A0A087YAS2_POEFO Loading...

Clustered mitochondria protein homolog

mRNA-binding protein involved in proper cytoplasmic distribution of mitochondria. Specifically binds mRNAs of nuclear-encoded mitochondrial proteins in the cytoplasm and regulates transport or translation of these transcripts close to mitochondria, playing a role in mitochondrial biogenesis.

AlphaFold DB , UniProt , Accession A0A087YAS2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,269 aa.

						>A0A087YAS2_POEFO|A0A087YAS2
MVNGDGAHTEEGESKQDGNSEADGGEDSNEQEVIVIQDTGFTVKIQAPGTEPFDLQVSPQEMVQEIHQVLMDREDTCHRTCFSLQLDGNVLDNFAELKSIEGLQEGSLLKVVEEPYTVREARIHVRHIRDLLKSLDPSDAYNGVDCNSLSFLSIFTDGDLGDSGKRKKKGTELEQIDCTPPEHILPGSKERPLVPLQPQNKDWKPMQCLKVLTMSGWNPPPGNRKMHGDLMYLYIVTVEERHVSVTASTRGFYLNQSTTYTFSPKPANPSFLSHSLVELLSQISPAFKKNFTSLQKKRVQRHPFERIATPFQVYSWTAPQVDHAMDCVRAEDAYTSRLGYEEHIPGQTRDWNEELQTTRELPRKNLPERLLRERAIFKVHSDFAAAATRGAMAVIDGNVMAINPGEETRMQMFIWNNIFFSLGFDVRDHYRELGGDAAAHAAPTNDLNGVRAYGAVDVEGLYTLGTVVVDYRGYRVTAQSIIPGILEREQEQSVIYGSIDFGKTVVSHGKYLELLDKTSRPLKVQQHKVLNEKEESVELCSSVECKGIIGNDGRHYILDLLRTFPPDLNFLPVDGEELSAESQRQGFPRQHRHRLACLRQELIEAFVEHRYLLFMKMAAIQLMQQKANKDSSKTDVPAITETSATDGGVDSTQTTAAQASADSTDPTDNNSTSAAPQMAPESEESSSKPTTNGPVDPTGTQNGECRSPLEDPKSREVVLNACRAVGSISNTSFDIRFNPDIFSPGVRFPDDTLEDVQKQKQLLKDAAAFLVTCQIPSLVKDCLDHSTLPMDGATLTEALHQRGINVRYLGTVLEFVDKTPAKAQLEHFYRIGIVELITRCAKHIFRTYLQGVELSALSAAVSHFLNCFLSSFPDAVAHLPPDELVSRRKSRKRRNRVPGGGDNTAWASLTPSELWKNIATEAQSYYHFKMQCESVDQVVEKYGLQKTTLLREISVKTGIQILLKEYNFDSRHKPAFTEEDILNIFPVVKHVNPKASDAFHFFQSGQAKVQQGFLKEGCELINEALNLFNNVYGAMHVEICACLRLLARLNYIMGDHPEALSNQQKAVLMSERVLGIEHPNTIQEYMHLALYCFANGQLSTALKLLYRARYLMLLVCGEDHPEMALIDSNIGLVLHGVMEYDLSLRFLENALTVNTKYHGARSLKVALSHHLVARVYESKAEFRSALQHEKEGYTIYKNQMGEAHEKTKESSEYLKYLTQQAVALQRTMNEIYKNGSNASIMPLKFTAPSMASILEQLNIINGIIFIPLR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.3	Very low	24.3	Very low	237 Å²	237	142.1 Å²	142.1	100%	1.167	82%	0.823	S	S	*	*				0	118.3	0	-97.9	179.6	172.3	0	0	107.3
2	V	26.7	Very low	24.1	Very low	125 Å²	125	135.9 Å²	135.9	76%	0.758	81%	0.813	S	S	*	*			trans	64.7	91.2	154.3	-165.4	0	0	0	0	115.1
3	N	24.6	Very low	24	Very low	164 Å²	164	139.8 Å²	139.8	88%	0.877	82%	0.817	S	S	*	*				80.8	136	79.5	-76.6	0.6	0	0	0	113.3
4	G	24.7	Very low	24.1	Very low	76 Å²	76	136.9 Å²	136.9	78%	0.784	81%	0.809	S	S	*	*			trans	149	78.1	137.9	0	0	0	0	0	116.7
5	D	24.5	Very low	24.3	Very low	174 Å²	174	140.8 Å²	140.8	93%	0.93	81%	0.811	S	S	*	*			trans	-20.6	157.5	150.5	-65.6	-43.4	0	0	0	119
6	G	22.9	Very low	24.4	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	81%	0.81	S	S	*	*				138.8	79.9	129.4	0	0	0	0	0	118.5
7	A	24.1	Very low	24.5	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	81%	0.812	S	S	*	*				42.2	144.9	125.9	0	0	0	0	0	124
8	H	23.9	Very low	24.5	Very low	167 Å²	167	140.1 Å²	140.1	77%	0.773	81%	0.814	S	S	*	*			trans	116.5	107.1	132.7	-89.8	-59.7	0	0	0	120.9
9	T	21.9	Very low	24.7	Very low	102 Å²	102	140.7 Å²	140.7	63%	0.626	81%	0.814	S	S	*	*				67.7	115.7	127.2	38.7	0	0	0	0	122.7
10	E	24.1	Very low	24.7	Very low	169 Å²	169	139.7 Å²	139.7	79%	0.79	82%	0.815	S	S	*	*				52.6	127	114.7	-74.1	-175.8	165.7	0	0	121.5
11	E	23.2	Very low	24.8	Very low	190 Å²	190	141.7 Å²	141.7	89%	0.888	82%	0.817	S	S	*	*				132.9	135.9	118.6	-103.4	179.2	-169.4	0	0	114.1
12	G	22.6	Very low	24.8	Very low	68 Å²	68	135 Å²	135	70%	0.701	80%	0.799	S	S	*	*			trans	128.2	102.8	140.5	0	0	0	0	0	119.1
13	E	23	Very low	24.8	Very low	186 Å²	186	137.2 Å²	137.2	87%	0.869	81%	0.807	S	S	*	*			trans	86.3	98.5	133.3	-62.9	-169.6	160.3	0	0	122.1
14	S	24.5	Very low	24.8	Very low	100 Å²	100	133 Å²	133	70%	0.699	80%	0.802	S	S	*	*				33.6	129.5	114.5	63.6	0	0	0	0	121.9
15	K	26.9	Very low	24.7	Very low	195 Å²	195	133.3 Å²	133.3	85%	0.848	81%	0.805	S	S	*	*			trans	-174	110.7	133.6	-101.7	166.4	-174	179.1	0	109.4
16	Q	25.7	Very low	25.1	Very low	168 Å²	168	133.9 Å²	133.9	79%	0.785	80%	0.802	S	S	*	*				77.4	104	85.5	-110.5	-176	-1.6	0	0	116.1
17	D	26.5	Very low	25.2	Very low	159 Å²	159	138.3 Å²	138.3	85%	0.85	81%	0.809	S	S	*	*			trans	52.1	128.8	131.3	-59.6	-22.4	0	0	0	123.2
18	G	25.7	Very low	25.3	Very low	82 Å²	82	139.2 Å²	139.2	85%	0.845	81%	0.81	S	S	*	*			trans	-166.5	99.9	158.4	0	0	0	0	0	111.5
19	N	26.5	Very low	25.6	Very low	153 Å²	153	138.9 Å²	138.9	82%	0.818	81%	0.814	S	S	*	*			trans	-83.5	143	-171.3	-164.5	34.4	0	0	0	113.7
20	S	26.1	Very low	25.9	Very low	119 Å²	119	141.7 Å²	141.7	83%	0.832	82%	0.82	S	S	*	*			trans	-166.6	120.9	146.5	58.8	0	0	0	0	112.4
21	E	27.1	Very low	26.1	Very low	182 Å²	182	142.2 Å²	142.2	85%	0.85	82%	0.823	S	S	*	*			trans	-76.3	149	174.7	-64.1	175.1	142.6	0	0	113.6
22	A	26.4	Very low	26.2	Very low	97 Å²	97	140.5 Å²	140.5	80%	0.802	82%	0.815	S	S	*	*				139.9	140.9	124.6	0	0	0	0	0	115.7
23	D	25	Very low	26.5	Very low	171 Å²	171	143.3 Å²	143.3	91%	0.914	82%	0.818	S	S	*	*			trans	65.9	130.7	175.8	-82.8	-13.7	0	0	0	116.9
24	G	25.1	Very low	26.8	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	81%	0.807	S	S	*	*			cis	120.6	107	24.1	0	0	0	0	0	108.2
25	G	23.9	Very low	27	Very low	82 Å²	82	140 Å²	140	85%	0.845	80%	0.8	S	S	*	*			trans	134.4	119.7	170	0	0	0	0	0	115.1
26	E	31.7	Very low	27.6	Very low	187 Å²	187	134.6 Å²	134.6	87%	0.874	78%	0.78	S	S	*	*			trans	-62.1	143.7	178.1	-61.8	165.9	142.4	0	0	113.1
27	D	25.7	Very low	28.3	Very low	162 Å²	162	134 Å²	134	87%	0.866	78%	0.777	S	S	*	*				174.8	107.4	127.4	-94.2	-25.6	0	0	0	110.5
28	S	26.3	Very low	29.4	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	76%	0.755	S	S	*	*			trans	-137.1	81.5	159.5	63.7	0	0	0	0	108.6	E30	S28-E30 PolarHBondContact O-N 3.39Å; S28-E30 VanDerWaalsContact O-N 3.16Å
29	N	29.8	Very low	31	Very low	161 Å²	161	131.4 Å²	131.4	86%	0.861	75%	0.748	S	S	*	*			trans	-83.4	63.8	165.1	-148	7.7	0	0	0	108
30	E	27.4	Very low	33.2	Very low	160 Å²	160	125.3 Å²	125.3	75%	0.748	72%	0.721	S	S	*	*			trans	-92.2	110.3	163.4	-72.9	-171.5	163.2	0	0	106.6	S28 E32	S28-E30 PolarHBondContact O-N 3.39Å; S28-E30 VanDerWaalsContact O-N 3.16Å; E30-E32 PolarHBondContact O-N 3.37Å
31	Q	29.1	Very low	36.1	Very low	180 Å²	180	121 Å²	121	84%	0.841	69%	0.688	S	S	*	*			trans	-61.1	87.7	155.4	-86.1	176.4	-32	0	0	106.5	V33	Q31-V33 VanDerWaalsContact C-N 3.32Å; Q31-V33 PolarHBondContact O-N 2.8Å
32	E	26	Very low	39	Very low	155 Å²	155	114.2 Å²	114.2	72%	0.724	66%	0.659	S	S	*	*			trans	-57.4	104.4	160.5	-89.1	-172.7	152.1	0	0	106.6	E30 I34	E30-E32 PolarHBondContact O-N 3.37Å; E32-I34 HydrophobicContact CB-CG1 4.21Å; E32-I34 PolarHBondContact O-N 3.24Å
33	V	28.4	Very low	42.2	Very low	126 Å²	126	109.6 Å²	109.6	76%	0.764	62%	0.62	S	S	*	*			trans	-59.9	89.7	154	178.4	0	0	0	0	104.6	Q31 V35	Q31-V33 VanDerWaalsContact C-N 3.32Å; Q31-V33 PolarHBondContact O-N 2.8Å; V33-V35 HydrophobicContact CG1-CG2 4.11Å; V33-V35 PolarHBondContact O-N 3.23Å
34	I	28.9	Very low	45.4	Very low	126 Å²	126	105.8 Å²	105.8	65%	0.646	60%	0.596	S	S	*	*			trans	-68.2	88.9	170.1	-56.6	175.3	0	0	0	105.2	E32 I36	E32-I34 HydrophobicContact CB-CG1 4.21Å; E32-I34 PolarHBondContact O-N 3.24Å; I34-I36 VanDerWaalsContact C-N 3.26Å; I34-I36 HydrophobicContact CG2-CG1 3.8Å; I34-I36 PolarHBondContact O-N 3.16Å
35	V	29.6	Very low	48.6	Very low	91 Å²	91	102.1 Å²	102.1	55%	0.552	56%	0.558	S	S	*	*			trans	-60.4	100.5	155.9	179.8	0	0	0	0	104.2	V33 Q37	V33-V35 HydrophobicContact CG1-CG2 4.11Å; V33-V35 PolarHBondContact O-N 3.23Å; V35-Q37 HydrophobicContact CG1-CB 4.03Å; V35-Q37 HydrophobicContact CG1-CG 3.64Å; V35-Q37 PolarHBondContact O-N 2.94Å
36	I	38.2	Very low	51.9	Low	82 Å²	82	101.6 Å²	101.6	42%	0.421	53%	0.534	S	S	.	.			trans	-72.2	68.9	166.4	-52.3	174.4	0	0	0	106	I34 D38	I34-I36 VanDerWaalsContact C-N 3.26Å; I34-I36 HydrophobicContact CG2-CG1 3.8Å; I34-I36 PolarHBondContact O-N 3.16Å; I36-D38 PolarHBondContact O-N 3.33Å; I36-D38 VanDerWaalsContact O-N 3.1Å
37	Q	40.7	Very low	54.6	Low	154 Å²	154	92.8 Å²	92.8	72%	0.72	49%	0.493	S	S	*	.			trans	-75.3	86.8	155	-93.2	174.6	12.9	0	0	104.5	V35 T39	V35-Q37 HydrophobicContact CG1-CB 4.03Å; V35-Q37 HydrophobicContact CG1-CG 3.64Å; V35-Q37 PolarHBondContact O-N 2.94Å; Q37-T39 PolarHBondContact O-N 2.92Å
38	D	49.4	Very low	57.5	Low	72 Å²	72	87.1 Å²	87.1	39%	0.385	47%	0.465	S	S	.	.			trans	-57.7	94.5	161.9	-111.2	2.9	0	0	0	105.9	I36 G40 S58 Q60	I36-D38 PolarHBondContact O-N 3.33Å; I36-D38 VanDerWaalsContact O-N 3.1Å; D38-G40 PolarHBondContact O-N 3.38Å; D38-S58 PolarHBondContact OD2-OG 3.45Å; D38-Q60 PolarHBondContact OD1-NE2 2.98Å
39	T	58.7	Low	60	Low	115 Å²	115	86.4 Å²	86.4	71%	0.706	48%	0.475	S	S	*	.			trans	-69.3	86.8	171.2	48.5	0	0	0	0	106.6	Q37	Q37-T39 PolarHBondContact O-N 2.92Å
40	G	74.3	Confident	62.5	Low	25 Å²	25	80.9 Å²	80.9	26%	0.258	45%	0.447	S	S	.	.			trans	-55.5	146.8	173.1	0	0	0	0	0	110.2	D38 V57	D38-G40 PolarHBondContact O-N 3.38Å; G40-V57 CarbonylContact C-O 3.58Å; G40-V57 WeakPolarHBondContact CA-O 3.44Å
41	F	85.6	Confident	65.4	Low	29 Å²	29	81.5 Å²	81.5	13%	0.127	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	155.4	178.1	71.4	-81.7	0	0	0	108.9	V43 V57 P59 L97 L103 E105	F41-V43 HydrophobicContact CD2-CG1 3.99Å; F41-V43 HydrophobicContact CE2-CG1 3.46Å; F41-V43 VanDerWaalsContact CE2-CG1 3.46Å; F41-V43 HydrophobicContact CZ-CG1 4.31Å; F41-V57 HydrophobicContact CD1-CG2 4.18Å; F41-V57 HydrophobicContact CD2-CG2 4.2Å; F41-V57 HydrophobicContact CE1-CG2 3.82Å; F41-V57 HydrophobicContact CE2-CG2 3.87Å; F41-V57 HydrophobicContact CG-CG2 4.36Å; F41-V57 HydrophobicContact CZ-CG2 3.66Å; F41-V57 PolarHBondContact N-O 2.95Å; F41-V57 WeakPolarHBondContact O-CG2 3.44Å; F41-V57 PolarHBondContact O-N 3.05Å; F41-P59 HydrophobicContact CD1-CG 3.9Å; F41-P59 HydrophobicContact CE1-CB 4.31Å; F41-P59 HydrophobicContact CE1-CG 4.04Å; F41-L97 HydrophobicContact CE1-CB 4.46Å; F41-L97 HydrophobicContact CZ-CB 4.2Å; F41-L97 HydrophobicContact CZ-CD1 4.44Å; F41-L103 HydrophobicContact CE2-CD2 4.08Å; F41-L103 HydrophobicContact CE2-CG 3.97Å; F41-L103 HydrophobicContact CZ-CD2 3.77Å; F41-L103 HydrophobicContact CZ-CG 4.13Å; F41-E105 WeakPolarHBondContact CA-OE2 3.25Å; F41-E105 WeakPolarHBondContact CB-OE2 3.34Å
42	T	89.7	Confident	68.3	Low	39 Å²	39	76.1 Å²	76.1	24%	0.239	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132	-176.4	-41.2	0	0	0	0	110.1	D54 L55 E105 G106	T42-D54 HydrophobicContact CG2-CB 3.64Å; T42-L55 WeakPolarHBondContact CA-O 3.34Å; T42-E105 WeakPolarHBondContact CB-OE1 3.21Å; T42-E105 VanDerWaalsContact N-CD 3.27Å; T42-E105 PolarHBondContact N-OE1 3.41Å; T42-E105 PolarHBondContact N-OE2 3.05Å; T42-E105 PolarHBondContact OG1-OE1 3.23Å; T42-G106 PolarHBondContact O-N 3.18Å
43	V	92.3	Very high	71.4	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	147	168.2	-64.2	0	0	0	0	110.1	F41 I45 L55 V57 L103 L109	F41-V43 HydrophobicContact CD2-CG1 3.99Å; F41-V43 HydrophobicContact CE2-CG1 3.46Å; F41-V43 VanDerWaalsContact CE2-CG1 3.46Å; F41-V43 HydrophobicContact CZ-CG1 4.31Å; V43-I45 HydrophobicContact CG2-CG1 4.47Å; V43-L55 HydrophobicContact CG2-CB 4.19Å; V43-L55 WeakPolarHBondContact CG2-O 3.45Å; V43-L55 PolarHBondContact N-O 2.89Å; V43-L55 PolarHBondContact O-N 3.39Å; V43-V57 HydrophobicContact CB-CG2 4.48Å; V43-V57 HydrophobicContact CG1-CG2 3.83Å; V43-V57 HydrophobicContact CG2-CG1 3.92Å; V43-V57 HydrophobicContact CG2-CG2 3.92Å; V43-L103 HydrophobicContact CG1-CD1 4.06Å; V43-L109 HydrophobicContact CB-CD1 4.28Å; V43-L109 HydrophobicContact CG2-CD1 4.08Å
44	K	92.7	Very high	74.5	Confident	91 Å²	91	69 Å²	69	40%	0.396	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	124.5	174.1	-73.6	-177.1	178.2	-178.3	0	109.5	F53 D54 S107 L108 L109	K44-F53 CarbonylContact C-O 3.57Å; K44-F53 WeakPolarHBondContact CA-O 3.34Å; K44-D54 WeakPolarHBondContact CE-OD1 3.31Å; K44-D54 VanDerWaalsContact CG-OD1 3.3Å; K44-D54 WeakPolarHBondContact CG-OD1 3.48Å; K44-S107 PolarHBondContact N-O 3.4Å; K44-L108 HydrophobicContact CB-CD1 3.71Å; K44-L108 CarbonylContact O-C 3.51Å; K44-L108 WeakPolarHBondContact O-CA 3.4Å; K44-L109 PolarHBondContact O-N 3.23Å
45	I	92.3	Very high	77.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.6	175.3	-57.3	-169.9	0	0	0	109.8	V43 P52 F53 L55 I66 L70 L109 V111	V43-I45 HydrophobicContact CG2-CG1 4.47Å; I45-P52 VanDerWaalsContact O-CA 3.29Å; I45-P52 WeakPolarHBondContact O-CA 3.47Å; I45-F53 HydrophobicContact CB-CE1 4.07Å; I45-F53 HydrophobicContact CB-CE2 4.06Å; I45-F53 HydrophobicContact CB-CZ 3.78Å; I45-F53 HydrophobicContact CD1-CE2 4.44Å; I45-F53 HydrophobicContact CD1-CZ 4.43Å; I45-F53 HydrophobicContact CG1-CE2 4.49Å; I45-F53 HydrophobicContact CG2-CE1 4.18Å; I45-F53 HydrophobicContact CG2-CZ 4.02Å; I45-F53 PolarHBondContact N-O 2.88Å; I45-F53 PolarHBondContact O-N 3.44Å; I45-L55 HydrophobicContact CD1-CB 4.02Å; I45-L55 HydrophobicContact CD1-CD2 3.47Å; I45-L55 VanDerWaalsContact CD1-CD2 3.47Å; I45-L55 HydrophobicContact CD1-CG 4.36Å; I45-L55 HydrophobicContact CG1-CB 4.27Å; I45-I66 HydrophobicContact CD1-CG2 3.61Å; I45-L70 HydrophobicContact CD1-CD1 4.28Å; I45-L70 HydrophobicContact CD1-CD2 3.87Å; I45-L70 HydrophobicContact CD1-CG 4.29Å; I45-L70 HydrophobicContact CG2-CD1 4.26Å; I45-L70 HydrophobicContact CG2-CD2 4.03Å; I45-L109 WeakPolarHBondContact CA-O 3.32Å; I45-L109 HydrophobicContact CG1-CB 4.47Å; I45-V111 HydrophobicContact CG2-CG2 3.7Å
