-167.3	0	0	0	0	109.2	K813 D817 Y818	K813-S815 PolarHBondContact O-N 2.88Å; K813-S815 VanDerWaalsContact O-N 3.16Å; S815-D817 PolarHBondContact O-N 2.93Å; S815-D817 VanDerWaalsContact OG-CG 3.25Å; S815-D817 PolarHBondContact OG-OD2 3.45Å; S815-Y818 VanDerWaalsContact N-CD2 3.32Å; S815-Y818 VanDerWaalsContact N-CE2 3.35Å; S815-Y818 VanDerWaalsContact O-CD2 3.23Å; S815-Y818 WeakPolarHBondContact O-CD2 3.36Å
816	R	61.8	Low	67.8	Low	189 Å²	189	80.1 Å²	80.1	71%	0.713	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-68.6	-26.3	174.6	-165.1	176.2	174.8	176.3	-5.1	111.3	Y818 E819	R816-Y818 PolarHBondContact O-N 2.96Å; R816-E819 PolarHBondContact O-N 3.38Å
817	D	63.3	Low	66.2	Low	77 Å²	77	81.3 Å²	81.3	41%	0.412	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-59.8	-27.7	-179.2	-40.3	-35.2	0	0	0	112.4	S815 E819 E820 Y823	S815-D817 PolarHBondContact O-N 2.93Å; S815-D817 VanDerWaalsContact OG-CG 3.25Å; S815-D817 PolarHBondContact OG-OD2 3.45Å; D817-E819 PolarHBondContact O-N 3.5Å; D817-E820 WeakPolarHBondContact O-CB 3.36Å; D817-E820 PolarHBondContact O-N 3.48Å; D817-Y823 HydrophobicContact CB-CD2 4.16Å; D817-Y823 WeakPolarHBondContact O-CB 3.41Å
818	Y	58.8	Low	64.5	Low	66 Å²	66	83 Å²	83	26%	0.259	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-66	-17	177.6	-61.9	-66.7	0	0	0	113.8	V131 E812 K813 S815 R816 Y823	V131-Y818 HydrophobicContact CG1-CD2 3.79Å; V131-Y818 HydrophobicContact CG1-CE2 3.74Å; V131-Y818 HydrophobicContact CG1-CG 4.38Å; V131-Y818 HydrophobicContact CG2-CE1 4.45Å; E812-Y818 PolarHBondContact OE2-OH 3.3Å; K813-Y818 WeakPolarHBondContact O-CE2 3.5Å; S815-Y818 VanDerWaalsContact N-CD2 3.32Å; S815-Y818 VanDerWaalsContact N-CE2 3.35Å; S815-Y818 VanDerWaalsContact O-CD2 3.23Å; S815-Y818 WeakPolarHBondContact O-CD2 3.36Å; R816-Y818 PolarHBondContact O-N 2.96Å; Y818-Y823 AromaticContact CD1-CD1 3.5Å; Y818-Y823 HydrophobicContact CD1-CD1 3.5Å; Y818-Y823 VanDerWaalsContact CD1-CD1 3.5Å; Y818-Y823 AromaticContact CD1-CE1 3.07Å; Y818-Y823 HydrophobicContact CD1-CE1 3.07Å; Y818-Y823 HydrophobicContact CD1-CE2 4.48Å; Y818-Y823 HydrophobicContact CD1-CG 4.37Å; Y818-Y823 AromaticContact CD1-CZ 3.65Å; Y818-Y823 HydrophobicContact CE1-CD1 4.05Å; Y818-Y823 AromaticContact CE1-CE1 3.14Å; Y818-Y823 HydrophobicContact CE1-CE1 3.14Å; Y818-Y823 HydrophobicContact CE1-CE2 4.31Å; Y818-Y823 AromaticContact CE1-CZ 3.3Å; Y818-Y823 VanDerWaalsContact CE1-OH 3.23Å; Y818-Y823 WeakPolarHBondContact CE1-OH 3.38Å; Y818-Y823 HydrophobicContact CG-CD1 4.44Å; Y818-Y823 HydrophobicContact CG-CE1 4.28Å
819	E	59.3	Low	62.6	Low	128 Å²	128	91.2 Å²	91.2	60%	0.598	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-88.7	-7.9	174.2	-65.4	-176.3	166.4	0	0	112.4	Y814 R816 D817	Y814-E819 PolarHBondContact OH-OE1 2.92Å; R816-E819 PolarHBondContact O-N 3.38Å; D817-E819 PolarHBondContact O-N 3.5Å
820	E	59.2	Low	60.9	Low	107 Å²	107	96.3 Å²	96.3	50%	0.5	46%	0.463	S	S	.	.	S	Bend	trans	-79	137	-179.6	-64	-176.8	165.7	0	0	111.1	D817 D822 Y823 I824	D817-E820 WeakPolarHBondContact O-CB 3.36Å; D817-E820 PolarHBondContact O-N 3.48Å; E820-D822 PolarHBondContact O-N 3.25Å; E820-D822 VanDerWaalsContact O-N 3.14Å; E820-Y823 PolarHBondContact O-N 2.66Å; E820-Y823 VanDerWaalsContact O-N 3.11Å; E820-I824 PolarHBondContact O-N 3.3Å
821	P	55.9	Low	59.1	Low	102 Å²	102	101.4 Å²	101.4	66%	0.662	49%	0.488	S	S	*	.	H	α-helix	trans	-54.3	-36.7	-177.5	-23.7	31.8	0	0	0	113.3	I824 S825	P821-I824 PolarHBondContact O-N 2.76Å; P821-S825 PolarHBondContact O-N 3.03Å
822	D	58.1	Low	57.3	Low	125 Å²	125	108.6 Å²	108.6	67%	0.668	51%	0.51	S	S	*	.	H	α-helix	trans	-68	-38.4	-177.4	-68.7	-14	0	0	0	111.4	E820 S825 Y826	E820-D822 PolarHBondContact O-N 3.25Å; E820-D822 VanDerWaalsContact O-N 3.14Å; D822-S825 PolarHBondContact O-N 3.03Å; D822-S825 PolarHBondContact O-OG 2.91Å; D822-Y826 WeakPolarHBondContact O-CB 3.35Å; D822-Y826 PolarHBondContact O-N 3.2Å
823	Y	55.4	Low	55.7	Low	72 Å²	72	109.6 Å²	109.6	28%	0.282	52%	0.523	S	S	.	.	H	α-helix	trans	-66.4	-41	177	-156	-79.5	0	0	0	111.6	D817 Y818 E820 S825 Y826 H827	D817-Y823 HydrophobicContact CB-CD2 4.16Å; D817-Y823 WeakPolarHBondContact O-CB 3.41Å; Y818-Y823 AromaticContact CD1-CD1 3.5Å; Y818-Y823 HydrophobicContact CD1-CD1 3.5Å; Y818-Y823 VanDerWaalsContact CD1-CD1 3.5Å; Y818-Y823 AromaticContact CD1-CE1 3.07Å; Y818-Y823 HydrophobicContact CD1-CE1 3.07Å; Y818-Y823 HydrophobicContact CD1-CE2 4.48Å; Y818-Y823 HydrophobicContact CD1-CG 4.37Å; Y818-Y823 AromaticContact CD1-CZ 3.65Å; Y818-Y823 HydrophobicContact CE1-CD1 4.05Å; Y818-Y823 AromaticContact CE1-CE1 3.14Å; Y818-Y823 HydrophobicContact CE1-CE1 3.14Å; Y818-Y823 HydrophobicContact CE1-CE2 4.31Å; Y818-Y823 AromaticContact CE1-CZ 3.3Å; Y818-Y823 VanDerWaalsContact CE1-OH 3.23Å; Y818-Y823 WeakPolarHBondContact CE1-OH 3.38Å; Y818-Y823 HydrophobicContact CG-CD1 4.44Å; Y818-Y823 HydrophobicContact CG-CE1 4.28Å; E820-Y823 PolarHBondContact O-N 2.66Å; E820-Y823 VanDerWaalsContact O-N 3.11Å; Y823-S825 VanDerWaalsContact C-N 3.3Å; Y823-S825 PolarHBondContact