46	Q	93.3	Very high	80.2	Confident	70 Å²	70	66.7 Å²	66.7	33%	0.327	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	105.6	172.7	-179.9	173.1	41.8	0	0	110.1	P52 L108 L109 V111	Q46-P52 HydrophobicContact CB-CB 4.45Å; Q46-P52 HydrophobicContact CB-CG 4.3Å; Q46-P52 HydrophobicContact CG-CG 4.33Å; Q46-L108 HydrophobicContact CB-CD1 3.88Å; Q46-L109 PolarHBondContact N-O 3.07Å; Q46-V111 PolarHBondContact O-N 2.84Å
47	A	89.2	Confident	82.5	Confident	2 Å²	2	63 Å²	63	2%	0.017	35%	0.354	C	S	.	.			trans	-90.5	155.9	170.2	0	0	0	0	0	112.5	G49 T50 T76 V111	A47-G49 PolarHBondContact O-N 3.44Å; A47-T50 VanDerWaalsContact C-OG1 3.31Å; A47-T50 WeakPolarHBondContact CA-OG1 3.44Å; A47-T50 WeakPolarHBondContact CB-OG1 3.36Å; A47-T50 PolarHBondContact N-OG1 2.97Å; A47-T50 PolarHBondContact O-N 3.16Å; A47-T50 PolarHBondContact O-OG1 3.24Å; A47-T76 HydrophobicContact CB-CG2 3.8Å; A47-V111 HydrophobicContact CB-CB 4.15Å; A47-V111 HydrophobicContact CB-CG2 4.14Å
48	P	85.5	Confident	84.5	Confident	44 Å²	44	56.3 Å²	56.3	29%	0.286	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	126.7	-179.4	-24	33.9	0	0	0	111.7	T50 R79 V111 E113	P48-T50 VanDerWaalsContact C-N 3.26Å; P48-T50 PolarHBondContact O-N 3.46Å; P48-R79 PolarHBondContact O-NH2 3.46Å; P48-V111 WeakPolarHBondContact CD-O 3.47Å; P48-E113 HydrophobicContact CG-CG 4.2Å
49	G	79.4	Confident	85.9	Confident	93 Å²	93	54.6 Å²	54.6	96%	0.959	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	8.1	177.9	0	0	0	0	0	115.6	A47	A47-G49 PolarHBondContact O-N 3.44Å
50	T	82.8	Confident	86.7	Confident	44 Å²	44	54.1 Å²	54.1	27%	0.27	31%	0.307	S	S	.	.	S	Bend	trans	-118.6	151.2	176.1	57	0	0	0	0	111.3	A47 P48	A47-T50 VanDerWaalsContact C-OG1 3.31Å; A47-T50 WeakPolarHBondContact CA-OG1 3.44Å; A47-T50 WeakPolarHBondContact CB-OG1 3.36Å; A47-T50 PolarHBondContact N-OG1 2.97Å; A47-T50 PolarHBondContact O-N 3.16Å; A47-T50 PolarHBondContact O-OG1 3.24Å; P48-T50 VanDerWaalsContact C-N 3.26Å; P48-T50 PolarHBondContact O-N 3.46Å
51	E	87.1	Confident	87	Confident	173 Å²	173	55.8 Å²	55.8	81%	0.808	31%	0.308	S	S	*	.			trans	-68.3	147.2	170.2	-67.4	-170.8	166.8	0	0	110.7	F53	E51-F53 PolarHBondContact O-N 2.93Å
52	P	90.1	Very high	87	Confident	68 Å²	68	57.4 Å²	57.4	44%	0.442	32%	0.317	S	S	.	.			trans	-58.7	135.9	175.3	-20.4	31.5	0	0	0	110.9	I45 Q46 L108	I45-P52 VanDerWaalsContact O-CA 3.29Å; I45-P52 WeakPolarHBondContact O-CA 3.47Å; Q46-P52 HydrophobicContact CB-CB 4.45Å; Q46-P52 HydrophobicContact CB-CG 4.3Å; Q46-P52 HydrophobicContact CG-CG 4.33Å; P52-L108 HydrophobicContact CB-CD1 4.28Å
53	F	91.8	Very high	86.8	Confident	29 Å²	29	55.5 Å²	55.5	13%	0.127	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	154.1	175.1	66.9	-94.2	0	0	0	111.1	K44 I45 E51 L55 L70 R73	K44-F53 CarbonylContact C-O 3.57Å; K44-F53 WeakPolarHBondContact CA-O 3.34Å; I45-F53 HydrophobicContact CB-CE1 4.07Å; I45-F53 HydrophobicContact CB-CE2 4.06Å; I45-F53 HydrophobicContact CB-CZ 3.78Å; I45-F53 HydrophobicContact CD1-CE2 4.44Å; I45-F53 HydrophobicContact CD1-CZ 4.43Å; I45-F53 HydrophobicContact CG1-CE2 4.49Å; I45-F53 HydrophobicContact CG2-CE1 4.18Å; I45-F53 HydrophobicContact CG2-CZ 4.02Å; I45-F53 PolarHBondContact N-O 2.88Å; I45-F53 PolarHBondContact O-N 3.44Å; E51-F53 PolarHBondContact O-N 2.93Å; F53-L55 HydrophobicContact CE2-CB 4.34Å; F53-L70 HydrophobicContact CZ-CD2 3.65Å; F53-R73 VanDerWaalsContact CD2-NH1 3.28Å; F53-R73 VanDerWaalsContact CE2-NH1 3.3Å; F53-R73 VanDerWaalsContact CZ-CD 3.46Å
54	D	92.3	Very high	86.5	Confident	102 Å²	102	59.8 Å²	59.8	55%	0.545	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	132.2	179	-63.1	-28.5	0	0	0	110.3	T42 K44	T42-D54 HydrophobicContact CG2-CB 3.64Å; K44-D54 WeakPolarHBondContact CE-OD1 3.31Å; K44-D54 VanDerWaalsContact CG-OD1 3.3Å; K44-D54 WeakPolarHBondContact CG-OD1 3.48Å
55	L	89.6	Confident	86.1	Confident	24 Å²	24	57.9 Å²	57.9	13%	0.126	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.6	171.5	-178.8	69.1	0	0	0	108.7	T42 V43 I45 F53 V57 I66 V69	T42-L55 WeakPolarHBondContact CA-O 3.34Å; V43-L55 HydrophobicContact CG2-CB 4.19Å; V43-L55 WeakPolarHBondContact CG2-O 3.45Å; V43-L55 PolarHBondContact N-O 2.89Å; V43-L55 PolarHBondContact O-N 3.39Å; I45-L55 HydrophobicContact CD1-CB 4.02Å; I45-L55 HydrophobicContact CD1-CD2 3.47Å; I45-L55 VanDerWaalsContact CD1-CD2 3.47Å; I45-L55 HydrophobicContact CD1-CG 4.36Å; I45-L55 HydrophobicContact CG1-CB 4.27Å; F53-L55 HydrophobicContact CE2-CB 4.34Å; L55-V57 HydrophobicContact CD2-CG1 3.82Å; L55-V57 HydrophobicContact CG-CG1 3.95Å; L55-I66 HydrophobicContact CD2-CG2 3.95Å; L55-V69 HydrophobicContact CD1-CG1 3.82Å; L55-V69 HydrophobicContact CD2-CG1 4.25Å
56	Q	89.3	Confident	85.9	Confident	144 Å²	144	57.9 Å²	57.9	67%	0.673	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.5	172	-168.9	177	2.2	0	0	109.2
57	V	85.9	Confident	85.6	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149.2	-177.3	-66.9	0	0	0	0	110.3	G40 F41 V43 L55 E61 I66 L97	G40-V57 CarbonylContact C-O 3.58Å; G40-V57 WeakPolarHBondContact CA-O 3.44Å; F41-V57 HydrophobicContact CD1-CG2 4.18Å; F41-V57 HydrophobicContact CD2-CG2 4.2Å; F41-V57 HydrophobicContact CE1-CG2 3.82Å; F41-V57 HydrophobicContact CE2-CG2 3.87Å; F41-V57 HydrophobicContact CG-CG2 4.36Å; F41-V57 HydrophobicContact CZ-CG2 3.66Å; F41-V57 PolarHBondContact N-O 2.95Å; F41-V57 WeakPolarHBondContact O-CG2 3.44Å; F41-V57 PolarHBondContact O-N 3.05Å; V43-V57 HydrophobicContact CB-CG2 4.48Å; V43-V57 HydrophobicContact CG1-CG2 3.83Å; V43-V57 HydrophobicContact CG2-CG1 3.92Å; V43-V57 HydrophobicContact CG2-CG2 3.92Å; L55-V57 HydrophobicContact CD2-CG1 3.82Å; L55-V57 HydrophobicContact CG-CG1 3.95Å; V57-E61 VanDerWaalsContact CA-OE2 3.31Å; V57-E61 WeakPolarHBondContact CA-OE2 3.23Å; V57-E61 WeakPolarHBondContact CB-OE2 3.28Å; V57-I66 HydrophobicContact CG1-CD1 4.02Å; V57-I66 HydrophobicContact CG1-CG1 4.07Å; V57-L97 HydrophobicContact CB-CD1 3.56Å; V57-L97 HydrophobicContact CG1-CD1 4.12Å; V57-L97 HydrophobicContact CG2-CD1 3.71Å
58	S	82.6	Confident	85.4	Confident	15 Å²	15	61.4 Å²	61.4	11%	0.105	33%	0.334	C	S	.	.			trans	-88.9	142.3	171.6	162.6	0	0	0	0	110.7	D38 Q60 E61	D38-S58 PolarHBondContact OD2-OG 3.45Å; S58-Q60 PolarHBondContact O-N 2.87Å; S58-Q60 PolarHBondContact OG-N 3.48Å; S58-E61 VanDerWaalsContact N-CD 3.28Å; S58-E61 PolarHBondContact N-OE2 3.09Å; S58-E61 VanDerWaalsContact N-OE2 3.12Å; S58-E61 WeakPolarHBondContact O-CB 3.34Å; S58-E61 PolarHBondContact O-N 3.4Å
59	P	79.3	Confident	85.4	Confident	35 Å²	35	62.5 Å²	62.5	23%	0.227	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.5	173.7	-22.4	31.6	0	0	0	114.7	F41 K98	F41-P59 HydrophobicContact CD1-CG 3.9Å; F41-P59 HydrophobicContact CE1-CB 4.31Å; F41-P59 HydrophobicContact CE1-CG 4.04Å; P59-K98 HydrophobicContact CB-CB 3.95Å; P59-K98 WeakPolarHBondContact O-CB 3.43Å; P59-K98 WeakPolarHBondContact O-CG 3.5Å; P59-K98 PolarHBondContact O-N 3.1Å
60	Q	76.1	Confident	85.8	Confident	106 Å²	106	58.1 Å²	58.1	50%	0.495	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.7	-178.9	-50.6	-173.2	29.4	0	0	113.3	D38 S58	D38-Q60 PolarHBondContact OD1-NE2 2.98Å; S58-Q60 PolarHBondContact O-N 2.87Å; S58-Q60 PolarHBondContact OG-N 3.48Å
61	E	80.8	Confident	85.9	Confident	60 Å²	60	58.2 Å²	58.2	28%	0.28	29%	0.292	S	S	.	.	S	Bend	trans	-66.8	151.6	177.8	-69.6	175.4	173.5	0	0	110.7	V57 S58 E65 E96 L97	V57-E61 VanDerWaalsContact CA-OE2 3.31Å; V57-E61 WeakPolarHBondContact CA-OE2 3.23Å; V57-E61 WeakPolarHBondContact CB-OE2 3.28Å; S58-E61 VanDerWaalsContact N-CD 3.28Å; S58-E61 PolarHBondContact N-OE2 3.09Å; S58-E61 VanDerWaalsContact N-OE2 3.12Å; S58-E61 WeakPolarHBondContact O-CB 3.34Å; S58-E61 PolarHBondContact O-N 3.4Å; E61-E65 WeakPolarHBondContact CA-OE2 3.45Å; E61-E65 WeakPolarHBondContact CB-OE2 3.37Å; E61-E65 VanDerWaalsContact CG-OE2 3.26Å; E61-E65 WeakPolarHBondContact CG-OE2 3.46Å; E61-E96 CarbonylContact O-C 3.53Å; E61-E96 WeakPolarHBondContact O-CA 3.45Å; E61-L97 HydrophobicContact CB-CD1 4.02Å; E61-L97 HydrophobicContact CB-CG 4.47Å; E61-L97 WeakPolarHBondContact O-CG 3.43Å; E61-L97 PolarHBondContact O-N 3.2Å
62	M	85.7	Confident	85.6	Confident	62 Å²	62	53.9 Å²	53.9	31%	0.305	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-88.5	152.7	171.6	-69.2	-179.5	-70.1	0	0	110.6	Q64 E65 A95	M62-Q64 PolarHBondContact O-N 3.09Å; M62-Q64 VanDerWaalsContact O-N 3.11Å; M62-E65 HydrophobicContact CB-CG 4.38Å; M62-E65 PolarHBondContact N-OE2 3.44Å; M62-E65 WeakPolarHBondContact O-CB 3.37Å; M62-E65 PolarHBondContact O-N 3.16Å; M62-A95 WeakPolarHBondContact CA-O 3.31Å
63	V	85.5	Confident	85.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-53.8	-34.2	173	175.7	0	0	0	0	111.9	E65 I66 H67 L84 L91 D92 A95 L97 I100	V63-E65 PolarHBondContact O-N 3.32Å; V63-I66 WeakPolarHBondContact O-CB 3.24Å; V63-I66 PolarHBondContact O-N 3.2Å; V63-H67 PolarHBondContact O-N 3.39Å; V63-H67 VanDerWaalsContact O-N 3.15Å; V63-L84 HydrophobicContact CG1-CB 4.33Å; V63-L84 HydrophobicContact CG1-CD1 3.88Å; V63-L91 HydrophobicContact CG1-CB 3.88Å; V63-L91 HydrophobicContact CG1-CD1 4.5Å; V63-L91 HydrophobicContact CG2-CB 4.06Å; V63-L91 HydrophobicContact CG2-CD1 4.38Å; V63-D92 VanDerWaalsContact CB-O 3.28Å; V63-D92 WeakPolarHBondContact CB-O 3.45Å; V63-D92 VanDerWaalsContact CG2-O 3.29Å; V63-D92 WeakPolarHBondContact CG2-O 3.38Å; V63-A95 PolarHBondContact N-O 3.44Å; V63-A95 VanDerWaalsContact N-O 3.1Å; V63-L97 HydrophobicContact CG2-CD2 3.96Å; V63-I100 HydrophobicContact CG2-CD1 3.43Å; V63-I100 VanDerWaalsContact CG2-CD1 3.43Å
64	Q	85.4	Confident	84.7	Confident	89 Å²	89	56.2 Å²	56.2	42%	0.416	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-29.9	174.7	-175.8	173.6	2.7	0	0	113.5	M62 H67 Q68 N93	M62-Q64 PolarHBondContact O-N 3.09Å; M62-Q64 VanDerWaalsContact O-N 3.11Å; Q64-H67 WeakPolarHBondContact O-CB 3.28Å; Q64-H67 PolarHBondContact O-N 3.49Å; Q64-Q68 PolarHBondContact O-N 3.4Å; Q64-N93 HydrophobicContact CB-CB 4.35Å; Q64-N93 VanDerWaalsContact CB-O 3.25Å; Q64-N93 WeakPolarHBondContact CB-O 3.39Å; Q64-N93 PolarHBondContact N-O 3.1Å
65	E	84.5	Confident	84.2	Confident	51 Å²	51	55.3 Å²	55.3	24%	0.238	27%	0.271	C	S	.	.	H	α-helix	trans	-71.3	-38	178.1	-63.7	177.9	163.4	0	0	110.2	E61 M62 V63 H67 Q68 V69 R374	E61-E65 WeakPolarHBondContact CA-OE2 3.45Å; E61-E65 WeakPolarHBondContact CB-OE2 3.37Å; E61-E65 VanDerWaalsContact CG-OE2 3.26Å; E61-E65 WeakPolarHBondContact CG-OE2 3.46Å; M62-E65 HydrophobicContact CB-CG 4.38Å; M62-E65 PolarHBondContact N-OE2 3.44Å; M62-E65 WeakPolarHBondContact O-CB 3.37Å; M62-E65 PolarHBondContact O-N 3.16Å; V63-E65 PolarHBondContact O-N 3.32Å; E65-H67 VanDerWaalsContact C-N 3.31Å; E65-H67 PolarHBondContact O-N 2.95Å; E65-Q68 PolarHBondContact O-N 3.39Å; E65-Q68 VanDerWaalsContact O-N 3.15Å; E65-V69 WeakPolarHBondContact O-CG2 3.37Å; E65-V69 PolarHBondContact O-N 3.42Å; E65-R374 IonicContact OE1-NH2 2.82Å
66	I	88.1	Confident	84.2	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-43.5	169.3	-57.4	-177.6	0	0	0	110.4	I45 L55 V57 V63 Q68 V69 L70 L84 L97 L109	I45-I66 HydrophobicContact CD1-CG2 3.61Å; L55-I66 HydrophobicContact CD2-CG2 3.95Å; V57-I66 HydrophobicContact CG1-CD1 4.02Å; V57-I66 HydrophobicContact CG1-CG1 4.07Å; V63-I66 WeakPolarHBondContact O-CB 3.24Å; V63-I66 PolarHBondContact O-N 3.2Å; I66-Q68 VanDerWaalsContact C-N 3.3Å; I66-Q68 PolarHBondContact O-N 2.89Å; I66-V69 PolarHBondContact O-N 3.24Å; I66-L70 HydrophobicContact CG2-CD1 4.26Å; I66-L70 HydrophobicContact CG2-CG 4.4Å; I66-L70 VanDerWaalsContact O-CG 3.31Å; I66-L70 WeakPolarHBondContact O-CG 3.25Å; I66-L70 PolarHBondContact O-N 3.22Å; I66-L84 HydrophobicContact CB-CD1 3.81Å; I66-L84 HydrophobicContact CG2-CD1 3.59Å; I66-L97 HydrophobicContact CD1-CD1 3.86Å; I66-L97 HydrophobicContact CD1-CD2 3.64Å; I66-L97 HydrophobicContact CD1-CG 4.38Å; I66-L97 HydrophobicContact CG1-CD1 4.39Å; I66-L109 HydrophobicContact CD1-CD1 3.88Å