O-N 2.87Å; Y823-Y826 PolarHBondContact O-N 2.98Å; Y823-H827 AromaticContact CD1-CD2 3.61Å; Y823-H827 AromaticContact CE1-CD2 3.01Å; Y823-H827 WeakPolarHBondContact CE1-CD2 3.48Å; Y823-H827 AromaticContact CE1-NE2 3.28Å; Y823-H827 VanDerWaalsContact CE1-NE2 3.28Å; Y823-H827 WeakPolarHBondContact CE1-NE2 3.06Å; Y823-H827 AromaticContact CZ-CD2 3.55Å; Y823-H827 AromaticContact CZ-NE2 3.36Å; Y823-H827 PolarHBondContact O-N 3.37Å; Y823-H827 VanDerWaalsContact O-N 3.08Å; Y823-H827 PolarHBondContact OH-NE2 2.92Å; Y823-H827 VanDerWaalsContact OH-NE2 3.07Å
824	I	55.8	Low	54.3	Low	108 Å²	108	107.8 Å²	107.8	55%	0.554	53%	0.526	S	S	*	.	H	α-helix	trans	-61.3	-41.6	174.4	-59.8	170.1	0	0	0	110.2	E820 P821 G828	E820-I824 PolarHBondContact O-N 3.3Å; P821-I824 PolarHBondContact O-N 2.76Å; I824-G828 WeakPolarHBondContact O-CA 3.11Å; I824-G828 PolarHBondContact O-N 3.4Å
825	S	56.2	Low	52.9	Low	66 Å²	66	109.9 Å²	109.9	46%	0.462	55%	0.547	S	S	.	.	H	α-helix	trans	-65.7	-42	178.5	81.8	0	0	0	0	112.2	P821 D822 Y823 F829	P821-S825 PolarHBondContact O-N 3.03Å; D822-S825 PolarHBondContact O-N 3.03Å; D822-S825 PolarHBondContact O-OG 2.91Å; Y823-S825 VanDerWaalsContact C-N 3.3Å; Y823-S825 PolarHBondContact O-N 2.87Å; S825-F829 PolarHBondContact O-N 3.29Å
826	Y	54.5	Low	51.6	Low	146 Å²	146	115.5 Å²	115.5	57%	0.573	57%	0.574	S	S	*	*	H	α-helix	trans	-65.7	-50.7	-178	-164.8	-92.6	0	0	0	110.9	D822 Y823 F829 Y830	D822-Y826 WeakPolarHBondContact O-CB 3.35Å; D822-Y826 PolarHBondContact O-N 3.2Å; Y823-Y826 PolarHBondContact O-N 2.98Å; Y826-F829 PolarHBondContact O-N 2.93Å; Y826-Y830 HydrophobicContact CD1-CD2 4.15Å; Y826-Y830 HydrophobicContact CD1-CE2 4.37Å; Y826-Y830 HydrophobicContact CD2-CE2 4.34Å; Y826-Y830 HydrophobicContact CE1-CD2 4.01Å; Y826-Y830 HydrophobicContact CE1-CE2 4.04Å; Y826-Y830 HydrophobicContact CE2-CE2 4.03Å; Y826-Y830 AromaticContact CZ-CE2 3.87Å; Y826-Y830 WeakPolarHBondContact O-CD2 3.48Å; Y826-Y830 PolarHBondContact O-N 3.05Å
827	H	50.3	Low	50.6	Low	58 Å²	58	115.9 Å²	115.9	27%	0.269	58%	0.577	S	S	.	*	H	α-helix	trans	-74	-30.4	178	-83.8	-85.8	0	0	0	113.7	Y823 F829 Y830 M831	Y823-H827 AromaticContact CD1-CD2 3.61Å; Y823-H827 AromaticContact CE1-CD2 3.01Å; Y823-H827 WeakPolarHBondContact CE1-CD2 3.48Å; Y823-H827 AromaticContact CE1-NE2 3.28Å; Y823-H827 VanDerWaalsContact CE1-NE2 3.28Å; Y823-H827 WeakPolarHBondContact CE1-NE2 3.06Å; Y823-H827 AromaticContact CZ-CD2 3.55Å; Y823-H827 AromaticContact CZ-NE2 3.36Å; Y823-H827 PolarHBondContact O-N 3.37Å; Y823-H827 VanDerWaalsContact O-N 3.08Å; Y823-H827 PolarHBondContact OH-NE2 2.92Å; Y823-H827 VanDerWaalsContact OH-NE2 3.07Å; H827-F829 PolarHBondContact O-N 3.38Å; H827-Y830 PolarHBondContact O-N 2.76Å; H827-M831 WeakPolarHBondContact O-CB 2.91Å; H827-M831 PolarHBondContact O-N 3.27Å
828	G	52.9	Low	49.4	Very low	47 Å²	47	119.4 Å²	119.4	49%	0.485	59%	0.591	S	S	.	*	H	α-helix	trans	-59.2	-27.9	173.3	0	0	0	0	0	113.2	I824	I824-G828 WeakPolarHBondContact O-CA 3.11Å; I824-G828 PolarHBondContact O-N 3.4Å
829	F	48.5	Very low	48.2	Very low	173 Å²	173	123 Å²	123	76%	0.759	62%	0.615	S	S	*	*	H	α-helix	trans	-79.4	-42.9	174.2	-100	-88.3	0	0	0	113.3	S825 Y826 H827	S825-F829 PolarHBondContact O-N 3.29Å; Y826-F829 PolarHBondContact O-N 2.93Å; H827-F829 PolarHBondContact O-N 3.38Å
830	Y	48.9	Very low	47.2	Very low	172 Å²	172	123.2 Å²	123.2	68%	0.675	62%	0.62	S	S	*	*	H	α-helix	trans	-93.9	-22	-171.1	-65.8	-71.6	0	0	0	115.4	Y826 H827	Y826-Y830 HydrophobicContact CD1-CD2 4.15Å; Y826-Y830 HydrophobicContact CD1-CE2 4.37Å; Y826-Y830 HydrophobicContact CD2-CE2 4.34Å; Y826-Y830 HydrophobicContact CE1-CD2 4.01Å; Y826-Y830 HydrophobicContact CE1-CE2 4.04Å; Y826-Y830 HydrophobicContact CE2-CE2 4.03Å; Y826-Y830 AromaticContact CZ-CE2 3.87Å; Y826-Y830 WeakPolarHBondContact O-CD2 3.48Å; Y826-Y830 PolarHBondContact O-N 3.05Å; H827-Y830 PolarHBondContact O-N 2.76Å
831	M	45.2	Very low	46.1	Very low	114 Å²	114	122.2 Å²	122.2	56%	0.562	63%	0.625	S	S	*	*			trans	-93.5	8.9	179.4	-85.2	-170.5	175.8	0	0	114.6	H827 P833	H827-M831 WeakPolarHBondContact O-CB 2.91Å; H827-M831 PolarHBondContact O-N 3.27Å; M831-P833 WeakPolarHBondContact O-CD 3.47Å; M831-P833 VanDerWaalsContact O-N 3.12Å
832	R	37.6	Very low	45.1	Very low	197 Å²	197	126.2 Å²	126.2	74%	0.743	64%	0.635	S	S	*	*			trans	-65.9	111.8	174	-148.9	-177.2	-148.6	122.6	0.7	108.4
833	P	40.4	Very low	43.9	Very low	93 Å²	93	129.5 Å²	129.5	60%	0.604	64%	0.643	S	S	*	*			trans	-61.4	138.8	-179.8	-16.8	30.3	0	0	0	108.7	M831 T835	M831-P833 WeakPolarHBondContact O-CD 3.47Å; M831-P833 VanDerWaalsContact O-N 3.12Å; P833-T835 PolarHBondContact O-N 3.17Å
834	P	41.5	Very low	42.9	Very low	111 Å²	111	131.9 Å²	131.9	72%	0.721	67%	0.668	S	S	*	*	S	Bend	trans	-67.9	8.8	-173.2	-17.2	28.8	0	0	0	115.9
835	T	41.8	Very low	42.1	Very low	119 Å²	119	138.4 Å²	138.4	73%	0.73	69%	0.685	S	S	*	*			trans	-118	54	-169.1	63.3	0	0	0	0	112.7	P833	P833-T835 PolarHBondContact O-N 3.17Å