67	H	87.1	Confident	84.1	Confident	24 Å²	24	47.6 Å²	47.6	11%	0.111	24%	0.235	C	C	.	.	H	α-helix	trans	-54.2	-46.2	174.1	-98.9	-96.3	0	0	0	112.3	V63 Q64 E65 L70 M71 F82	V63-H67 PolarHBondContact O-N 3.39Å; V63-H67 VanDerWaalsContact O-N 3.15Å; Q64-H67 WeakPolarHBondContact O-CB 3.28Å; Q64-H67 PolarHBondContact O-N 3.49Å; E65-H67 VanDerWaalsContact C-N 3.31Å; E65-H67 PolarHBondContact O-N 2.95Å; H67-L70 PolarHBondContact O-N 3.35Å; H67-M71 WeakPolarHBondContact O-CG 3.47Å; H67-M71 PolarHBondContact O-N 2.96Å; H67-F82 HydrophobicContact CB-CZ 4.47Å; H67-F82 AromaticContact CE1-CD2 3.22Å; H67-F82 WeakPolarHBondContact CE1-CD2 3.31Å; H67-F82 AromaticContact CE1-CE2 3.09Å; H67-F82 WeakPolarHBondContact CE1-CE2 3.24Å; H67-F82 AromaticContact CE1-CG 3.97Å; H67-F82 AromaticContact CE1-CZ 3.7Å; H67-F82 PolarHBondContact CE1-O 3.34Å; H67-F82 VanDerWaalsContact CE1-O 3.23Å; H67-F82 AromaticContact CG-CE2 3.74Å; H67-F82 AromaticContact CG-CZ 3.94Å; H67-F82 AromaticContact ND1-CD2 3.74Å; H67-F82 AromaticContact ND1-CE1 3.97Å; H67-F82 AromaticContact ND1-CE2 3.16Å; H67-F82 WeakPolarHBondContact ND1-CE2 3.27Å; H67-F82 AromaticContact ND1-CZ 3.28Å; H67-F82 VanDerWaalsContact ND1-CZ 3.28Å; H67-F82 WeakPolarHBondContact ND1-CZ 3.48Å; H67-F82 AromaticContact NE2-CD2 3.84Å; H67-F82 AromaticContact NE2-CE2 3.63Å
68	Q	84.3	Confident	84.3	Confident	122 Å²	122	48.4 Å²	48.4	57%	0.57	24%	0.239	S	C	*	.	H	α-helix	trans	-65.6	-43.9	179.1	-172.5	173	-3.5	0	0	111.8	Q64 E65 I66 L70 M71 D72	Q64-Q68 PolarHBondContact O-N 3.4Å; E65-Q68 PolarHBondContact O-N 3.39Å; E65-Q68 VanDerWaalsContact O-N 3.15Å; I66-Q68 VanDerWaalsContact C-N 3.3Å; I66-Q68 PolarHBondContact O-N 2.89Å; Q68-L70 VanDerWaalsContact C-N 3.27Å; Q68-L70 PolarHBondContact O-N 2.96Å; Q68-M71 PolarHBondContact O-N 3.37Å; Q68-M71 VanDerWaalsContact O-N 3.07Å; Q68-D72 PolarHBondContact O-N 3.19Å
69	V	85.4	Confident	84.6	Confident	66 Å²	66	48.5 Å²	48.5	40%	0.4	24%	0.237	S	C	.	.	H	α-helix	trans	-57.6	-41.6	175.4	171.9	0	0	0	0	111.2	L55 E65 I66 D72 R73	L55-V69 HydrophobicContact CD1-CG1 3.82Å; L55-V69 HydrophobicContact CD2-CG1 4.25Å; E65-V69 WeakPolarHBondContact O-CG2 3.37Å; E65-V69 PolarHBondContact O-N 3.42Å; I66-V69 PolarHBondContact O-N 3.24Å; V69-D72 PolarHBondContact O-N 3.37Å; V69-R73 WeakPolarHBondContact O-CB 3.48Å; V69-R73 PolarHBondContact O-N 2.87Å
70	L	88	Confident	85.2	Confident	1 Å²	1	48 Å²	48	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-35.3	176.4	-67.9	178.2	0	0	0	113	I45 F53 I66 H67 Q68 D72 T76 C77 F82 L84 V111	I45-L70 HydrophobicContact CD1-CD1 4.28Å; I45-L70 HydrophobicContact CD1-CD2 3.87Å; I45-L70 HydrophobicContact CD1-CG 4.29Å; I45-L70 HydrophobicContact CG2-CD1 4.26Å; I45-L70 HydrophobicContact CG2-CD2 4.03Å; F53-L70 HydrophobicContact CZ-CD2 3.65Å; I66-L70 HydrophobicContact CG2-CD1 4.26Å; I66-L70 HydrophobicContact CG2-CG 4.4Å; I66-L70 VanDerWaalsContact O-CG 3.31Å; I66-L70 WeakPolarHBondContact O-CG 3.25Å; I66-L70 PolarHBondContact O-N 3.22Å; H67-L70 PolarHBondContact O-N 3.35Å; Q68-L70 VanDerWaalsContact C-N 3.27Å; Q68-L70 PolarHBondContact O-N 2.96Å; L70-D72 PolarHBondContact O-N 2.87Å; L70-T76 HydrophobicContact CD2-CG2 4.44Å; L70-T76 CarbonylContact O-C 3.59Å; L70-T76 VanDerWaalsContact O-C 3.28Å; L70-T76 WeakPolarHBondContact O-CB 3.29Å; L70-T76 PolarHBondContact O-OG1 3.42Å; L70-C77 PolarHBondContact O-N 2.85Å; L70-F82 HydrophobicContact CB-CZ 3.98Å; L70-F82 HydrophobicContact CD1-CE2 3.77Å; L70-F82 HydrophobicContact CD1-CZ 3.9Å; L70-L84 HydrophobicContact CD1-CD2 3.91Å; L70-V111 HydrophobicContact CD1-CG2 3.77Å
71	M	85.6	Confident	85.9	Confident	47 Å²	47	43.2 Å²	43.2	23%	0.232	21%	0.211	C	C	.	.	H	α-helix	trans	-69.9	-21.3	174.6	-73.1	-177.2	57.1	0	0	112.9	H67 Q68 C77 T80 H127	H67-M71 WeakPolarHBondContact O-CG 3.47Å; H67-M71 PolarHBondContact O-N 2.96Å; Q68-M71 PolarHBondContact O-N 3.37Å; Q68-M71 VanDerWaalsContact O-N 3.07Å; M71-C77 WeakPolarHBondContact O-CA 3.44Å; M71-C77 WeakPolarHBondContact O-CB 3.38Å; M71-T80 HydrophobicContact CE-CG2 4.11Å; M71-H127 VanDerWaalsContact CE-CE1 3.49Å; M71-H127 WeakPolarHBondContact CE-CE1 3.42Å; M71-H127 WeakPolarHBondContact CE-ND1 3.35Å
72	D	80	Confident	86.5	Confident	81 Å²	81	41.1 Å²	41.1	43%	0.433	20%	0.201	S	C	.	.	H	α-helix	trans	-92.4	-27.9	176.4	-85.8	-37.8	0	0	0	114.6	Q68 V69 L70 R298	Q68-D72 PolarHBondContact O-N 3.19Å; V69-D72 PolarHBondContact O-N 3.37Å; L70-D72 PolarHBondContact O-N 2.87Å; D72-R298 PolarHBondContact O-NH1 3.43Å; D72-R298 IonicContact OD1-NH2 2.74Å; D72-R298 PolarHBondContact OD1-NH2 3.49Å
73	R	84.1	Confident	86.8	Confident	88 Å²	88	38.6 Å²	38.6	33%	0.332	19%	0.189	S	C	.	.	S	Bend	trans	-66.5	141.9	-179.3	-177.3	-179.3	-178.4	106.9	-0.3	112.7	F53 V69 D75 T76 C77	F53-R73 VanDerWaalsContact CD2-NH1 3.28Å; F53-R73 VanDerWaalsContact CE2-NH1 3.3Å; F53-R73 VanDerWaalsContact CZ-CD 3.46Å; V69-R73 WeakPolarHBondContact O-CB 3.48Å; V69-R73 PolarHBondContact O-N 2.87Å; R73-D75 PolarHBondContact O-N 3.49Å; R73-T76 PolarHBondContact O-N 3.42Å; R73-C77 WeakPolarHBondContact O-CA 3.35Å; R73-C77 WeakPolarHBondContact O-CB 3.35Å; R73-C77 PolarHBondContact O-N 3.12Å
74	E	79.3	Confident	87.2	Confident	59 Å²	59	38.6 Å²	38.6	28%	0.276	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-51.1	-172.9	-172.3	178.9	-176	0	0	114	C77 Q295 V299	E74-C77 PolarHBondContact O-SG 3.43Å; E74-Q295 HydrophobicContact CG-CB 3.9Å; E74-Q295 HydrophobicContact CG-CG 4.35Å; E74-Q295 PolarHBondContact O-NE2 2.91Å; E74-V299 HydrophobicContact CB-CG2 3.97Å; E74-V299 HydrophobicContact CG-CG2 4.05Å
75	D	82.7	Confident	87.6	Confident	83 Å²	83	36.1 Å²	36.1	44%	0.444	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-16.5	-170.1	-58.5	-36.8	0	0	0	113.5	R73 H78	R73-D75 PolarHBondContact O-N 3.49Å; D75-H78 PolarHBondContact O-CE1 2.93Å
76	T	88.6	Confident	88	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.018	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-10	-174.9	50.7	0	0	0	0	113.3	A47 L70 R73 H78 R79	A47-T76 HydrophobicContact CB-CG2 3.8Å; L70-T76 HydrophobicContact CD2-CG2 4.44Å; L70-T76 CarbonylContact O-C 3.59Å; L70-T76 VanDerWaalsContact O-C 3.28Å; L70-T76 WeakPolarHBondContact O-CB 3.29Å; L70-T76 PolarHBondContact O-OG1 3.42Å; R73-T76 PolarHBondContact O-N 3.42Å; T76-H78 PolarHBondContact O-N 3.34Å; T76-R79 WeakPolarHBondContact O-CB 3.16Å; T76-R79 PolarHBondContact O-N 3.49Å
77	C	87.3	Confident	88	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.014	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26	-174.1	62.8	0	0	0	0	114.6	L70 M71 R73 E74 R79 H127 L131	L70-C77 PolarHBondContact O-N 2.85Å; M71-C77 WeakPolarHBondContact O-CA 3.44Å; M71-C77 WeakPolarHBondContact O-CB 3.38Å; R73-C77 WeakPolarHBondContact O-CA 3.35Å; R73-C77 WeakPolarHBondContact O-CB 3.35Å; R73-C77 PolarHBondContact O-N 3.12Å; E74-C77 PolarHBondContact O-SG 3.43Å; C77-R79 VanDerWaalsContact C-N 3.25Å; C77-R79 PolarHBondContact O-N 2.98Å; C77-H127 PolarHBondContact O-CD2 3.48Å; C77-H127 PolarHBondContact O-NE2 3.15Å; C77-L131 HydrophobicContact CB-CD1 4.16Å; C77-L131 HydrophobicContact CB-CD2 4.14Å
78	H	89.2	Confident	87.9	Confident	22 Å²	22	42.5 Å²	42.5	10%	0.102	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	3	178.7	62.3	-81.5	0	0	0	113.6	D75 T76 H124 S275 V277	D75-H78 PolarHBondContact O-CE1 2.93Å; T76-H78 PolarHBondContact O-N 3.34Å; H78-H124 PolarHBondContact O-CE1 2.9Å; H78-H124 VanDerWaalsContact O-CE1 3.24Å; H78-S275 PolarHBondContact CD2-OG 2.81Å; H78-S275 PolarHBondContact O-OG 3.29Å; H78-V277 HydrophobicContact CB-CB 3.74Å; H78-V277 HydrophobicContact CB-CG1 4.07Å; H78-V277 HydrophobicContact CB-CG2 3.64Å
79	R	90.8	Very high	88.2	Confident	17 Å²	17	42.3 Å²	42.3	6%	0.064	23%	0.23	C	C	.	.			trans	-106	118.6	176.1	-58	177.1	175.1	-75.1	-12.8	107.9	P48 T76 C77 F82 E113 E278	P48-R79 PolarHBondContact O-NH2 3.46Å; T76-R79 WeakPolarHBondContact O-CB 3.16Å; T76-R79 PolarHBondContact O-N 3.49Å; C77-R79 VanDerWaalsContact C-N 3.25Å; C77-R79 PolarHBondContact O-N 2.98Å; R79-F82 HydrophobicContact CB-CD1 4.29Å; R79-F82 WeakPolarHBondContact O-CE1 3.04Å; R79-E113 IonicContact CZ-OE1 2.76Å; R79-E113 IonicContact NH1-OE1 3.15Å; R79-E113 PolarHBondContact NH1-OE1 2.88Å; R79-E278 IonicContact CZ-OE1 3Å; R79-E278 IonicContact NH1-OE1 3.68Å; R79-E278 IonicContact NH2-OE1 3.64Å; R79-E278 PolarHBondContact NH2-OE1 3.33Å
80	T	90.8	Very high	88.5	Confident	23 Å²	23	43.3 Å²	43.3	14%	0.141	24%	0.236	C	C	.	.			trans	-127.6	-11.1	-175.2	69.5	0	0	0	0	113.6	M71 H124 H127	M71-T80 HydrophobicContact CE-CG2 4.11Å; T80-H124 WeakPolarHBondContact OG1-CA 3.34Å; T80-H124 VanDerWaalsContact OG1-CB 3.28Å; T80-H124 WeakPolarHBondContact OG1-CB 3.22Å; T80-H124 PolarHBondContact OG1-ND1 2.89Å; T80-H127 HydrophobicContact CG2-CB 3.89Å; T80-H127 WeakPolarHBondContact CG2-CD2 3.33Å
81	C	91.9	Very high	88.6	Confident	6 Å²	6	44 Å²	44	4%	0.041	24%	0.239	C	C	.	.	S	Bend	trans	-124.2	87.1	-177.8	-168.9	0	0	0	0	108.2	E114 Y116 H274	C81-E114 PolarHBondContact O-N 3.32Å; C81-E114 PolarHBondContact SG-O 3.38Å; C81-Y116 HydrophobicContact CB-CD1 3.79Å; C81-Y116 HydrophobicContact CB-CE1 3.26Å; C81-Y116 HydrophobicContact CB-CE2 4.29Å; C81-Y116 HydrophobicContact CB-CG 4.49Å; C81-H274 PolarHBondContact O-NE2 2.83Å
82	F	92.6	Very high	88.7	Confident	17 Å²	17	46.6 Å²	46.6	8%	0.075	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	167.7	-177.5	63	-93.2	0	0	0	110.3	H67 L70 R79 L84 V111 V112	H67-F82 HydrophobicContact CB-CZ 4.47Å; H67-F82 AromaticContact CE1-CD2 3.22Å; H67-F82 WeakPolarHBondContact CE1-CD2 3.31Å; H67-F82 AromaticContact CE1-CE2 3.09Å; H67-F82 WeakPolarHBondContact CE1-CE2 3.24Å; H67-F82 AromaticContact CE1-CG 3.97Å; H67-F82 AromaticContact CE1-CZ 3.7Å; H67-F82 PolarHBondContact CE1-O 3.34Å; H67-F82 VanDerWaalsContact CE1-O 3.23Å; H67-F82 AromaticContact CG-CE2 3.74Å; H67-F82 AromaticContact CG-CZ 3.94Å; H67-F82 AromaticContact ND1-CD2 3.74Å; H67-F82 AromaticContact ND1-CE1 3.97Å; H67-F82 AromaticContact ND1-CE2 3.16Å; H67-F82 WeakPolarHBondContact ND1-CE2 3.27Å; H67-F82 AromaticContact ND1-CZ 3.28Å; H67-F82 VanDerWaalsContact ND1-CZ 3.28Å; H67-F82 WeakPolarHBondContact ND1-CZ 3.48Å; H67-F82 AromaticContact NE2-CD2 3.84Å; H67-F82 AromaticContact NE2-CE2 3.63Å; L70-F82 HydrophobicContact CB-CZ 3.98Å; L70-F82 HydrophobicContact CD1-CE2 3.77Å; L70-F82 HydrophobicContact CD1-CZ 3.9Å; R79-F82 HydrophobicContact CB-CD1 4.29Å; R79-F82 WeakPolarHBondContact O-CE1 3.04Å; F82-L84 HydrophobicContact CE2-CD2 4.24Å; F82-L84 HydrophobicContact CE2-CG 4.29Å; F82-V111 HydrophobicContact CB-CG1 3.67Å; F82-V111 HydrophobicContact CD1-CG1 4.29Å; F82-V111 HydrophobicContact CD2-CB 4.49Å; F82-V111 HydrophobicContact CD2-CG1 3.51Å; F82-V111 HydrophobicContact CE2-CG1 4.13Å; F82-V111 HydrophobicContact CG-CG1 3.58Å; F82-V112 CarbonylContact C-O 3.57Å; F82-V112 WeakPolarHBondContact CA-O 3.38Å; F82-V112 VanDerWaalsContact CB-O 3.25Å; F82-V112 WeakPolarHBondContact CB-O 3.29Å
83	S	92.4	Very high	88.9	Confident	9 Å²	9	46 Å²	46	6%	0.063	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.5	166.4	61.4	0	0	0	0	109.4	V112 E114	S83-V112 PolarHBondContact N-O 2.8Å; S83-V112 PolarHBondContact O-N 2.87Å; S83-E114 VanDerWaalsContact CB-OE1 3.29Å; S83-E114 WeakPolarHBondContact CB-OE1 3.4Å; S83-E114 PolarHBondContact OG-OE1 3.4Å
84	L	92.6	Very high	89	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.4	169.3	-69.1	172.9	0	0	0	109	V63 I66 L70 F82 L91 V111	V63-L84 HydrophobicContact CG1-CB 4.33Å; V63-L84 HydrophobicContact CG1-CD1 3.88Å; I66-L84 HydrophobicContact CB-CD1 3.81Å; I66-L84 HydrophobicContact CG2-CD1 3.59Å; L70-L84 HydrophobicContact CD1-CD2 3.91Å; F82-L84 HydrophobicContact CE2-CD2 4.24Å; F82-L84 HydrophobicContact CE2-CG 4.29Å; L84-L91 HydrophobicContact CB-CD1 4.21Å; L84-L91 WeakPolarHBondContact O-CB 3.46Å; L84-L91 WeakPolarHBondContact O-CG 3.36Å; L84-L91 PolarHBondContact O-N 3.09Å; L84-V111 HydrophobicContact CD2-CG2 3.8Å
85	Q	93.9	Very high	89.3	Confident	37 Å²	37	46.8 Å²	46.8	17%	0.173	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.6	-179.9	-62.8	-174.3	6.8	0	0	112.1	N89 V90 K110 V112	Q85-N89 CarbonylContact C-O 3.32Å; Q85-N89 WeakPolarHBondContact CA-O 3.4Å; Q85-V90 HydrophobicContact CG-CG2 3.97Å; Q85-K110 PolarHBondContact N-O 2.86Å; Q85-K110 PolarHBondContact O-N 3.29Å; Q85-V112 HydrophobicContact CB-CG2 4.33Å; Q85-V112 VanDerWaalsContact CD-CG2 3.46Å; Q85-V112 HydrophobicContact CG-CB 4.38Å; Q85-V112 HydrophobicContact CG-CG2 3.93Å
86	L	92.8	Very high	89.4	Confident	11 Å²	11	46.7 Å²	46.7	6%	0.058	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.5	168.2	-178	67.3	0	0	0	108.1	G88 N89 L91 I100 L103 L109	L86-G88 PolarHBondContact O-N 2.92Å; L86-N89 PolarHBondContact N-O 3.47Å; L86-N89 PolarHBondContact O-N 2.79Å; L86-L91 HydrophobicContact CB-CD2 4.02Å; L86-I100 HydrophobicContact CD2-CG2 4.15Å; L86-L103 HydrophobicContact CD1-CD1 4.39Å; L86-L103 HydrophobicContact CD2-CB 4.07Å; L86-L103 HydrophobicContact CD2-CD1 4.14Å; L86-L109 HydrophobicContact CB-CD2 3.95Å; L86-L109 HydrophobicContact CD1-CD2 4.04Å