836	D	37.4	Very low	41	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	71%	0.705	S	S	*	*			trans	-112.8	17.7	155.2	-94.7	-18.9	0	0	0	110.8	Q838	D836-Q838 PolarHBondContact O-N 3.49Å; D836-Q838 VanDerWaalsContact O-N 3.16Å
837	Y	41.1	Very low	39.8	Very low	196 Å²	196	146.3 Å²	146.3	77%	0.769	72%	0.722	S	S	*	*	S	Bend	trans	-76.4	103.6	170.2	-82.3	-86.2	0	0	0	109.9
838	Q	38.5	Very low	39.1	Very low	152 Å²	152	149.3 Å²	149.3	71%	0.71	75%	0.749	S	S	*	*			trans	73.8	71.7	148.2	-58.4	174.4	-28.7	0	0	117.6	D836 N840	D836-Q838 PolarHBondContact O-N 3.49Å; D836-Q838 VanDerWaalsContact O-N 3.16Å; Q838-N840 VanDerWaalsContact C-N 3.32Å
839	D	34.5	Very low	37.9	Very low	140 Å²	140	158.3 Å²	158.3	75%	0.749	77%	0.769	S	S	*	*			trans	-96.9	72.8	134.2	-166.1	-7.8	0	0	0	108.3	S841	D839-S841 PolarHBondContact O-N 3Å; D839-S841 VanDerWaalsContact OD1-CB 3.29Å; D839-S841 WeakPolarHBondContact OD1-CB 3.43Å; D839-S841 PolarHBondContact OD1-N 3.18Å; D839-S841 PolarHBondContact OD1-OG 3.42Å
840	N	37.1	Very low	37.2	Very low	133 Å²	133	159.4 Å²	159.4	71%	0.711	77%	0.773	S	S	*	*			trans	-79.1	56.2	167	-90.3	-23.7	0	0	0	109.2	Q838 Q842	Q838-N840 VanDerWaalsContact C-N 3.32Å; N840-Q842 VanDerWaalsContact C-N 3.26Å; N840-Q842 PolarHBondContact O-N 3.1Å
841	S	36.3	Very low	36.4	Very low	86 Å²	86	158.8 Å²	158.8	60%	0.601	78%	0.776	S	S	*	*			trans	-72.3	91.8	160.1	42.3	0	0	0	0	108	D839 K843	D839-S841 PolarHBondContact O-N 3Å; D839-S841 VanDerWaalsContact OD1-CB 3.29Å; D839-S841 WeakPolarHBondContact OD1-CB 3.43Å; D839-S841 PolarHBondContact OD1-N 3.18Å; D839-S841 PolarHBondContact OD1-OG 3.42Å; S841-K843 PolarHBondContact O-N 3.13Å
842	Q	36.2	Very low	35.8	Very low	186 Å²	186	161.9 Å²	161.9	87%	0.869	79%	0.787	S	S	*	*			trans	-47.8	98	177.8	-67	170.1	-15.6	0	0	111.8	N840	N840-Q842 VanDerWaalsContact C-N 3.26Å; N840-Q842 PolarHBondContact O-N 3.1Å
843	K	32.4	Very low	35.4	Very low	194 Å²	194	158.8 Å²	158.8	84%	0.843	79%	0.789	S	S	*	*			trans	-85.8	121.9	155.4	-92.1	-177.8	177.9	175	0	108.9	S841 R845	S841-K843 PolarHBondContact O-N 3.13Å; K843-R845 PolarHBondContact O-N 3.21Å; K843-R845 VanDerWaalsContact O-N 3.16Å
844	P	34.6	Very low	35.1	Very low	123 Å²	123	164.3 Å²	164.3	80%	0.799	80%	0.804	S	S	*	*			trans	-71.1	111.4	-171.5	26.9	-31.8	0	0	0	110.5
845	R	38.1	Very low	34.4	Very low	245 Å²	245	164.5 Å²	164.5	93%	0.925	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-84.8	122	167.6	-92.4	-179.6	163.4	165.1	-4.3	109.5	K843 K847	K843-R845 PolarHBondContact O-N 3.21Å; K843-R845 VanDerWaalsContact O-N 3.16Å; R845-K847 PolarHBondContact O-N 3.34Å
846	N	33.4	Very low	34	Very low	165 Å²	165	168.1 Å²	168.1	88%	0.882	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-49.7	129.3	-177.7	-88.8	-31.5	0	0	0	113.6
847	K	30.4	Very low	33.6	Very low	212 Å²	212	165.3 Å²	165.3	92%	0.922	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.7	128.7	173	-69.7	171.8	174.6	173	0	110.6	R845	R845-K847 PolarHBondContact O-N 3.34Å
848	S	34	Very low	33.1	Very low	121 Å²	121	163.6 Å²	163.6	85%	0.846	81%	0.812	S	S	*	*			trans	-131.8	122.8	158.8	176.5	0	0	0	0	108.9
849	R	28.8	Very low	32.8	Very low	236 Å²	236	159.8 Å²	159.8	89%	0.891	81%	0.814	S	S	*	*			trans	-59.4	146.4	-172.3	-71	159.9	160.1	166	-6.8	113.1
850	K	33.9	Very low	32.6	Very low	196 Å²	196	158.9 Å²	158.9	85%	0.852	82%	0.818	S	S	*	*				-179.4	117.9	117.4	-99.2	171.3	-177.7	-179.3	0	113.3
851	H	32.1	Very low	32.4	Very low	160 Å²	160	158.4 Å²	158.4	74%	0.741	83%	0.826	S	S	*	*			trans	62.7	126.7	137.7	-84.4	-54.2	0	0	0	125.1
852	K	31.9	Very low	32.3	Very low	179 Å²	179	158.4 Å²	158.4	78%	0.778	83%	0.831	S	S	*	*			trans	79.8	92.2	131.8	-82.2	178.3	175.9	-179	0	119.7
853	V	29.6	Very low	31.9	Very low	132 Å²	132	161.2 Å²	161.2	80%	0.8	83%	0.833	S	S	*	*				26	117	114.8	-174.1	0	0	0	0	117.3
854	K	33.3	Very low	31.9	Very low	208 Å²	208	159.1 Å²	159.1	90%	0.904	83%	0.831	S	S	*	*				-158.9	120	124.7	-112.7	178.4	-179.1	-176.9	0	110.5
855	C	26.7	Very low	31.7	Very low	116 Å²	116	158.5 Å²	158.5	78%	0.784	83%	0.83	S	S	*	*			trans	-69.1	145	164	-61.1	0	0	0	0	109.8
856	Q	34.4	Very low	31.4	Very low	194 Å²	194	155.6 Å²	155.6	91%	0.907	83%	0.827	S	S	*	*			trans	-161.8	134.9	131.6	-111.3	167.3	-1.3	0	0	111
857	S	28.7	Very low	31.4	Very low	97 Å²	97	151.1 Å²	151.1	68%	0.678	81%	0.808	S	S	*	*			trans	-72.6	151.2	179.6	58.2	0	0	0	0	111.7
858	N	30.7	Very low	31.4	Very low	160 Å²	160	152.4 Å²	152.4	86%	0.856	81%	0.807	S	S	*	*			trans	154.3	105.5	132.5	-78.1	-5	0	0	0	108
859	G	31.6	Very low	31.5	Very low	73 Å²	73	156.6 Å²	156.6	75%	0.753	81%	0.806	S	S	*	*			trans	-158.5	89.9	-179.3	0	0	0	0	0	110.6
860	S	31.1	Very low	31.5	Very low	120 Å²	120	154 Å²	154	84%	0.839	80%	0.804	S	S	*	*			trans	-15.4	131.9	166.5	49.3	0	0	0	0	117.9	A862	S860-A862 PolarHBondContact O-N 3.45Å
861	S	32.2	Very low	31.5	Very low	124 Å²	124	154.1 Å²	154.1	87%	0.867	81%	0.807	S	S	*	*			trans	-41.7	109.3	167	-176.6	0	0	0	0	113	R863	S861-R863 PolarHBondContact O-N 3.45Å
862	A	33.4	Very low	31.4	Very low	86 Å²	86	153.8 Å²	153.8	71%	0.711	81%	0.81	S	S	*	*			trans	-68.9	121.4	171.6	0	0	0	0	0	110.1	S860 N864	S860-A862 PolarHBondContact O-N 3.45Å; A862-N864 PolarHBondContact O-N 2.93Å