87	D	88.3	Confident	89.3	Confident	146 Å²	146	46.6 Å²	46.6	78%	0.781	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	26.2	-178.3	-61.1	-34.7	0	0	0	115.5
88	G	85.4	Confident	89.2	Confident	52 Å²	52	52.5 Å²	52.5	54%	0.536	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	-1.5	-179	0	0	0	0	0	115	L86	L86-G88 PolarHBondContact O-N 2.92Å
89	N	89.9	Confident	89	Confident	119 Å²	119	54.9 Å²	54.9	64%	0.636	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.9	173	-65.3	-34.5	0	0	0	110.6	Q85 L86	Q85-N89 CarbonylContact C-O 3.32Å; Q85-N89 WeakPolarHBondContact CA-O 3.4Å; L86-N89 PolarHBondContact N-O 3.47Å; L86-N89 PolarHBondContact O-N 2.79Å
90	V	91.3	Very high	88.9	Confident	87 Å²	87	55.2 Å²	55.2	53%	0.527	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.4	175	176.7	0	0	0	0	109.6	Q85	Q85-V90 HydrophobicContact CG-CG2 3.97Å
91	L	91.4	Very high	88.5	Confident	16 Å²	16	63.2 Å²	63.2	8%	0.084	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-79.7	138.8	176.7	-58.8	-177.2	0	0	0	110.4	V63 L84 L86 N93 I100 L109	V63-L91 HydrophobicContact CG1-CB 3.88Å; V63-L91 HydrophobicContact CG1-CD1 4.5Å; V63-L91 HydrophobicContact CG2-CB 4.06Å; V63-L91 HydrophobicContact CG2-CD1 4.38Å; L84-L91 HydrophobicContact CB-CD1 4.21Å; L84-L91 WeakPolarHBondContact O-CB 3.46Å; L84-L91 WeakPolarHBondContact O-CG 3.36Å; L84-L91 PolarHBondContact O-N 3.09Å; L86-L91 HydrophobicContact CB-CD2 4.02Å; L91-N93 PolarHBondContact O-N 2.64Å; L91-I100 HydrophobicContact CD1-CD1 4.13Å; L91-I100 HydrophobicContact CD2-CD1 4.2Å; L91-I100 HydrophobicContact CD2-CG2 3.6Å; L91-L109 HydrophobicContact CD1-CD2 3.69Å
92	D	88.3	Confident	88	Confident	101 Å²	101	65.3 Å²	65.3	54%	0.54	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-71.5	127.2	172	-176	-1.2	0	0	0	109.6	V63 F94 A95	V63-D92 VanDerWaalsContact CB-O 3.28Å; V63-D92 WeakPolarHBondContact CB-O 3.45Å; V63-D92 VanDerWaalsContact CG2-O 3.29Å; V63-D92 WeakPolarHBondContact CG2-O 3.38Å; D92-F94 PolarHBondContact O-N 3.16Å; D92-F94 VanDerWaalsContact O-N 3.17Å; D92-F94 PolarHBondContact OD1-N 3.17Å; D92-A95 HydrophobicContact CB-CB 4.05Å; D92-A95 WeakPolarHBondContact O-CB 3.37Å; D92-A95 PolarHBondContact O-N 3.48Å; D92-A95 VanDerWaalsContact O-N 3.14Å
93	N	84.2	Confident	87.8	Confident	67 Å²	67	65.5 Å²	65.5	36%	0.358	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.9	-178.6	-70.8	-27.3	0	0	0	112.9	Q64 L91	Q64-N93 HydrophobicContact CB-CB 4.35Å; Q64-N93 VanDerWaalsContact CB-O 3.25Å; Q64-N93 WeakPolarHBondContact CB-O 3.39Å; Q64-N93 PolarHBondContact N-O 3.1Å; L91-N93 PolarHBondContact O-N 2.64Å
94	F	84.3	Confident	87.6	Confident	145 Å²	145	71.8 Å²	71.8	64%	0.636	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	1.6	-177.1	-56.9	-73.6	0	0	0	113.8	D92	D92-F94 PolarHBondContact O-N 3.16Å; D92-F94 VanDerWaalsContact O-N 3.17Å; D92-F94 PolarHBondContact OD1-N 3.17Å
95	A	86.2	Confident	87.4	Confident	20 Å²	20	77.5 Å²	77.5	17%	0.165	42%	0.419	C	S	.	.	S	Bend	trans	-77.3	138.5	174.9	0	0	0	0	0	110.9	M62 V63 D92 I100	M62-A95 WeakPolarHBondContact CA-O 3.31Å; V63-A95 PolarHBondContact N-O 3.44Å; V63-A95 VanDerWaalsContact N-O 3.1Å; D92-A95 HydrophobicContact CB-CB 4.05Å; D92-A95 WeakPolarHBondContact O-CB 3.37Å; D92-A95 PolarHBondContact O-N 3.48Å; D92-A95 VanDerWaalsContact O-N 3.14Å; A95-I100 HydrophobicContact CB-CG1 4.42Å
96	E	85.8	Confident	87.1	Confident	81 Å²	81	77.4 Å²	77.4	38%	0.379	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-70	141.7	168.9	-64.4	179	151.9	0	0	109.4	E61 K98 S99	E61-E96 CarbonylContact O-C 3.53Å; E61-E96 WeakPolarHBondContact O-CA 3.45Å; E96-K98 VanDerWaalsContact C-N 3.26Å; E96-K98 HydrophobicContact CB-CG 4.28Å; E96-K98 PolarHBondContact O-N 3.27Å; E96-K98 IonicContact OE1-NZ 3.82Å; E96-K98 WeakPolarHBondContact OE2-CE 3.36Å; E96-K98 IonicContact OE2-NZ 2.89Å; E96-K98 PolarHBondContact OE2-NZ 3.4Å; E96-S99 PolarHBondContact N-OG 2.97Å; E96-S99 WeakPolarHBondContact O-CB 3.42Å; E96-S99 PolarHBondContact O-N 2.86Å; E96-S99 PolarHBondContact O-OG 2.91Å
97	L	86.1	Confident	87.1	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.005	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-58.1	-37	-176	-67.1	-179.8	0	0	0	113	F41 V57 E61 V63 I66 S99 I100 L103	F41-L97 HydrophobicContact CE1-CB 4.46Å; F41-L97 HydrophobicContact CZ-CB 4.2Å; F41-L97 HydrophobicContact CZ-CD1 4.44Å; V57-L97 HydrophobicContact CB-CD1 3.56Å; V57-L97 HydrophobicContact CG1-CD1 4.12Å; V57-L97 HydrophobicContact CG2-CD1 3.71Å; E61-L97 HydrophobicContact CB-CD1 4.02Å; E61-L97 HydrophobicContact CB-CG 4.47Å; E61-L97 WeakPolarHBondContact O-CG 3.43Å; E61-L97 PolarHBondContact O-N 3.2Å; V63-L97 HydrophobicContact CG2-CD2 3.96Å; I66-L97 HydrophobicContact CD1-CD1 3.86Å; I66-L97 HydrophobicContact CD1-CD2 3.64Å; I66-L97 HydrophobicContact CD1-CG 4.38Å; I66-L97 HydrophobicContact CG1-CD1 4.39Å; L97-S99 PolarHBondContact O-N 3.21Å; L97-I100 HydrophobicContact CD2-CD1 3.87Å; L97-I100 WeakPolarHBondContact O-CB 3.47Å; L97-I100 PolarHBondContact O-N 3.43Å; L97-L103 HydrophobicContact CB-CD2 3.87Å; L97-L103 HydrophobicContact CD2-CD2 3.9Å; L97-L103 HydrophobicContact CG-CD2 4.38Å; L97-L103 WeakPolarHBondContact O-CD2 3.41Å
98	K	84.4	Confident	87.3	Confident	125 Å²	125	73.9 Å²	73.9	54%	0.543	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-64.3	-22.4	175.1	70.2	-174.9	174.9	-165.7	0	114.3	P59 E96 I100	P59-K98 HydrophobicContact CB-CB 3.95Å; P59-K98 WeakPolarHBondContact O-CB 3.43Å; P59-K98 WeakPolarHBondContact O-CG 3.5Å; P59-K98 PolarHBondContact O-N 3.1Å; E96-K98 VanDerWaalsContact C-N 3.26Å; E96-K98 HydrophobicContact CB-CG 4.28Å; E96-K98 PolarHBondContact O-N 3.27Å; E96-K98 IonicContact OE1-NZ 3.82Å; E96-K98 WeakPolarHBondContact OE2-CE 3.36Å; E96-K98 IonicContact OE2-NZ 2.89Å; E96-K98 PolarHBondContact OE2-NZ 3.4Å; K98-I100 VanDerWaalsContact C-N 3.29Å
99	S	86.3	Confident	87.7	Confident	73 Å²	73	71.4 Å²	71.4	51%	0.51	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-84.2	-7.5	-179.1	72.8	0	0	0	0	112.9	E96 L97 E101	E96-S99 PolarHBondContact N-OG 2.97Å; E96-S99 WeakPolarHBondContact O-CB 3.42Å; E96-S99 PolarHBondContact O-N 2.86Å; E96-S99 PolarHBondContact O-OG 2.91Å; L97-S99 PolarHBondContact O-N 3.21Å; S99-E101 PolarHBondContact O-N 3.28Å
100	I	87.3	Confident	87.9	Confident	23 Å²	23	70.6 Å²	70.6	12%	0.118	38%	0.375	C	S	.	.	S	Bend	trans	-85	112.1	-177.2	-58.3	173.9	0	0	0	109.3	V63 L86 L91 A95 L97 K98 G102 L103	V63-I100 HydrophobicContact CG2-CD1 3.43Å; V63-I100 VanDerWaalsContact CG2-CD1 3.43Å; L86-I100 HydrophobicContact CD2-CG2 4.15Å; L91-I100 HydrophobicContact CD1-CD1 4.13Å; L91-I100 HydrophobicContact CD2-CD1 4.2Å; L91-I100 HydrophobicContact CD2-CG2 3.6Å; A95-I100 HydrophobicContact CB-CG1 4.42Å; L97-I100 HydrophobicContact CD2-CD1 3.87Å; L97-I100 WeakPolarHBondContact O-CB 3.47Å; L97-I100 PolarHBondContact O-N 3.43Å; K98-I100 VanDerWaalsContact C-N 3.29Å; I100-G102 PolarHBondContact O-N 2.91Å; I100-L103 HydrophobicContact CB-CB 4.06Å; I100-L103 HydrophobicContact CB-CD2 4.38Å; I100-L103 HydrophobicContact CD1-CD2 4.23Å; I100-L103 HydrophobicContact CG2-CB 4.03Å; I100-L103 PolarHBondContact O-N 3.48Å
101	E	83.3	Confident	87.9	Confident	191 Å²	191	66.9 Å²	66.9	89%	0.893	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	128.1	176.2	-66.5	-174.4	173	0	0	111.3	S99	S99-E101 PolarHBondContact O-N 3.28Å
102	G	81.8	Confident	88	Confident	50 Å²	50	68.5 Å²	68.5	52%	0.515	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	-5.9	177.9	0	0	0	0	0	115.6	I100 Q104	I100-G102 PolarHBondContact O-N 2.91Å; G102-Q104 PolarHBondContact O-N 3.43Å
103	L	87.3	Confident	88.2	Confident	22 Å²	22	67.1 Å²	67.1	12%	0.115	35%	0.354	C	S	.	.			trans	-78.4	118	176.3	-169.3	70.7	0	0	0	111.2	F41 V43 L86 L97 I100 L109	F41-L103 HydrophobicContact CE2-CD2 4.08Å; F41-L103 HydrophobicContact CE2-CG 3.97Å; F41-L103 HydrophobicContact CZ-CD2 3.77Å; F41-L103 HydrophobicContact CZ-CG 4.13Å; V43-L103 HydrophobicContact CG1-CD1 4.06Å; L86-L103 HydrophobicContact CD1-CD1 4.39Å; L86-L103 HydrophobicContact CD2-CB 4.07Å; L86-L103 HydrophobicContact CD2-CD1 4.14Å; L97-L103 HydrophobicContact CB-CD2 3.87Å; L97-L103 HydrophobicContact CD2-CD2 3.9Å; L97-L103 HydrophobicContact CG-CD2 4.38Å; L97-L103 WeakPolarHBondContact O-CD2 3.41Å; I100-L103 HydrophobicContact CB-CB 4.06Å; I100-L103 HydrophobicContact CB-CD2 4.38Å; I100-L103 HydrophobicContact CD1-CD2 4.23Å; I100-L103 HydrophobicContact CG2-CB 4.03Å; I100-L103 PolarHBondContact O-N 3.48Å; L103-L109 HydrophobicContact CD1-CD2 3.96Å; L103-L109 HydrophobicContact CD1-CG 4.44Å
104	Q	88.9	Confident	88.6	Confident	140 Å²	140	67 Å²	67	65%	0.654	35%	0.35	S	S	*	.			trans	-138.8	171.6	-178.8	-59.2	-177.3	4.1	0	0	112	G102 G106 S107	G102-Q104 PolarHBondContact O-N 3.43Å; Q104-G106 PolarHBondContact O-N 3.03Å; Q104-S107 PolarHBondContact N-OG 3.41Å; Q104-S107 WeakPolarHBondContact O-CB 3.38Å; Q104-S107 PolarHBondContact O-N 3.11Å; Q104-S107 PolarHBondContact O-OG 2.97Å
105	E	88.8	Confident	89.1	Confident	121 Å²	121	63.9 Å²	63.9	57%	0.565	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	126.5	171.6	-175.9	71.1	-152.8	0	0	111.3	F41 T42 S107	F41-E105 WeakPolarHBondContact CA-OE2 3.25Å; F41-E105 WeakPolarHBondContact CB-OE2 3.34Å; T42-E105 WeakPolarHBondContact CB-OE1 3.21Å; T42-E105 VanDerWaalsContact N-CD 3.27Å; T42-E105 PolarHBondContact N-OE1 3.41Å; T42-E105 PolarHBondContact N-OE2 3.05Å; T42-E105 PolarHBondContact OG1-OE1 3.23Å; E105-S107 VanDerWaalsContact C-N 3.34Å
106	G	88.1	Confident	89.4	Confident	35 Å²	35	63.1 Å²	63.1	36%	0.361	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	2.4	-179.3	0	0	0	0	0	115.7	T42 Q104	T42-G106 PolarHBondContact O-N 3.18Å; Q104-G106 PolarHBondContact O-N 3.03Å
107	S	92.3	Very high	89.7	Confident	19 Å²	19	62.5 Å²	62.5	13%	0.133	34%	0.34	C	S	.	.			trans	-58.8	141.1	-180	-65	0	0	0	0	112.6	K44 Q104 E105	K44-S107 PolarHBondContact N-O 3.4Å; Q104-S107 PolarHBondContact N-OG 3.41Å; Q104-S107 WeakPolarHBondContact O-CB 3.38Å; Q104-S107 PolarHBondContact O-N 3.11Å; Q104-S107 PolarHBondContact O-OG 2.97Å; E105-S107 VanDerWaalsContact C-N 3.34Å
108	L	92.5	Very high	89.8	Confident	63 Å²	63	65.6 Å²	65.6	33%	0.33	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	104.1	-177.1	-175.5	68.7	0	0	0	111.6	K44 Q46 P52 K110	K44-L108 HydrophobicContact CB-CD1 3.71Å; K44-L108 CarbonylContact O-C 3.51Å; K44-L108 WeakPolarHBondContact O-CA 3.4Å; Q46-L108 HydrophobicContact CB-CD1 3.88Å; P52-L108 HydrophobicContact CB-CD1 4.28Å; L108-K110 HydrophobicContact CG-CG 4.5Å
109	L	93.4	Very high	89.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119	169.6	-61.1	-177.4	0	0	0	110.3	V43 K44 I45 Q46 I66 L86 L91 L103	V43-L109 HydrophobicContact CB-CD1 4.28Å; V43-L109 HydrophobicContact CG2-CD1 4.08Å; K44-L109 PolarHBondContact O-N 3.23Å; I45-L109 WeakPolarHBondContact CA-O 3.32Å; I45-L109 HydrophobicContact CG1-CB 4.47Å; Q46-L109 PolarHBondContact N-O 3.07Å; I66-L109 HydrophobicContact CD1-CD1 3.88Å; L86-L109 HydrophobicContact CB-CD2 3.95Å; L86-L109 HydrophobicContact CD1-CD2 4.04Å; L91-L109 HydrophobicContact CD1-CD2 3.69Å; L103-L109 HydrophobicContact CD1-CD2 3.96Å; L103-L109 HydrophobicContact CD1-CG 4.44Å
110	K	93.3	Very high	89.8	Confident	102 Å²	102	65.5 Å²	65.5	44%	0.443	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	130.5	175.8	-69.1	-179.2	-179.1	171.2	0	110.2	Q85 L108 V112	Q85-K110 PolarHBondContact N-O 2.86Å; Q85-K110 PolarHBondContact O-N 3.29Å; L108-K110 HydrophobicContact CG-CG 4.5Å; K110-V112 HydrophobicContact CB-CG2 4.37Å
111	V	92.9	Very high	90	Very high	9 Å²	9	64.4 Å²	64.4	6%	0.055	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	113.3	170.4	177.4	0	0	0	0	108	I45 Q46 A47 P48 L70 F82 L84	I45-V111 HydrophobicContact CG2-CG2 3.7Å; Q46-V111 PolarHBondContact O-N 2.84Å; A47-V111 HydrophobicContact CB-CB 4.15Å; A47-V111 HydrophobicContact CB-CG2 4.14Å; P48-V111 WeakPolarHBondContact CD-O 3.47Å; L70-V111 HydrophobicContact CD1-CG2 3.77Å; F82-V111 HydrophobicContact CB-CG1 3.67Å; F82-V111 HydrophobicContact CD1-CG1 4.29Å; F82-V111 HydrophobicContact CD2-CB 4.49Å; F82-V111 HydrophobicContact CD2-CG1 3.51Å; F82-V111 HydrophobicContact CE2-CG1 4.13Å; F82-V111 HydrophobicContact CG-CG1 3.58Å; L84-V111 HydrophobicContact CD2-CG2 3.8Å
112	V	92.9	Very high	90.1	Very high	50 Å²	50	61.1 Å²	61.1	30%	0.303	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.4	-178.6	-178.3	0	0	0	0	109.8	F82 S83 Q85 K110 E114	F82-V112 CarbonylContact C-O 3.57Å; F82-V112 WeakPolarHBondContact CA-O 3.38Å; F82-V112 VanDerWaalsContact CB-O 3.25Å; F82-V112 WeakPolarHBondContact CB-O 3.29Å; S83-V112 PolarHBondContact N-O 2.8Å; S83-V112 PolarHBondContact O-N 2.87Å; Q85-V112 HydrophobicContact CB-CG2 4.33Å; Q85-V112 VanDerWaalsContact CD-CG2 3.46Å; Q85-V112 HydrophobicContact CG-CB 4.38Å; Q85-V112 HydrophobicContact CG-CG2 3.93Å; K110-V112 HydrophobicContact CB-CG2 4.37Å; V112-E114 PolarHBondContact O-N 3.37Å
113	E	92.4	Very high	90.2	Very high	73 Å²	73	62 Å²	62	34%	0.341	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.9	-178.7	-67.7	-179.9	160	0	0	111.4	P48 R79 H274	P48-E113 HydrophobicContact CG-CG 4.2Å; R79-E113 IonicContact CZ-OE1 2.76Å; R79-E113 IonicContact NH1-OE1 3.15Å; R79-E113 PolarHBondContact NH1-OE1 2.88Å; E113-H274 HydrophobicContact CG-CB 4.36Å; E113-H274 WeakPolarHBondContact CG-CD2 3.37Å; E113-H274 WeakPolarHBondContact OE1-CB 3.5Å; E113-H274 IonicContact OE1-CD2 2.7Å; E113-H274 IonicContact OE1-CG 3.42Å; E113-H274 WeakPolarHBondContact OE2-CB 3.27Å; E113-H274 IonicContact OE2-CD2 2.71Å; E113-H274 IonicContact OE2-CG 2.78Å
114	E	93.1	Very high	90.3	Very high	63 Å²	63	61 Å²	61	29%	0.294	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-101.4	147.1	-178.5	-70.5	-61.4	155.7	0	0	111.5	C81 S83 V112 Y116 H274	C81-E114 PolarHBondContact O-N 3.32Å; C81-E114 PolarHBondContact SG-O 3.38Å; S83-E114 VanDerWaalsContact CB-OE1 3.29Å; S83-E114 WeakPolarHBondContact CB-OE1 3.4Å; S83-E114 PolarHBondContact OG-OE1 3.4Å; V112-E114 PolarHBondContact O-N 3.37Å; E114-Y116 PolarHBondContact O-N 3.1Å; E114-H274 PolarHBondContact O-CE1 2.88Å
115	P	93.3	Very high	90.3	Very high	80 Å²	80	54.5 Å²	54.5	52%	0.519	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-65.9	132.7	-178.4	28.5	-33.5	0	0	0	111.6	T117 T249	P115-T117 PolarHBondContact O-N 2.95Å; P115-T249 CarbonylContact C-O 3.5Å; P115-T249 WeakPolarHBondContact CA-O 3.27Å; P115-T249 WeakPolarHBondContact CB-O 3.36Å
116	Y	94	Very high	90.1	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.016	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-67.7	136.1	-179	-74.5	-83.3	0	0	0	112.5	C81 E114 E120 A121 H124 L230 T249 F252 H274	C81-Y116 HydrophobicContact CB-CD1 3.79Å; C81-Y116 HydrophobicContact CB-CE1 3.26Å; C81-Y116 HydrophobicContact CB-CE2 4.29Å; C81-Y116 HydrophobicContact CB-CG 4.49Å; E114-Y116 PolarHBondContact O-N 3.1Å; Y116-E120 HydrophobicContact CD1-CB 3.8Å; Y116-E120 HydrophobicContact CE1-CB 4.46Å; Y116-A121 HydrophobicContact CD1-CB 4.1Å; Y116-A121 HydrophobicContact CG-CB 4.46Å; Y116-H124 HydrophobicContact CE1-CB 3.8Å; Y116-H124 AromaticContact CE1-CG 3.99Å; Y116-H124 PolarHBondContact OH-CE1 3.19Å; Y116-H124 VanDerWaalsContact OH-CE1 3.3Å; Y116-H124 PolarHBondContact OH-ND1 3.38Å; Y116-L230 VanDerWaalsContact O-CD1 3.27Å; Y116-L230 WeakPolarHBondContact O-CD1 3.38Å; Y116-T249 PolarHBondContact N-O 3.48Å; Y116-T249 WeakPolarHBondContact O-CA 3.43Å; Y116-F252 HydrophobicContact CD2-CE2 4.45Å; Y116-F252 HydrophobicContact CE1-CE2 4.34Å; Y116-F252 AromaticContact CE2-CE2 3.82Å; Y116-F252 HydrophobicContact CE2-CE2 3.82Å; Y116-F252 AromaticContact CZ-CE2 3.76Å; Y116-H274 AromaticContact CD2-CE1 3.71Å; Y116-H274 AromaticContact CE2-CE1 3.21Å; Y116-H274 WeakPolarHBondContact CE2-CE1 3.31Å; Y116-H274 AromaticContact CE2-ND1 3.49Å; Y116-H274 WeakPolarHBondContact CE2-ND1 3.45Å; Y116-H274 AromaticContact CE2-NE2 3.66Å; Y116-H274 WeakPolarHBondContact CE2-O 3.19Å; Y116-H274 AromaticContact CZ-CE1 3.97Å; Y116-H274 AromaticContact CZ-NE2 3.97Å; Y116-H274 PolarHBondContact OH-O 3.04Å; Y116-H274 VanDerWaalsContact OH-O 3.07Å
117	T	92.3	Very high	90	Very high	68 Å²	68	50.6 Å²	50.6	42%	0.417	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-90.5	168.6	155.4	62.7	0	0	0	0	110.5	P115 R119 E120 A121	P115-T117 PolarHBondContact O-N 2.95Å; T117-R119 PolarHBondContact O-N 2.84Å; T117-E120 WeakPolarHBondContact CB-OE2 3.43Å; T117-E120 WeakPolarHBondContact CG2-OE2 3.37Å; T117-E120 PolarHBondContact N-OE2 2.81Å; T117-E120 PolarHBondContact O-N 3.47Å; T117-E120 VanDerWaalsContact OG1-CD 3.25Å; T117-E120 WeakPolarHBondContact OG1-CG 3.49Å; T117-E120 PolarHBondContact OG1-N 3.44Å; T117-E120 PolarHBondContact OG1-OE2 3.09Å; T117-A121 WeakPolarHBondContact O-CB 3.46Å; T117-A121 PolarHBondContact O-N 3.02Å
118	V	86.4	Confident	89.9	Confident	66 Å²	66	49.7 Å²	49.7	40%	0.4	24%	0.241	S	C	.	.	H	α-helix	trans	-57.2	-36.7	173.8	178.7	0	0	0	0	110.9	R122 L230	V118-R122 WeakPolarHBondContact O-CG 3.45Å; V118-R122 PolarHBondContact O-N 3.15Å; V118-R122 VanDerWaalsContact O-N 3.16Å; V118-L230 HydrophobicContact CG2-CB 4.19Å; V118-L230 HydrophobicContact CG2-CD2 3.9Å
119	R	84.1	Confident	89.5	Confident	129 Å²	129	47.3 Å²	47.3	49%	0.487	23%	0.228	S	C	.	.	H	α-helix	trans	-65	-54.8	178.2	-179	-174.2	178.2	-161.3	0.7	111	T117 A121 R122 I123 H343	T117-R119 PolarHBondContact O-N 2.84Å; R119-A121 VanDerWaalsContact C-N 3.29Å; R119-A121 PolarHBondContact O-N 3.33Å; R119-R122 WeakPolarHBondContact O-CB 3.27Å; R119-R122 PolarHBondContact O-N 3.43Å; R119-R122 VanDerWaalsContact O-N 3.08Å; R119-I123 HydrophobicContact CG-CD1 3.96Å; R119-I123 WeakPolarHBondContact O-CG1 3.41Å; R119-I123 PolarHBondContact O-N 3.13Å; R119-H343 PolarHBondContact NH2-O 3Å
120	E	88.6	Confident	88.9	Confident	67 Å²	67	50.7 Å²	50.7	31%	0.313	25%	0.246	S	C	.	.	H	α-helix	trans	-62.5	-37.5	-178.8	-70.1	149.6	166.3	0	0	111.7	Y116 T117 R122 I123 H124	Y116-E120 HydrophobicContact CD1-CB 3.8Å; Y116-E120 HydrophobicContact CE1-CB 4.46Å; T117-E120 WeakPolarHBondContact CB-OE2 3.43Å; T117-E120 WeakPolarHBondContact CG2-OE2 3.37Å; T117-E120 PolarHBondContact N-OE2 2.81Å; T117-E120 PolarHBondContact O-N 3.47Å; T117-E120 VanDerWaalsContact OG1-CD 3.25Å; T117-E120 WeakPolarHBondContact OG1-CG 3.49Å; T117-E120 PolarHBondContact OG1-N 3.44Å; T117-E120 PolarHBondContact OG1-OE2 3.09Å; E120-R122 VanDerWaalsContact C-N 3.3Å; E120-R122 PolarHBondContact O-N 3.02Å; E120-I123 PolarHBondContact O-N 3.06Å; E120-H124 VanDerWaalsContact O-CB 3.3Å; E120-H124 WeakPolarHBondContact O-CB 3.31Å; E120-H124 PolarHBondContact O-N 2.87Å
121	A	89.6	Confident	88.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-35	175.8	0	0	0	0	0	112	Y116 T117 R119 V125 L230 M231 A247	Y116-A121 HydrophobicContact CD1-CB 4.1Å; Y116-A121 HydrophobicContact CG-CB 4.46Å; T117-A121 WeakPolarHBondContact O-CB 3.46Å; T117-A121 PolarHBondContact O-N 3.02Å; R119-A121 VanDerWaalsContact C-N 3.29Å; R119-A121 PolarHBondContact O-N 3.33Å; A121-V125 VanDerWaalsContact O-CG2 3.27Å; A121-V125 WeakPolarHBondContact O-CG2 3.4Å; A121-V125 PolarHBondContact O-N 2.72Å; A121-V125 VanDerWaalsContact O-N 3.08Å; A121-L230 HydrophobicContact CB-CD1 4.1Å; A121-M231 HydrophobicContact CB-CE 3.59Å; A121-M231 HydrophobicContact CB-SD 4.38Å; A121-A247 HydrophobicContact CB-CB 4.4Å
122	R	85.7	Confident	88.3	Confident	123 Å²	123	47.3 Å²	47.3	46%	0.464	23%	0.232	S	C	.	.	H	α-helix	trans	-68.5	-47.5	174.1	-74.1	-175.1	-171.3	-162.5	0.2	111.3	V118 R119 E120 H124 V125 R126 M231	V118-R122 WeakPolarHBondContact O-CG 3.45Å; V118-R122 PolarHBondContact O-N 3.15Å; V118-R122 VanDerWaalsContact O-N 3.16Å; R119-R122 WeakPolarHBondContact O-CB 3.27Å; R119-R122 PolarHBondContact O-N 3.43Å; R119-R122 VanDerWaalsContact O-N 3.08Å; E120-R122 VanDerWaalsContact C-N 3.3Å; E120-R122 PolarHBondContact O-N 3.02Å; R122-H124 VanDerWaalsContact C-N 3.27Å; R122-H124 PolarHBondContact O-N 3.24Å; R122-V125 PolarHBondContact O-N 2.74Å; R122-R126 WeakPolarHBondContact O-CB 3.36Å; R122-R126 PolarHBondContact O-N 3.42Å; R122-M231 HydrophobicContact CB-CE 4.25Å; R122-M231 HydrophobicContact CG-CE 3.4Å; R122-M231 VanDerWaalsContact CG-CE 3.4Å
123	I	84.2	Confident	87.7	Confident	68 Å²	68	47.1 Å²	47.1	35%	0.349	23%	0.227	S	C	.	.	H	α-helix	trans	-57.6	-43.7	176.6	-66	169.7	0	0	0	110	R119 E120 R126 H127	R119-I123 HydrophobicContact CG-CD1 3.96Å; R119-I123 WeakPolarHBondContact O-CG1 3.41Å; R119-I123 PolarHBondContact O-N 3.13Å; E120-I123 PolarHBondContact O-N 3.06Å; I123-R126 PolarHBondContact O-N 3.49Å; I123-H127 VanDerWaalsContact O-CB 3.31Å; I123-H127 WeakPolarHBondContact O-CB 3.45Å; I123-H127 PolarHBondContact O-N 3.26Å
124	H	89.8	Confident	87.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-48.1	177.3	-174	75.6	0	0	0	112.8	H78 T80 Y116 E120 R122 R126 H127 I128 F252 L276	H78-H124 PolarHBondContact O-CE1 2.9Å; H78-H124 VanDerWaalsContact O-CE1 3.24Å; T80-H124 WeakPolarHBondContact OG1-CA 3.34Å; T80-H124 VanDerWaalsContact OG1-CB 3.28Å; T80-H124 WeakPolarHBondContact OG1-CB 3.22Å; T80-H124 PolarHBondContact OG1-ND1 2.89Å; Y116-H124 HydrophobicContact CE1-CB 3.8Å; Y116-H124 AromaticContact CE1-CG 3.99Å; Y116-H124 PolarHBondContact OH-CE1 3.19Å; Y116-H124 VanDerWaalsContact OH-CE1 3.3Å; Y116-H124 PolarHBondContact OH-ND1 3.38Å; E120-H124 VanDerWaalsContact O-CB 3.3Å; E120-H124 WeakPolarHBondContact O-CB 3.31Å; E120-H124 PolarHBondContact O-N 2.87Å; R122-H124 VanDerWaalsContact C-N 3.27Å; R122-H124 PolarHBondContact O-N 3.24Å; H124-R126 VanDerWaalsContact C-N 3.34Å; H124-R126 PolarHBondContact O-N 3.41Å; H124-H127 PolarHBondContact O-N 3.37Å; H124-I128 WeakPolarHBondContact NE2-CD1 3.46Å; H124-I128 WeakPolarHBondContact O-CG1 3.4Å; H124-I128 PolarHBondContact O-N 3.37Å; H124-F252 HydrophobicContact CB-CZ 4.49Å; H124-F252 AromaticContact CD2-CE2 3.3Å; H124-F252 WeakPolarHBondContact CD2-CE2 3.48Å; H124-F252 AromaticContact CD2-CZ 3.31Å; H124-F252 WeakPolarHBondContact CD2-CZ 3.37Å; H124-F252 AromaticContact NE2-CE2 3.57Å; H124-L276 PolarHBondContact NE2-N 2.88Å
125	V	88.4	Confident	86.5	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.024	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-40.2	179.2	172.4	0	0	0	0	110.9	A121 R122 R129 M231 L233 F252 L276	A121-V125 VanDerWaalsContact O-CG2 3.27Å; A121-V125 WeakPolarHBondContact O-CG2 3.4Å; A121-V125 PolarHBondContact O-N 2.72Å; A121-V125 VanDerWaalsContact O-N 3.08Å; R122-V125 PolarHBondContact O-N 2.74Å; V125-R129 VanDerWaalsContact O-CG 3.27Å; V125-R129 WeakPolarHBondContact O-CG 3.25Å; V125-R129 PolarHBondContact O-N 2.95Å; V125-R129 VanDerWaalsContact O-N 3.11Å; V125-M231 HydrophobicContact CG2-SD 4.42Å; V125-L233 HydrophobicContact CG1-CD2 4.38Å; V125-L233 HydrophobicContact CG2-CD1 3.79Å; V125-L233 HydrophobicContact CG2-CD2 4.26Å; V125-F252 HydrophobicContact CG2-CE1 4.15Å; V125-F252 HydrophobicContact CG2-CZ 4.49Å; V125-L276 HydrophobicContact CG2-CD2 4.29Å
126	R	84.1	Confident	85.9	Confident	45 Å²	45	42.1 Å²	42.1	17%	0.17	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-54.7	174.3	179.2	177.6	-67	140.4	-9.9	111.5	R122 I123 H124 I128 R129 D130 D332 E342	R122-R126 WeakPolarHBondContact O-CB 3.36Å; R122-R126 PolarHBondContact O-N 3.42Å; I123-R126 PolarHBondContact O-N 3.49Å; H124-R126 VanDerWaalsContact C-N 3.34Å; H124-R126 PolarHBondContact O-N 3.41Å; R126-I128 PolarHBondContact O-N 3.38Å; R126-R129 CarbonylContact O-C 3.58Å; R126-R129 WeakPolarHBondContact O-CA 3.38Å; R126-R129 WeakPolarHBondContact O-CB 3.48Å; R126-R129 PolarHBondContact O-N 3.33Å; R126-D130 PolarHBondContact O-N 2.84Å; R126-D332 IonicContact CZ-OD1 3.54Å; R126-D332 IonicContact NE-OD1 3.07Å; R126-D332 IonicContact NH2-OD1 2.87Å; R126-D332 PolarHBondContact NH2-OD1 2.71Å; R126-D332 VanDerWaalsContact NH2-OD1 3.1Å; R126-E342 IonicContact CZ-OE1 3.52Å; R126-E342 IonicContact CZ-OE2 2.68Å; R126-E342 IonicContact NE-OE2 3.71Å; R126-E342 IonicContact NH1-OE1 2.69Å; R126-E342 IonicContact NH1-OE2 3.53Å; R126-E342 PolarHBondContact NH1-OE2 3.19Å; R126-E342 IonicContact NH2-OE1 3.57Å; R126-E342 PolarHBondContact NH2-OE1 3.14Å; R126-E342 IonicContact NH2-OE2 3.91Å; R126-E342 PolarHBondContact NH2-OE2 3.47Å
127	H	86.9	Confident	85.5	Confident	30 Å²	30	43.4 Å²	43.4	14%	0.139	21%	0.212	C	C	.	.	H	α-helix	trans	-53.7	-42	179.3	-177.3	75.2	0	0	0	112.2	M71 C77 T80 I123 H124 R129 D130 L131	M71-H127 VanDerWaalsContact CE-CE1 3.49Å; M71-H127 WeakPolarHBondContact CE-CE1 3.42Å; M71-H127 WeakPolarHBondContact CE-ND1 3.35Å; C77-H127 PolarHBondContact O-CD2 3.48Å; C77-H127 PolarHBondContact O-NE2 3.15Å; T80-H127 HydrophobicContact CG2-CB 3.89Å; T80-H127 WeakPolarHBondContact CG2-CD2 3.33Å; I123-H127 VanDerWaalsContact O-CB 3.31Å; I123-H127 WeakPolarHBondContact O-CB 3.45Å; I123-H127 PolarHBondContact O-N 3.26Å; H124-H127 PolarHBondContact O-N 3.37Å; H127-R129 PolarHBondContact O-N 3.4Å; H127-D130 PolarHBondContact O-N 3.1Å; H127-L131 WeakPolarHBondContact O-CG 3.27Å; H127-L131 PolarHBondContact O-N 2.85Å