863	R	29.4	Very low	31.6	Very low	245 Å²	245	150.1 Å²	150.1	93%	0.925	81%	0.807	S	S	*	*			trans	-72.9	116.3	165.6	-95.3	179.5	176.1	164.6	-1	108.2	S861 S865	S861-R863 PolarHBondContact O-N 3.45Å; R863-S865 PolarHBondContact O-N 3.42Å; R863-S865 VanDerWaalsContact O-N 3.09Å
864	N	30.9	Very low	31.9	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	80%	0.802	S	S	*	*			trans	-62.9	99.4	169.4	-75.3	-25.6	0	0	0	110.1	A862	A862-N864 PolarHBondContact O-N 2.93Å
865	S	31.1	Very low	31.8	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	79%	0.787	S	S	*	*			trans	-99.7	108.3	155.6	52.8	0	0	0	0	108.3	R863 S867	R863-S865 PolarHBondContact O-N 3.42Å; R863-S865 VanDerWaalsContact O-N 3.09Å; S865-S867 VanDerWaalsContact C-N 3.32Å; S865-S867 PolarHBondContact O-N 2.02Å
866	H	31.7	Very low	32.2	Very low	184 Å²	184	145.9 Å²	145.9	85%	0.852	78%	0.782	S	S	*	*			trans	-65.8	91.7	169.8	-79.6	-61.4	0	0	0	109.3	R868	H866-R868 PolarHBondContact O-N 3.06Å
867	S	33.3	Very low	32.2	Very low	70 Å²	70	145.9 Å²	145.9	49%	0.49	78%	0.775	S	S	.	*			trans	-70	103.6	164.1	176.8	0	0	0	0	108.5	S865 Y869	S865-S867 VanDerWaalsContact C-N 3.32Å; S865-S867 PolarHBondContact O-N 2.02Å; S867-Y869 PolarHBondContact O-N 3.22Å; S867-Y869 VanDerWaalsContact O-N 3.13Å; S867-Y869 WeakPolarHBondContact OG-CD2 3.19Å; S867-Y869 WeakPolarHBondContact OG-CE2 3.47Å
868	R	31.4	Very low	32.6	Very low	239 Å²	239	149 Å²	149	90%	0.902	78%	0.784	S	S	*	*			trans	-71.2	94.9	162.5	-100.4	-176.1	-84	-172.1	-5.7	107	H866 Q870	H866-R868 PolarHBondContact O-N 3.06Å; R868-Q870 PolarHBondContact O-N 3.17Å
869	Y	34.9	Very low	32.8	Very low	210 Å²	210	145 Å²	145	82%	0.824	77%	0.773	S	S	*	*			trans	-70.6	109.4	167.9	-74.4	-84.3	0	0	0	108.6	S867	S867-Y869 PolarHBondContact O-N 3.22Å; S867-Y869 VanDerWaalsContact O-N 3.13Å; S867-Y869 WeakPolarHBondContact OG-CD2 3.19Å; S867-Y869 WeakPolarHBondContact OG-CE2 3.47Å
870	Q	29.6	Very low	32.9	Very low	182 Å²	182	151.8 Å²	151.8	85%	0.85	78%	0.777	S	S	*	*			trans	-76.3	131.2	162.3	-104.3	167.2	-42	0	0	108.4	R868 L872	R868-Q870 PolarHBondContact O-N 3.17Å; Q870-L872 PolarHBondContact O-N 2.95Å; Q870-L872 VanDerWaalsContact O-N 3.11Å
871	Q	33.8	Very low	33	Very low	198 Å²	198	158.5 Å²	158.5	93%	0.925	80%	0.796	S	S	*	*			trans	-57.3	110.9	168.7	-90.5	169.7	-56.2	0	0	108.8	S873	Q871-S873 PolarHBondContact O-N 3.41Å