128	I	89.3	Confident	85.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-41.9	175	-70.9	170.2	0	0	0	111.5	H124 R126 D130 L131 L132 L212 L276 V277	H124-I128 WeakPolarHBondContact NE2-CD1 3.46Å; H124-I128 WeakPolarHBondContact O-CG1 3.4Å; H124-I128 PolarHBondContact O-N 3.37Å; R126-I128 PolarHBondContact O-N 3.38Å; I128-D130 VanDerWaalsContact C-N 3.29Å; I128-D130 PolarHBondContact O-N 3.48Å; I128-L131 WeakPolarHBondContact O-CB 3.41Å; I128-L131 PolarHBondContact O-N 2.9Å; I128-L132 HydrophobicContact CG2-CD1 4.4Å; I128-L132 HydrophobicContact CG2-CG 4.42Å; I128-L132 VanDerWaalsContact O-CG 3.26Å; I128-L132 WeakPolarHBondContact O-CG 3.4Å; I128-L132 PolarHBondContact O-N 2.9Å; I128-L212 HydrophobicContact CG2-CD2 4.41Å; I128-L276 HydrophobicContact CD1-CB 3.59Å; I128-L276 HydrophobicContact CD1-CD2 4.11Å; I128-L276 HydrophobicContact CD1-CG 4.18Å; I128-V277 HydrophobicContact CD1-CG2 3.76Å; I128-V277 HydrophobicContact CG1-CG2 3.86Å; I128-V277 HydrophobicContact CG2-CG2 4.01Å
129	R	85.1	Confident	85.1	Confident	12 Å²	12	40.4 Å²	40.4	5%	0.045	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-38	176.6	-68.5	172.6	-177.6	160.5	-5.7	111.1	V125 R126 H127 L132 K133 L212 V328 E331	V125-R129 VanDerWaalsContact O-CG 3.27Å; V125-R129 WeakPolarHBondContact O-CG 3.25Å; V125-R129 PolarHBondContact O-N 2.95Å; V125-R129 VanDerWaalsContact O-N 3.11Å; R126-R129 CarbonylContact O-C 3.58Å; R126-R129 WeakPolarHBondContact O-CA 3.38Å; R126-R129 WeakPolarHBondContact O-CB 3.48Å; R126-R129 PolarHBondContact O-N 3.33Å; H127-R129 PolarHBondContact O-N 3.4Å; R129-L132 WeakPolarHBondContact O-CB 3.44Å; R129-L132 PolarHBondContact O-N 3.41Å; R129-K133 PolarHBondContact O-N 3.18Å; R129-K133 VanDerWaalsContact O-N 3.12Å; R129-L212 HydrophobicContact CG-CD2 3.61Å; R129-L212 HydrophobicContact CG-CG 4.13Å; R129-L212 PolarHBondContact NE-O 2.96Å; R129-L212 VanDerWaalsContact NE-O 3.16Å; R129-L212 PolarHBondContact NH2-O 2.99Å; R129-L212 VanDerWaalsContact NH2-O 3.15Å; R129-V328 HydrophobicContact CB-CG2 3.52Å; R129-V328 HydrophobicContact CG-CG2 3.93Å; R129-E331 IonicContact NH1-OE2 2.67Å; R129-E331 PolarHBondContact NH1-OE2 2.92Å; R129-E331 VanDerWaalsContact NH1-OE2 3.15Å
130	D	81.7	Confident	85.3	Confident	71 Å²	71	34.6 Å²	34.6	38%	0.38	17%	0.173	S	C	.	.	H	α-helix	trans	-66.5	-42.8	175.5	-56.8	-21.1	0	0	0	111	R126 H127 I128 L132 K133 S134	R126-D130 PolarHBondContact O-N 2.84Å; H127-D130 PolarHBondContact O-N 3.1Å; I128-D130 VanDerWaalsContact C-N 3.29Å; I128-D130 PolarHBondContact O-N 3.48Å; D130-L132 VanDerWaalsContact C-N 3.3Å; D130-L132 PolarHBondContact O-N 2.74Å; D130-K133 CarbonylContact O-C 3.55Å; D130-K133 PolarHBondContact O-N 2.89Å; D130-K133 VanDerWaalsContact O-N 3.07Å; D130-S134 WeakPolarHBondContact O-CA 3.35Å; D130-S134 PolarHBondContact O-N 3.45Å
131	L	85.9	Confident	85.4	Confident	8 Å²	8	32.1 Å²	32.1	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-43.6	172.3	-72.8	175.9	0	0	0	111.6	C77 H127 I128 K133 S134 L294	C77-L131 HydrophobicContact CB-CD1 4.16Å; C77-L131 HydrophobicContact CB-CD2 4.14Å; H127-L131 WeakPolarHBondContact O-CG 3.27Å; H127-L131 PolarHBondContact O-N 2.85Å; I128-L131 WeakPolarHBondContact O-CB 3.41Å; I128-L131 PolarHBondContact O-N 2.9Å; L131-K133 PolarHBondContact O-N 3.09Å; L131-S134 WeakPolarHBondContact O-CB 3.35Å; L131-S134 PolarHBondContact O-N 3.45Å; L131-S134 PolarHBondContact O-OG 2.99Å; L131-L294 WeakPolarHBondContact O-CD2 3.47Å
132	L	86.3	Confident	85.4	Confident	32 Å²	32	35.9 Å²	35.9	17%	0.168	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-26.6	177.7	-69.2	-175.9	0	0	0	113.3	I128 R129 D130 C208 L209 L212 F287 F291 L294	I128-L132 HydrophobicContact CG2-CD1 4.4Å; I128-L132 HydrophobicContact CG2-CG 4.42Å; I128-L132 VanDerWaalsContact O-CG 3.26Å; I128-L132 WeakPolarHBondContact O-CG 3.4Å; I128-L132 PolarHBondContact O-N 2.9Å; R129-L132 WeakPolarHBondContact O-CB 3.44Å; R129-L132 PolarHBondContact O-N 3.41Å; D130-L132 VanDerWaalsContact C-N 3.3Å; D130-L132 PolarHBondContact O-N 2.74Å; L132-C208 HydrophobicContact CD2-CB 3.58Å; L132-L209 HydrophobicContact CD1-CD1 3.93Å; L132-L209 HydrophobicContact CD1-CG 4.42Å; L132-L212 HydrophobicContact CD1-CD2 4.5Å; L132-F287 HydrophobicContact CD2-CE2 4.17Å; L132-F291 HydrophobicContact CD2-CD2 3.75Å; L132-F291 HydrophobicContact CD2-CE2 4.03Å; L132-L294 HydrophobicContact CD2-CD2 4.2Å
133	K	81.4	Confident	85.4	Confident	47 Å²	47	30.7 Å²	30.7	20%	0.204	17%	0.165	C	C	.	.	H	α-helix	trans	-102.3	-0.2	177.7	-66.1	-175.9	-166.8	164.8	0	114.4	R129 D130 L131 L135 D136 D326	R129-K133 PolarHBondContact O-N 3.18Å; R129-K133 VanDerWaalsContact O-N 3.12Å; D130-K133 CarbonylContact O-C 3.55Å; D130-K133 PolarHBondContact O-N 2.89Å; D130-K133 VanDerWaalsContact O-N 3.07Å; L131-K133 PolarHBondContact O-N 3.09Å; K133-L135 PolarHBondContact O-N 3.47Å; K133-D136 HydrophobicContact CB-CB 4.38Å; K133-D136 WeakPolarHBondContact O-CA 3.42Å; K133-D136 WeakPolarHBondContact O-CB 3.39Å; K133-D136 PolarHBondContact O-N 2.95Å; K133-D326 IonicContact NZ-OD1 2.61Å; K133-D326 PolarHBondContact NZ-OD1 3.27Å; K133-D326 IonicContact NZ-OD2 3.89Å; K133-D326 PolarHBondContact NZ-OD2 3.44Å
134	S	79.5	Confident	85.5	Confident	35 Å²	35	30 Å²	30	25%	0.245	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-12.6	-170.7	59.8	0	0	0	0	116.8	D130 L131	D130-S134 WeakPolarHBondContact O-CA 3.35Å; D130-S134 PolarHBondContact O-N 3.45Å; L131-S134 WeakPolarHBondContact O-CB 3.35Å; L131-S134 PolarHBondContact O-N 3.45Å; L131-S134 PolarHBondContact O-OG 2.99Å
135	L	79.4	Confident	85.1	Confident	21 Å²	21	35.4 Å²	35.4	11%	0.11	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-2.6	174.9	-56.4	-175.1	0	0	0	113.6	K133 L294 K297 R298 R301	K133-L135 PolarHBondContact O-N 3.47Å; L135-L294 HydrophobicContact CD1-CD1 3.64Å; L135-L294 HydrophobicContact CG-CD1 3.93Å; L135-K297 HydrophobicContact CD1-CB 3.64Å; L135-K297 HydrophobicContact CD1-CD 4.48Å; L135-R298 HydrophobicContact CD2-CB 4.34Å; L135-R301 PolarHBondContact O-NH1 3.19Å
136	D	81.1	Confident	85.1	Confident	54 Å²	54	36.3 Å²	36.3	29%	0.289	20%	0.199	S	C	.	.			trans	-83.1	120.8	-178.8	-168.2	-24	0	0	0	109.8	K133 S138	K133-D136 HydrophobicContact CB-CB 4.38Å; K133-D136 WeakPolarHBondContact O-CA 3.42Å; K133-D136 WeakPolarHBondContact O-CB 3.39Å; K133-D136 PolarHBondContact O-N 2.95Å; D136-S138 PolarHBondContact O-N 3.23Å; D136-S138 WeakPolarHBondContact OD1-CB 3.33Å; D136-S138 PolarHBondContact OD1-N 2.88Å; D136-S138 PolarHBondContact OD1-OG 3.04Å; D136-S138 PolarHBondContact OD2-OG 3.48Å
137	P	84.9	Confident	85.3	Confident	32 Å²	32	36 Å²	36	21%	0.208	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	0.4	178.7	33	-36.6	0	0	0	113.5	D139 A140 Y141 L149 W203	P137-D139 VanDerWaalsContact C-N 3.3Å; P137-D139 PolarHBondContact O-N 3.27Å; P137-A140 WeakPolarHBondContact O-CB 3.18Å; P137-A140 PolarHBondContact O-N 2.79Å; P137-A140 VanDerWaalsContact O-N 3.08Å; P137-Y141 HydrophobicContact CB-CD2 4.11Å; P137-Y141 HydrophobicContact CB-CE2 3.75Å; P137-Y141 HydrophobicContact CG-CD2 4.31Å; P137-Y141 HydrophobicContact CG-CE2 3.79Å; P137-Y141 VanDerWaalsContact O-CD2 3.27Å; P137-Y141 WeakPolarHBondContact O-CD2 3.38Å; P137-Y141 PolarHBondContact O-N 3.33Å; P137-L149 HydrophobicContact CB-CD2 4.21Å; P137-W203 HydrophobicContact CG-CZ2 4.41Å
138	S	84.6	Confident	85.5	Confident	27 Å²	27	34.7 Å²	34.7	19%	0.189	20%	0.195	C	C	.	.	H	α-helix	trans	-55	-41.2	-176.8	-65.7	0	0	0	0	113.3	D136 A140 Y141 N142	D136-S138 PolarHBondContact O-N 3.23Å; D136-S138 WeakPolarHBondContact OD1-CB 3.33Å; D136-S138 PolarHBondContact OD1-N 2.88Å; D136-S138 PolarHBondContact OD1-OG 3.04Å; D136-S138 PolarHBondContact OD2-OG 3.48Å; S138-A140 VanDerWaalsContact C-N 3.34Å; S138-Y141 PolarHBondContact O-N 2.94Å; S138-N142 WeakPolarHBondContact O-CB 3.38Å; S138-N142 PolarHBondContact O-N 3.46Å; S138-N142 PolarHBondContact O-ND2 2.89Å
139	D	85.9	Confident	85.7	Confident	44 Å²	44	35.4 Å²	35.4	24%	0.235	20%	0.199	C	C	.	.	H	α-helix	trans	-69.4	-35	179.4	-65.7	-21.7	0	0	0	111.5	P137 N142 G143 V144 N147	P137-D139 VanDerWaalsContact C-N 3.3Å; P137-D139 PolarHBondContact O-N 3.27Å; D139-N142 PolarHBondContact O-N 3.45Å; D139-G143 PolarHBondContact O-N 3.08Å; D139-V144 HydrophobicContact CB-CB 4.15Å; D139-V144 PolarHBondContact O-N 3.44Å; D139-N147 HydrophobicContact CB-CB 4.38Å
140	A	89.2	Confident	86	Confident	6 Å²	6	35.8 Å²	35.8	5%	0.05	20%	0.203	C	C	.	.	H	α-helix	trans	-66.9	-39.5	173	0	0	0	0	0	112.5	P137 S138 G143 N147 S148 L149	P137-A140 WeakPolarHBondContact O-CB 3.18Å; P137-A140 PolarHBondContact O-N 2.79Å; P137-A140 VanDerWaalsContact O-N 3.08Å; S138-A140 VanDerWaalsContact C-N 3.34Å; A140-G143 PolarHBondContact O-N 3.3Å; A140-N147 HydrophobicContact CB-CB 4.24Å; A140-S148 VanDerWaalsContact CB-C 3.49Å; A140-S148 WeakPolarHBondContact CB-O 3.26Å; A140-L149 HydrophobicContact CB-CD2 3.77Å; A140-L149 HydrophobicContact CB-CG 4.24Å
141	Y	90.8	Very high	86.4	Confident	15 Å²	15	32.8 Å²	32.8	6%	0.059	19%	0.187	C	C	.	.	H	α-helix	trans	-66	-37.8	174.1	-74.5	-58.5	0	0	0	112.4	P137 S138 G143 L149 Q197 A318 P319 Q960 F985	P137-Y141 HydrophobicContact CB-CD2 4.11Å; P137-Y141 HydrophobicContact CB-CE2 3.75Å; P137-Y141 HydrophobicContact CG-CD2 4.31Å; P137-Y141 HydrophobicContact CG-CE2 3.79Å; P137-Y141 VanDerWaalsContact O-CD2 3.27Å; P137-Y141 WeakPolarHBondContact O-CD2 3.38Å; P137-Y141 PolarHBondContact O-N 3.33Å; S138-Y141 PolarHBondContact O-N 2.94Å; Y141-G143 VanDerWaalsContact C-N 3.3Å; Y141-L149 HydrophobicContact CD1-CD1 3.91Å; Y141-L149 HydrophobicContact CD1-CD2 3.99Å; Y141-L149 HydrophobicContact CD1-CG 4.46Å; Y141-L149 HydrophobicContact CD2-CD2 4.38Å; Y141-L149 HydrophobicContact CE1-CD1 3.46Å; Y141-L149 VanDerWaalsContact CE1-CD1 3.46Å; Y141-L149 HydrophobicContact CE1-CD2 3.64Å; Y141-L149 HydrophobicContact CE1-CG 4.17Å; Y141-L149 HydrophobicContact CE2-CD2 4.1Å; Y141-L149 HydrophobicContact CG-CD2 4.31Å; Y141-Q197 VanDerWaalsContact CE1-NE2 3.27Å; Y141-Q197 PolarHBondContact OH-NE2 3.18Å; Y141-Q197 PolarHBondContact OH-OE1 2.58Å; Y141-A318 HydrophobicContact CD1-CB 3.74Å; Y141-A318 HydrophobicContact CG-CB 4.03Å; Y141-P319 HydrophobicContact CD2-CG 4.3Å; Y141-P319 HydrophobicContact CE2-CG 3.8Å; Y141-P319 VanDerWaalsContact CZ-CD 3.47Å; Y141-Q960 PolarHBondContact O-NE2 3.37Å; Y141-F985 WeakPolarHBondContact O-CZ 3.1Å
142	N	88.7	Confident	86.6	Confident	79 Å²	79	32.5 Å²	32.5	42%	0.422	19%	0.185	S	C	.	.	H	α-helix	trans	-85.5	-1.9	-178.9	-68.2	-58.3	0	0	0	113.5	S138 D139 V144 F985	S138-N142 WeakPolarHBondContact O-CB 3.38Å; S138-N142 PolarHBondContact O-N 3.46Å; S138-N142 PolarHBondContact O-ND2 2.89Å; D139-N142 PolarHBondContact O-N 3.45Å; N142-V144 HydrophobicContact CB-CG2 3.83Å; N142-F985 VanDerWaalsContact O-CE1 3.31Å; N142-F985 WeakPolarHBondContact O-CE1 3.34Å
143	G	87.3	Confident	86.5	Confident	14 Å²	14	32 Å²	32	14%	0.144	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	47.1	-179.9	0	0	0	0	0	113.1	D139 A140 Y141 Q312	D139-G143 PolarHBondContact O-N 3.08Å; A140-G143 PolarHBondContact O-N 3.3Å; Y141-G143 VanDerWaalsContact C-N 3.3Å; G143-Q312 VanDerWaalsContact C-CD 3.49Å; G143-Q312 PolarHBondContact O-OE1 3.13Å; G143-Q312 VanDerWaalsContact O-OE1 3.11Å
144	V	84.6	Confident	86.5	Confident	53 Å²	53	31.2 Å²	31.2	32%	0.321	18%	0.183	S	C	.	.			trans	-102.4	135.7	-177.1	-179.3	0	0	0	0	110.1	D139 N142 C146 N147	D139-V144 HydrophobicContact CB-CB 4.15Å; D139-V144 PolarHBondContact O-N 3.44Å; N142-V144 HydrophobicContact CB-CG2 3.83Å; V144-C146 PolarHBondContact O-N 3Å; V144-C146 VanDerWaalsContact O-N 3.14Å; V144-N147 WeakPolarHBondContact O-CB 3.49Å; V144-N147 PolarHBondContact O-N 3.48Å; V144-N147 PolarHBondContact O-ND2 2.88Å
145	D	81.4	Confident	86.6	Confident	114 Å²	114	31.7 Å²	31.7	61%	0.61	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	36.3	173.5	-58.8	-31.7	0	0	0	115.4	N147	D145-N147 PolarHBondContact O-N 2.76Å
146	C	88.4	Confident	86.7	Confident	23 Å²	23	30.8 Å²	30.8	16%	0.155	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	30.6	-177.9	-53.5	0	0	0	0	113.3	V144 A308 T309	V144-C146 PolarHBondContact O-N 3Å; V144-C146 VanDerWaalsContact O-N 3.14Å; C146-A308 HydrophobicContact CB-CB 4.35Å; C146-T309 WeakPolarHBondContact CB-O 3.47Å; C146-T309 PolarHBondContact O-N 3.32Å; C146-T309 PolarHBondContact O-OG1 3.12Å
147	N	88.9	Confident	86.2	Confident	39 Å²	39	34 Å²	34	21%	0.209	19%	0.193	C	C	.	.			trans	-81	141.2	165.9	-75.6	-57.3	0	0	0	110.8	D139 A140 V144 D145 Q312	D139-N147 HydrophobicContact CB-CB 4.38Å; A140-N147 HydrophobicContact CB-CB 4.24Å; V144-N147 WeakPolarHBondContact O-CB 3.49Å; V144-N147 PolarHBondContact O-N 3.48Å; V144-N147 PolarHBondContact O-ND2 2.88Å; D145-N147 PolarHBondContact O-N 2.76Å; N147-Q312 PolarHBondContact O-NE2 3.03Å
148	S	91.8	Very high	85.2	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.021	21%	0.207	C	C	.	.			trans	-138.7	165	-178.9	55.3	0	0	0	0	112.3	A140 T309 R1072	A140-S148 VanDerWaalsContact CB-C 3.49Å; A140-S148 WeakPolarHBondContact CB-O 3.26Å; S148-T309 WeakPolarHBondContact OG-CG2 3.5Å; S148-R1072 WeakPolarHBondContact CB-O 3.36Å; S148-R1072 PolarHBondContact O-NH1 3.48Å; S148-R1072 VanDerWaalsContact OG-C 3.32Å; S148-R1072 WeakPolarHBondContact OG-CA 3.48Å; S148-R1072 WeakPolarHBondContact OG-CB 3.25Å; S148-R1072 VanDerWaalsContact OG-CD 3.3Å; S148-R1072 WeakPolarHBondContact OG-CD 3.32Å; S148-R1072 PolarHBondContact OG-NE 3.13Å; S148-R1072 PolarHBondContact OG-O 3.24Å
149	L	92.1	Very high	84	Confident	15 Å²	15	38.6 Å²	38.6	8%	0.079	23%	0.225	C	C	.	.			trans	-77.5	145.6	-174.5	-64	170.5	0	0	0	111.3	P137 A140 Y141 F151 E1071 I1076	P137-L149 HydrophobicContact CB-CD2 4.21Å; A140-L149 HydrophobicContact CB-CD2 3.77Å; A140-L149 HydrophobicContact CB-CG 4.24Å; Y141-L149 HydrophobicContact CD1-CD1 3.91Å; Y141-L149 HydrophobicContact CD1-CD2 3.99Å; Y141-L149 HydrophobicContact CD1-CG 4.46Å; Y141-L149 HydrophobicContact CD2-CD2 4.38Å; Y141-L149 HydrophobicContact CE1-CD1 3.46Å; Y141-L149 VanDerWaalsContact CE1-CD1 3.46Å; Y141-L149 HydrophobicContact CE1-CD2 3.64Å; Y141-L149 HydrophobicContact CE1-CG 4.17Å; Y141-L149 HydrophobicContact CE2-CD2 4.1Å; Y141-L149 HydrophobicContact CG-CD2 4.31Å; L149-F151 HydrophobicContact CB-CE2 4.47Å; L149-F151 HydrophobicContact CB-CZ 4.22Å; L149-F151 HydrophobicContact CD1-CZ 4.18Å; L149-F151 HydrophobicContact CD2-CE1 4.41Å; L149-F151 HydrophobicContact CD2-CZ 4.14Å; L149-F151 HydrophobicContact CG-CZ 4.42Å; L149-E1071 CarbonylContact O-C 3.39Å; L149-I1076 HydrophobicContact CB-CG2 3.92Å; L149-I1076 HydrophobicContact CD1-CD1 4.48Å
150	S	91.1	Very high	82.8	Confident	19 Å²	19	36.6 Å²	36.6	13%	0.133	22%	0.215	C	C	.	.			trans	-145.7	136.2	165.9	177.9	0	0	0	0	109.5	L1068 E1071	S150-L1068 WeakPolarHBondContact OG-CD2 3.3Å; S150-E1071 VanDerWaalsContact CA-OE2 3.23Å; S150-E1071 WeakPolarHBondContact CA-OE2 3.28Å; S150-E1071 WeakPolarHBondContact CB-OE2 3.35Å; S150-E1071 PolarHBondContact OG-OE2 3.06Å
151	F	90.5	Very high	81	Confident	9 Å²	9	39 Å²	39	4%	0.039	24%	0.24	C	C	.	.			trans	-131.1	-3.4	-173.8	-61.1	-40.5	0	0	0	113.9	L149 S153 I154 F155 Q197 P198 E1071 I1076	L149-F151 HydrophobicContact CB-CE2 4.47Å; L149-F151 HydrophobicContact CB-CZ 4.22Å; L149-F151 HydrophobicContact CD1-CZ 4.18Å; L149-F151 HydrophobicContact CD2-CE1 4.41Å; L149-F151 HydrophobicContact CD2-CZ 4.14Å; L149-F151 HydrophobicContact CG-CZ 4.42Å; F151-S153 VanDerWaalsContact C-N 3.31Å; F151-S153 PolarHBondContact O-N 2.86Å; F151-I154 HydrophobicContact CB-CD1 4.47Å; F151-I154 HydrophobicContact CD1-CD1 3.78Å; F151-I154 WeakPolarHBondContact O-CB 3.3Å; F151-I154 PolarHBondContact O-N 3.27Å; F151-F155 HydrophobicContact CB-CD2 3.85Å; F151-F155 HydrophobicContact CB-CE2 3.5Å; F151-F155 HydrophobicContact CD2-CE2 4.49Å; F151-F155 HydrophobicContact CG-CE2 4.36Å; F151-F155 VanDerWaalsContact O-CD2 3.28Å; F151-F155 WeakPolarHBondContact O-CD2 3.42Å; F151-F155 PolarHBondContact O-N 3.37Å; F151-F155 VanDerWaalsContact O-N 3.12Å; F151-Q197 HydrophobicContact CE2-CB 4.49Å; F151-Q197 HydrophobicContact CE2-CG 4.15Å; F151-Q197 HydrophobicContact CZ-CB 4.37Å; F151-Q197 HydrophobicContact CZ-CG 4.04Å; F151-P198 HydrophobicContact CB-CG 4.1Å; F151-P198 HydrophobicContact CD1-CG 3.81Å; F151-P198 HydrophobicContact CD2-CG 4.45Å; F151-P198 HydrophobicContact CE1-CG 4.33Å; F151-P198 HydrophobicContact CG-CG 3.89Å; F151-E1071 PolarHBondContact N-OE1 3.32Å; F151-E1071 PolarHBondContact N-OE2 3.16Å; F151-I1076 HydrophobicContact CD2-CB 4.47Å; F151-I1076 HydrophobicContact CD2-CD1 3.88Å; F151-I1076 HydrophobicContact CD2-CG2 3.95Å; F151-I1076 HydrophobicContact CE2-CD1 3.42Å; F151-I1076 VanDerWaalsContact CE2-CD1 3.42Å; F151-I1076 HydrophobicContact CE2-CG2 4.21Å
152	L	90.4	Very high	78.8	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-52.6	-46.9	-178.3	178.7	64.3	0	0	0	113.2	I154 F155 T156 L160 Q1064 V1067 L1068 E1071 Y1085 L1088 L1104	L152-I154 PolarHBondContact O-N 3.04Å; L152-F155 PolarHBondContact O-N 3.41Å; L152-T156 HydrophobicContact CD1-CG2 3.87Å; L152-T156 HydrophobicContact CG-CG2 4.49Å; L152-T156 WeakPolarHBondContact O-CB 3.32Å; L152-T156 WeakPolarHBondContact O-CG2 3.5Å; L152-T156 PolarHBondContact O-N 2.95Å; L152-T156 PolarHBondContact O-OG1 3.43Å; L152-L160 HydrophobicContact CD1-CD1 4.08Å; L152-L160 HydrophobicContact CD2-CD1 3.96Å; L152-L160 HydrophobicContact CG-CD1 3.99Å; L152-Q1064 HydrophobicContact CD2-CG 3.84Å; L152-V1067 HydrophobicContact CB-CG1 4.27Å; L152-V1067 HydrophobicContact CD1-CG1 3.95Å; L152-V1067 HydrophobicContact CD2-CB 3.91Å; L152-V1067 HydrophobicContact CD2-CG1 3.87Å; L152-V1067 HydrophobicContact CG-CG1 4.24Å; L152-L1068 HydrophobicContact CB-CD2 3.74Å; L152-L1068 HydrophobicContact CB-CG 4.45Å; L152-L1068 HydrophobicContact CD2-CD1 4.48Å; L152-L1068 HydrophobicContact CD2-CD2 3.9Å; L152-L1068 HydrophobicContact CD2-CG 3.72Å; L152-L1068 HydrophobicContact CG-CD2 4.37Å; L152-E1071 PolarHBondContact N-OE2 3.46Å; L152-E1071 VanDerWaalsContact N-OE2 3.16Å; L152-Y1085 HydrophobicContact CD1-CD1 4.43Å; L152-Y1085 HydrophobicContact CD1-CE1 3.73Å; L152-L1088 HydrophobicContact CD1-CD2 3.62Å; L152-L1088 HydrophobicContact CD2-CD2 4.09Å; L152-L1088 HydrophobicContact CG-CD2 4.47Å; L152-L1104 HydrophobicContact CD1-CD2 3.7Å
153	S	84.1	Confident	76.4	Confident	22 Å²	22	47 Å²	47	15%	0.154	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-28.1	-179.5	59.1	0	0	0	0	112.7	F151 D157 G158 E305	F151-S153 VanDerWaalsContact C-N 3.31Å; F151-S153 PolarHBondContact O-N 2.86Å; S153-D157 PolarHBondContact O-N 2.69Å; S153-G158 PolarHBondContact O-N 3.44Å; S153-E305 VanDerWaalsContact CB-OE1 3.23Å; S153-E305 WeakPolarHBondContact CB-OE1 3.26Å; S153-E305 PolarHBondContact OG-OE1 3.02Å; S153-E305 PolarHBondContact OG-OE2 2.91Å
154	I	81.1	Confident	74.2	Confident	31 Å²	31	50.6 Å²	50.6	16%	0.159	33%	0.328	C	S	.	.	H	α-helix	trans	-79.6	-44.3	-180	-53.6	166.4	0	0	0	110.5	F151 L152 T156 D157 P198 W203	F151-I154 HydrophobicContact CB-CD1 4.47Å; F151-I154 HydrophobicContact CD1-CD1 3.78Å; F151-I154 WeakPolarHBondContact O-CB 3.3Å; F151-I154 PolarHBondContact O-N 3.27Å; L152-I154 PolarHBondContact O-N 3.04Å; I154-T156 PolarHBondContact O-N 2.92Å; I154-D157 PolarHBondContact O-N 2.92Å; I154-P198 HydrophobicContact CB-CB 4.41Å; I154-P198 HydrophobicContact CB-CG 4.1Å; I154-P198 HydrophobicContact CD1-CB 4.38Å; I154-P198 HydrophobicContact CD1-CG 3.74Å; I154-P198 HydrophobicContact CG2-CB 3.54Å; I154-P198 HydrophobicContact CG2-CG 3.78Å; I154-W203 HydrophobicContact CD1-CE3 4.39Å; I154-W203 HydrophobicContact CD1-CH2 3.6Å; I154-W203 HydrophobicContact CD1-CZ3 3.32Å; I154-W203 HydrophobicContact CG1-CH2 4.31Å; I154-W203 HydrophobicContact CG1-CZ3 3.81Å
155	F	82.3	Confident	71.8	Confident	45 Å²	45	56.9 Å²	56.9	20%	0.197	35%	0.351	C	S	.	.	H	α-helix	trans	-70.9	-21.1	178.9	-69.3	-62	0	0	0	113.3	F151 L152 P198 K1103 R1107	F151-F155 HydrophobicContact CB-CD2 3.85Å; F151-F155 HydrophobicContact CB-CE2 3.5Å; F151-F155 HydrophobicContact CD2-CE2 4.49Å; F151-F155 HydrophobicContact CG-CE2 4.36Å; F151-F155 VanDerWaalsContact O-CD2 3.28Å; F151-F155 WeakPolarHBondContact O-CD2 3.42Å; F151-F155 PolarHBondContact O-N 3.37Å; F151-F155 VanDerWaalsContact O-N 3.12Å; L152-F155 PolarHBondContact O-N 3.41Å; F155-P198 HydrophobicContact CE2-CG 4.28Å; F155-P198 HydrophobicContact CZ-CG 4Å; F155-K1103 WeakPolarHBondContact O-CD 3.49Å; F155-R1107 HydrophobicContact CD2-CG 4.4Å; F155-R1107 HydrophobicContact CE2-CG 4.38Å
156	T	81.6	Confident	69.8	Low	1 Å²	1	63 Å²	63	1%	0.006	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	1.3	179.7	58.7	0	0	0	0	114	L152 I154 G158 D159 L160 T1100 L1104	L152-T156 HydrophobicContact CD1-CG2 3.87Å; L152-T156 HydrophobicContact CG-CG2 4.49Å; L152-T156 WeakPolarHBondContact O-CB 3.32Å; L152-T156 WeakPolarHBondContact O-CG2 3.5Å; L152-T156 PolarHBondContact O-N 2.95Å; L152-T156 PolarHBondContact O-OG1 3.43Å; I154-T156 PolarHBondContact O-N 2.92Å; T156-G158 PolarHBondContact O-N 3.14Å; T156-D159 VanDerWaalsContact O-CB 3.24Å; T156-D159 WeakPolarHBondContact O-CB 3.4Å; T156-D159 PolarHBondContact O-N 2.82Å; T156-L160 HydrophobicContact CG2-CD1 3.59Å; T156-L160 HydrophobicContact CG2-CD2 4.16Å; T156-L160 HydrophobicContact CG2-CG 3.85Å; T156-T1100 HydrophobicContact CG2-CG2 3.63Å; T156-L1104 HydrophobicContact CG2-CD1 4.48Å; T156-L1104 HydrophobicContact CG2-CD2 3.8Å; T156-L1104 HydrophobicContact CG2-CG 4.33Å
157	D	70.7	Confident	67.2	Low	122 Å²	122	71.9 Å²	71.9	65%	0.652	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	23.3	-175.6	-59.2	-57.9	0	0	0	113.4	S153 I154 D159 K1103	S153-D157 PolarHBondContact O-N 2.69Å; I154-D157 PolarHBondContact O-N 2.92Å; D157-D159 VanDerWaalsContact C-N 3.27Å; D157-D159 PolarHBondContact O-N 3Å; D157-K1103 IonicContact OD2-NZ 2.97Å; D157-K1103 PolarHBondContact OD2-NZ 3.11Å
158	G	63.4	Low	64.7	Low	50 Å²	50	79.6 Å²	79.6	52%	0.515	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	11.5	-173.3	0	0	0	0	0	115.3	S153 T156 L160	S153-G158 PolarHBondContact O-N 3.44Å; T156-G158 PolarHBondContact O-N 3.14Å; G158-L160 VanDerWaalsContact C-N 3.29Å; G158-L160 PolarHBondContact O-N 3.32Å
159	D	58.5	Low	62.3	Low	105 Å²	105	89.1 Å²	89.1	56%	0.561	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	18.1	-168.3	-151.2	16.8	0	0	0	114.7	T156 D157 Q1097	T156-D159 VanDerWaalsContact O-CB 3.24Å; T156-D159 WeakPolarHBondContact O-CB 3.4Å; T156-D159 PolarHBondContact O-N 2.82Å; D157-D159 VanDerWaalsContact C-N 3.27Å; D157-D159 PolarHBondContact O-N 3Å; D159-Q1097 PolarHBondContact O-NE2 3.43Å
160	L	62.4	Low	59.5	Low	3 Å²	3	91.5 Å²	91.5	2%	0.016	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-6.3	-178.3	-69.3	170.2	0	0	0	114.3	L152 T156 G158 L1060 Q1064 L1088 C1092 T1100	L152-L160 HydrophobicContact CD1-CD1 4.08Å; L152-L160 HydrophobicContact CD2-CD1 3.96Å; L152-L160 HydrophobicContact CG-CD1 3.99Å; T156-L160 HydrophobicContact CG2-CD1 3.59Å; T156-L160 HydrophobicContact CG2-CD2 4.16Å; T156-L160 HydrophobicContact CG2-CG 3.85Å; G158-L160 VanDerWaalsContact C-N 3.29Å; G158-L160 PolarHBondContact O-N 3.32Å; L160-L1060 HydrophobicContact CD2-CD1 4.34Å; L160-L1060 WeakPolarHBondContact O-CD2 3.47Å; L160-Q1064 HydrophobicContact CB-CG 4.43Å; L160-Q1064 HydrophobicContact CD1-CG 3.87Å; L160-L1088 HydrophobicContact CD1-CD2 3.99Å; L160-L1088 HydrophobicContact CD2-CD1 4.45Å; L160-L1088 HydrophobicContact CD2-CD2 4.45Å; L160-C1092 WeakPolarHBondContact CD2-SG 3.41Å; L160-T1100 HydrophobicContact CD2-CG2 3.91Å
161	G	50.8	Low	56.9	Low	56 Å²	56	97.6 Å²	97.6	58%	0.577	54%	0.539	S	S	*	.	S	Bend	trans	99.2	93.2	164.6	0	0	0	0	0	115.7
162	D	44	Very low	54.5	Low	165 Å²	165	105.1 Å²	105.1	88%	0.882	57%	0.574	S	S	*	*			trans	-145.9	5.7	150.6	-147.7	8.8	0	0	0	113.2
163	S	39.7	Very low	52.4	Low	98 Å²	98	112.1 Å²	112.1	69%	0.685	61%	0.611	S	S	*	*	S	Bend	trans	-100.1	111	171.6	74.3	0	0	0	0	109.3	K165	S163-K165 PolarHBondContact O-N 3.21Å
164	G	39.3	Very low	50.6	Low	89 Å²	89	119.1 Å²	119.1	92%	0.918	64%	0.641	S	S	*	*	S	Bend	trans	-60	22.6	176.8	0	0	0	0	0	115.9
165	K	35.7	Very low	49.4	Very low	185 Å²	185	127.3 Å²	127.3	80%	0.804	68%	0.679	S	S	*	*			trans	-110.6	74.9	171.3	-66.3	-173.9	-177	177	0	109	S163 K167	S163-K165 PolarHBondContact O-N 3.21Å; K165-K167 PolarHBondContact O-N 3.03Å
166	R	37.9	Very low	48.6	Very low	243 Å²	243	127.9 Å²	127.9	92%	0.917	68%	0.683	S	S	*	*			trans	-47.9	108.9	157.3	-76.4	178.3	174	168.7	-1.8	107.4	K168	R166-K168 PolarHBondContact O-N 3.19Å; R166-K168 VanDerWaalsContact O-N 3.07Å
167	K	35.6	Very low	48.3	Very low	208 Å²	208	133.9 Å²	133.9	90%	0.904	72%	0.715	S	S	*	*			trans	-53.2	120.6	161.2	-94.1	-179.3	177	174.1	0	105.6	K165 K169	K165-K167 PolarHBondContact O-N 3.03Å; K167-K169 PolarHBondContact O-N 3.31Å
168	K	36.5	Very low	48.9	Very low	202 Å²	202	128.4 Å²	128.4	88%	0.878	69%	0.686	S	S	*	*			trans	-47.9	129.4	-177.3	-91.9	177.5	170.2	177.4	0	109.7	R166 G170	R166-K168 PolarHBondContact O-N 3.19Å; R166-K168 VanDerWaalsContact O-N 3.07Å; K168-G170 PolarHBondContact O-N 3.34Å
169	K	41	Very low	50.1	Low	203 Å²	203	130.7 Å²	130.7	88%	0.883	69%	0.691	S	S	*	*			trans	-34.2	109.8	162.2	-84.7	177.7	167.3	179.3	0	110.8	K167	K167-K169 PolarHBondContact O-N 3.31Å