872	L	30.8	Very low	33.1	Very low	153 Å²	153	160.3 Å²	160.3	80%	0.801	79%	0.792	S	S	*	*			trans	-75.7	108.6	165.2	-124	84.3	0	0	0	107.2	Q870 V874	Q870-L872 PolarHBondContact O-N 2.95Å; Q870-L872 VanDerWaalsContact O-N 3.11Å; L872-V874 HydrophobicContact CB-CG2 4.26Å; L872-V874 HydrophobicContact CD2-CG2 4.18Å; L872-V874 PolarHBondContact O-N 2.74Å; L872-V874 VanDerWaalsContact O-N 3.15Å
873	S	35.9	Very low	33	Very low	101 Å²	101	164.2 Å²	164.2	71%	0.706	80%	0.796	S	S	*	*			trans	-72.2	97.2	161.8	57.5	0	0	0	0	107.4	Q871 Y875	Q871-S873 PolarHBondContact O-N 3.41Å; S873-Y875 VanDerWaalsContact C-N 3.33Å; S873-Y875 PolarHBondContact O-N 3.01Å; S873-Y875 VanDerWaalsContact O-N 3.08Å
874	V	35.2	Very low	33.2	Very low	116 Å²	116	159.7 Å²	159.7	70%	0.703	79%	0.789	S	S	*	*			trans	-81.5	86.1	175.1	-175.2	0	0	0	0	107.6	L872	L872-V874 HydrophobicContact CB-CG2 4.26Å; L872-V874 HydrophobicContact CD2-CG2 4.18Å; L872-V874 PolarHBondContact O-N 2.74Å; L872-V874 VanDerWaalsContact O-N 3.15Å
875	Y	31.9	Very low	33.4	Very low	149 Å²	149	160.3 Å²	160.3	58%	0.584	79%	0.789	S	S	*	*			trans	-83.5	125.5	158.8	-88.6	-85.9	0	0	0	107.6	E458 S873 Y877	E458-Y875 PolarHBondContact OE2-OH 2.9Å; S873-Y875 VanDerWaalsContact C-N 3.33Å; S873-Y875 PolarHBondContact O-N 3.01Å; S873-Y875 VanDerWaalsContact O-N 3.08Å; Y875-Y877 PolarHBondContact O-N 3.32Å; Y875-Y877 VanDerWaalsContact O-N 3.07Å
876	P	34.4	Very low	33.5	Very low	103 Å²	103	163.4 Å²	163.4	67%	0.669	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	20.9	-171.6	20.1	-14.6	0	0	0	115.1
877	Y	34.7	Very low	33.6	Very low	194 Å²	194	162 Å²	162	76%	0.761	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-9.2	-177.4	-87.8	-78.8	0	0	0	115.4	Y875 A879	Y875-Y877 PolarHBondContact O-N 3.32Å; Y875-Y877 VanDerWaalsContact O-N 3.07Å; Y877-A879 PolarHBondContact O-N 3.38Å
878	D	35.8	Very low	33.7	Very low	162 Å²	162	168.6 Å²	168.6	87%	0.866	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	10.4	179.4	-67.3	-13	0	0	0	114
879	A	36.2	Very low	33.8	Very low	77 Å²	77	163.2 Å²	163.2	64%	0.636	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	13.6	-179	0	0	0	0	0	114.5	Y877	Y877-A879 PolarHBondContact O-N 3.38Å
880	Y	33	Very low	33.8	Very low	214 Å²	214	159.3 Å²	159.3	84%	0.839	80%	0.797	S	S	*	*			trans	-124.5	55.2	173.9	-76.5	-79.1	0	0	0	111.8
881	E	34	Very low	34.1	Very low	262 Å²	262	157.2 Å²	157.2	100%	1.224	79%	0.792	S	S	*	*			trans	-119.2	0	144.4	-79.2	-170.1	162	0	0	107.5

Retrieved 881 of 881 residues in 298.4 ms (Link to these results)

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