170	G	33.4	Very low	51.6	Low	64 Å²	64	126.1 Å²	126.1	66%	0.66	67%	0.667	S	S	*	*			trans	-83.6	128.6	149	0	0	0	0	0	107.7	K168 E172	K168-G170 PolarHBondContact O-N 3.34Å; G170-E172 PolarHBondContact O-N 3.45Å
171	T	35.3	Very low	52.9	Low	147 Å²	147	128.8 Å²	128.8	90%	0.902	68%	0.684	S	S	*	*	S	Bend	trans	-84.1	24.8	-176.3	-26.4	0	0	0	0	112.5
172	E	40.5	Very low	54.9	Low	167 Å²	167	133.1 Å²	133.1	78%	0.78	69%	0.69	S	S	*	*	S	Bend	trans	-118.1	132.2	172.7	-70.4	-179.7	166.3	0	0	105.9	G170 E174	G170-E172 PolarHBondContact O-N 3.45Å; E172-E174 PolarHBondContact O-N 2.91Å
173	L	47.3	Very low	57.1	Low	149 Å²	149	127 Å²	127	78%	0.78	66%	0.655	S	S	*	*			trans	-57.4	96.4	160.2	-84.5	96.8	0	0	0	105.4	Q175	L173-Q175 PolarHBondContact O-N 3.06Å
174	E	45.3	Very low	59.7	Low	169 Å²	169	122.4 Å²	122.4	79%	0.79	62%	0.623	S	S	*	*			trans	-46.8	136.4	162.1	-77	-177.9	157.8	0	0	106.2	E172 I176	E172-E174 PolarHBondContact O-N 2.91Å; E174-I176 VanDerWaalsContact C-N 3.27Å; E174-I176 WeakPolarHBondContact O-CG1 3.4Å; E174-I176 PolarHBondContact O-N 3.4Å
175	Q	55.8	Low	62.4	Low	203 Å²	203	119.7 Å²	119.7	95%	0.949	59%	0.587	S	S	*	*			trans	-56.3	94.6	177.9	-79.8	175	-22	0	0	108.7	L173 D177	L173-Q175 PolarHBondContact O-N 3.06Å; Q175-D177 PolarHBondContact O-N 3.22Å
176	I	65.3	Low	65.2	Low	56 Å²	56	112.3 Å²	112.3	29%	0.287	56%	0.558	S	S	.	*			trans	-70.6	113.6	177.2	-56.2	-178.9	0	0	0	105.1	E174 C178 L1098	E174-I176 VanDerWaalsContact C-N 3.27Å; E174-I176 WeakPolarHBondContact O-CG1 3.4Å; E174-I176 PolarHBondContact O-N 3.4Å; I176-C178 VanDerWaalsContact CG2-SG 3.58Å; I176-C178 PolarHBondContact O-N 3.19Å; I176-C178 PolarHBondContact O-SG 3.45Å; I176-L1098 HydrophobicContact CD1-CB 4.11Å; I176-L1098 HydrophobicContact CD1-CD1 4.34Å
177	D	76.8	Confident	67.6	Low	127 Å²	127	103.3 Å²	103.3	68%	0.679	54%	0.542	S	S	*	.			trans	-66.5	100.6	170.6	-175.8	10.5	0	0	0	108.4	Q175 T179	Q175-D177 PolarHBondContact O-N 3.22Å; D177-T179 VanDerWaalsContact C-N 3.34Å; D177-T179 WeakPolarHBondContact OD1-CB 3.28Å; D177-T179 PolarHBondContact OD1-N 2.99Å; D177-T179 VanDerWaalsContact OD1-N 3.07Å; D177-T179 PolarHBondContact OD1-OG1 3.39Å
178	C	82.6	Confident	70.2	Confident	7 Å²	7	94.3 Å²	94.3	5%	0.047	51%	0.505	C	S	.	.			trans	-95	4.8	-179.4	-60.3	0	0	0	0	111.4	I176 P180 L1102 Y1106 L1134 V1137 E1139	I176-C178 VanDerWaalsContact CG2-SG 3.58Å; I176-C178 PolarHBondContact O-N 3.19Å; I176-C178 PolarHBondContact O-SG 3.45Å; C178-P180 VanDerWaalsContact O-CD 3.25Å; C178-P180 WeakPolarHBondContact O-CD 3.46Å; C178-L1102 HydrophobicContact CB-CD1 3.84Å; C178-Y1106 PolarHBondContact O-OH 3.04Å; C178-L1134 HydrophobicContact CB-CD2 4.05Å; C178-V1137 HydrophobicContact CB-CG2 4.38Å; C178-E1139 HydrophobicContact CB-CG 4.18Å
179	T	87.7	Confident	72.6	Confident	98 Å²	98	94 Å²	94	60%	0.601	50%	0.504	S	S	*	.			trans	-68.9	115.6	-172.2	-45.9	0	0	0	0	110.5	D177	D177-T179 VanDerWaalsContact C-N 3.34Å; D177-T179 WeakPolarHBondContact OD1-CB 3.28Å; D177-T179 PolarHBondContact OD1-N 2.99Å; D177-T179 VanDerWaalsContact OD1-N 3.07Å; D177-T179 PolarHBondContact OD1-OG1 3.39Å
180	P	90.4	Very high	74.7	Confident	9 Å²	9	90.3 Å²	90.3	6%	0.058	49%	0.49	C	S	.	.			trans	-69.9	144.7	175.3	28.8	-34.5	0	0	0	110.7	C178 I184 L185 Y1106 L1142 F1146	C178-P180 VanDerWaalsContact O-CD 3.25Å; C178-P180 WeakPolarHBondContact O-CD 3.46Å; P180-I184 HydrophobicContact CB-CD1 3.56Å; P180-I184 HydrophobicContact CB-CG1 3.78Å; P180-L185 HydrophobicContact CB-CD2 4.33Å; P180-L185 HydrophobicContact CG-CD2 3.51Å; P180-L185 HydrophobicContact CG-CG 4.2Å; P180-Y1106 HydrophobicContact CB-CD1 4.47Å; P180-Y1106 HydrophobicContact CB-CE1 3.93Å; P180-Y1106 HydrophobicContact CB-CE2 4.1Å; P180-L1142 HydrophobicContact CG-CD1 4.44Å; P180-L1142 HydrophobicContact CG-CD2 4.12Å; P180-F1146 HydrophobicContact CB-CZ 4.36Å; P180-F1146 HydrophobicContact CG-CE2 4.29Å; P180-F1146 HydrophobicContact CG-CZ 4.42Å
181	P	90.6	Very high	77.4	Confident	60 Å²	60	89.2 Å²	89.2	39%	0.39	47%	0.465	S	S	.	.			trans	-54.2	145.5	166.1	-26.3	32.4	0	0	0	112.8	H183 I184	P181-H183 VanDerWaalsContact C-N 3.3Å; P181-H183 WeakPolarHBondContact CB-CE1 3.29Å; P181-H183 PolarHBondContact O-N 2.96Å; P181-I184 HydrophobicContact CB-CG1 4.12Å; P181-I184 HydrophobicContact CG-CG1 4.34Å; P181-I184 WeakPolarHBondContact O-CG1 3.45Å; P181-I184 PolarHBondContact O-N 3.11Å
182	E	91.4	Very high	80.1	Confident	147 Å²	147	83.1 Å²	83.1	69%	0.687	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-60.5	-36.9	-174.9	-173.7	171.6	-170.6	0	0	113.5	I184 L185 S188	E182-I184 PolarHBondContact O-N 3.08Å; E182-L185 PolarHBondContact O-N 3.21Å; E182-L185 VanDerWaalsContact O-N 3.17Å; E182-S188 WeakPolarHBondContact O-CB 3.05Å; E182-S188 PolarHBondContact O-OG 2.96Å
183	H	91.8	Very high	82.7	Confident	35 Å²	35	75.3 Å²	75.3	16%	0.162	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-70	-11.9	178.7	64.1	-91.5	0	0	0	114	P181 E190 P192 Y1110	P181-H183 VanDerWaalsContact C-N 3.3Å; P181-H183 WeakPolarHBondContact CB-CE1 3.29Å; P181-H183 PolarHBondContact O-N 2.96Å; H183-E190 HydrophobicContact CB-CB 4.33Å; H183-P192 HydrophobicContact CB-CG 3.77Å; H183-Y1110 AromaticContact CD2-CD2 3.66Å; H183-Y1110 AromaticContact NE2-CD2 3.73Å
184	I	94.1	Very high	84.8	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.01	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-103.6	1.8	174.2	72.1	150.6	0	0	0	113	P180 P181 E182 Y1106 R1109 Y1110	P180-I184 HydrophobicContact CB-CD1 3.56Å; P180-I184 HydrophobicContact CB-CG1 3.78Å; P181-I184 HydrophobicContact CB-CG1 4.12Å; P181-I184 HydrophobicContact CG-CG1 4.34Å; P181-I184 WeakPolarHBondContact O-CG1 3.45Å; P181-I184 PolarHBondContact O-N 3.11Å; E182-I184 PolarHBondContact O-N 3.08Å; I184-Y1106 HydrophobicContact CD1-CD1 3.32Å; I184-Y1106 HydrophobicContact CD1-CD2 4.1Å; I184-Y1106 HydrophobicContact CD1-CE1 4Å; I184-Y1106 HydrophobicContact CD1-CG 3.38Å; I184-R1109 VanDerWaalsContact C-NH1 3.29Å; I184-R1109 WeakPolarHBondContact O-CD 3.16Å; I184-R1109 VanDerWaalsContact O-CZ 3.3Å; I184-R1109 PolarHBondContact O-NE 2.91Å; I184-R1109 PolarHBondContact O-NH1 3.34Å; I184-Y1110 HydrophobicContact CG2-CD2 4.46Å
185	L	94.8	Very high	87	Confident	32 Å²	32	63.3 Å²	63.3	17%	0.168	34%	0.337	C	S	.	.	S	Bend	trans	-71.9	147.1	174.3	-77	171.4	0	0	0	110.8	P180 E182 G187 S188 R1109 L1142 F1146	P180-L185 HydrophobicContact CB-CD2 4.33Å; P180-L185 HydrophobicContact CG-CD2 3.51Å; P180-L185 HydrophobicContact CG-CG 4.2Å; E182-L185 PolarHBondContact O-N 3.21Å; E182-L185 VanDerWaalsContact O-N 3.17Å; L185-G187 PolarHBondContact O-N 3.01Å; L185-S188 VanDerWaalsContact O-CB 3.27Å; L185-S188 WeakPolarHBondContact O-CB 3.45Å; L185-S188 PolarHBondContact O-N 2.95Å; L185-S188 VanDerWaalsContact O-N 3.16Å; L185-R1109 PolarHBondContact O-NH1 3.43Å; L185-L1142 HydrophobicContact CD2-CD2 4.13Å; L185-F1146 HydrophobicContact CD2-CE2 4.26Å; L185-F1146 HydrophobicContact CD2-CZ 4.25Å
186	P	94.9	Very high	88.7	Confident	30 Å²	30	53.7 Å²	53.7	20%	0.195	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	135.5	173.1	-25.2	34.7	0	0	0	112.4	S188 E1118 F1146 N1149	P186-S188 VanDerWaalsContact C-N 3.3Å; P186-S188 PolarHBondContact O-N 3.34Å; P186-E1118 WeakPolarHBondContact CA-OE1 3.16Å; P186-F1146 HydrophobicContact CG-CD1 3.57Å; P186-F1146 HydrophobicContact CG-CE1 3.81Å; P186-F1146 HydrophobicContact CG-CG 4.02Å; P186-F1146 HydrophobicContact CG-CZ 4.42Å; P186-N1149 HydrophobicContact CB-CB 3.81Å; P186-N1149 HydrophobicContact CG-CB 4.19Å
187	G	89.2	Confident	89.7	Confident	55 Å²	55	51.7 Å²	51.7	57%	0.567	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-1.7	-177.1	0	0	0	0	0	115.4	L185 E1118	L185-G187 PolarHBondContact O-N 3.01Å; G187-E1118 PolarHBondContact N-OE1 3.42Å; G187-E1118 PolarHBondContact N-OE2 3.23Å
188	S	90.4	Very high	90	Very high	19 Å²	19	47.1 Å²	47.1	13%	0.133	26%	0.258	C	S	.	.			trans	-63.5	140	173.2	-175.4	0	0	0	0	110.8	E182 L185 P186 E190 R191	E182-S188 WeakPolarHBondContact O-CB 3.05Å; E182-S188 PolarHBondContact O-OG 2.96Å; L185-S188 VanDerWaalsContact O-CB 3.27Å; L185-S188 WeakPolarHBondContact O-CB 3.45Å; L185-S188 PolarHBondContact O-N 2.95Å; L185-S188 VanDerWaalsContact O-N 3.16Å; P186-S188 VanDerWaalsContact C-N 3.3Å; P186-S188 PolarHBondContact O-N 3.34Å; S188-E190 PolarHBondContact OG-N 3.01Å; S188-R191 VanDerWaalsContact O-CZ 3.24Å; S188-R191 PolarHBondContact O-NH1 3.48Å; S188-R191 PolarHBondContact O-NH2 3.31Å
189	K	85.9	Confident	89.3	Confident	195 Å²	195	53.2 Å²	53.2	85%	0.848	29%	0.286	S	S	*	.			trans	-100.5	-13.8	176.4	-64.8	-173.7	179.8	-177.3	0	113.4
190	E	85.4	Confident	87.8	Confident	126 Å²	126	52.2 Å²	52.2	59%	0.589	28%	0.277	S	S	*	.			trans	-76.3	134.9	-179	-63.6	-170.1	169.9	0	0	110.8	H183 S188 P192	H183-E190 HydrophobicContact CB-CB 4.33Å; S188-E190 PolarHBondContact OG-N 3.01Å; E190-P192 VanDerWaalsContact C-CD 3.48Å
191	R	89.9	Confident	85.8	Confident	40 Å²	40	61.2 Å²	61.2	15%	0.151	32%	0.316	C	S	.	.			trans	-128.9	66.7	178.7	-59.9	-65.1	176.8	-91.9	-2.1	109	S188 L193 T947	S188-R191 VanDerWaalsContact O-CZ 3.24Å; S188-R191 PolarHBondContact O-NH1 3.48Å; S188-R191 PolarHBondContact O-NH2 3.31Å; R191-L193 PolarHBondContact O-N 3.27Å; R191-T947 HydrophobicContact CB-CG2 4.12Å
192	P	92.5	Very high	83.6	Confident	20 Å²	20	65.2 Å²	65.2	13%	0.13	33%	0.334	C	S	.	.			trans	-63.7	138.2	-174.8	27.4	-34.7	0	0	0	110.2	H183 E190 P195 E965 Y1110	H183-P192 HydrophobicContact CB-CG 3.77Å; E190-P192 VanDerWaalsContact C-CD 3.48Å; P192-P195 HydrophobicContact CB-CG 4.19Å; P192-P195 HydrophobicContact CG-CG 3.93Å; P192-E965 WeakPolarHBondContact CA-OE1 2.93Å; P192-E965 WeakPolarHBondContact CA-OE2 3.37Å; P192-E965 WeakPolarHBondContact CB-OE1 3.24Å; P192-Y1110 HydrophobicContact CG-CE2 4.49Å; P192-Y1110 WeakPolarHBondContact O-CE2 3.35Å; P192-Y1110 PolarHBondContact O-OH 2.97Å
193	L	93.8	Very high	81.9	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.016	32%	0.317	C	S	.	.	S	Bend	trans	-83	-31.6	176.7	-66.5	-170.8	0	0	0	112	R191 P195 L196 W316 T947 L950 L963 E965 Y966 Y1110 L1114	R191-L193 PolarHBondContact O-N 3.27Å; L193-P195 VanDerWaalsContact C-CD 3.41Å; L193-P195 VanDerWaalsContact C-N 3.29Å; L193-P195 VanDerWaalsContact O-N 3.16Å; L193-L196 WeakPolarHBondContact O-CB 3.25Å; L193-L196 PolarHBondContact O-N 3.21Å; L193-W316 HydrophobicContact CD1-CH2 4.26Å; L193-W316 HydrophobicContact CD2-CH2 4.01Å; L193-T947 HydrophobicContact CD2-CG2 4.42Å; L193-L950 HydrophobicContact CD1-CD2 4.42Å; L193-L963 HydrophobicContact CB-CD1 4.31Å; L193-L963 WeakPolarHBondContact O-CD1 3.49Å; L193-E965 PolarHBondContact N-OE1 3.49Å; L193-E965 PolarHBondContact N-OE2 3.43Å; L193-Y966 HydrophobicContact CD1-CD2 3.72Å; L193-Y966 HydrophobicContact CD1-CE2 4.03Å; L193-Y1110 PolarHBondContact O-OH 3.43Å; L193-L1114 HydrophobicContact CD2-CD1 3.57Å
194	V	91.7	Very high	80.4	Confident	44 Å²	44	69.3 Å²	69.3	27%	0.267	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-55.9	-36.5	-173.6	178.5	0	0	0	0	113.2	L196 Q197 Q199 E965	V194-L196 PolarHBondContact O-N 3.02Å; V194-L196 VanDerWaalsContact O-N 3.16Å; V194-Q197 PolarHBondContact O-N 3.3Å; V194-Q199 HydrophobicContact CG1-CG 3.96Å; V194-E965 WeakPolarHBondContact CB-OE1 3.38Å; V194-E965 HydrophobicContact CG2-CG 4.12Å; V194-E965 VanDerWaalsContact CG2-OE1 3.23Å; V194-E965 WeakPolarHBondContact CG2-OE1 3.16Å; V194-E965 PolarHBondContact N-OE1 3.39Å
195	P	91.6	Very high	79	Confident	22 Å²	22	73.2 Å²	73.2	14%	0.143	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-67.9	-3.4	175.4	-18.9	32.3	0	0	0	116.1	P192 L193 Q197 R1107 Y1110	P192-P195 HydrophobicContact CB-CG 4.19Å; P192-P195 HydrophobicContact CG-CG 3.93Å; L193-P195 VanDerWaalsContact C-CD 3.41Å; L193-P195 VanDerWaalsContact C-N 3.29Å; L193-P195 VanDerWaalsContact O-N 3.16Å; P195-Q197 PolarHBondContact O-N 3.03Å; P195-R1107 PolarHBondContact O-NH1 3.15Å; P195-Y1110 VanDerWaalsContact C-CE1 3.49Å; P195-Y1110 HydrophobicContact CB-CD2 4.46Å; P195-Y1110 HydrophobicContact CB-CE1 4.01Å; P195-Y1110 HydrophobicContact CB-CE2 3.89Å; P195-Y1110 HydrophobicContact CG-CE2 4.21Å; P195-Y1110 WeakPolarHBondContact O-CE1 3.37Å
196	L	91.4	Very high	78.1	Confident	1 Å²	1	74 Å²	74	1%	0.005	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-53.8	-34.4	167.9	-106.6	74.9	0	0	0	110.7	L193 V194 W316 T317 L963 R1107 Y1110 L1114	L193-L196 WeakPolarHBondContact O-CB 3.25Å; L193-L196 PolarHBondContact O-N 3.21Å; V194-L196 PolarHBondContact O-N 3.02Å; V194-L196 VanDerWaalsContact O-N 3.16Å; L196-W316 HydrophobicContact CD2-CZ2 3.77Å; L196-T317 HydrophobicContact CD2-CG2 4.27Å; L196-L963 HydrophobicContact CB-CD1 4.2Å; L196-R1107 PolarHBondContact O-NH1 3.36Å; L196-R1107 PolarHBondContact O-NH2 2.94Å; L196-Y1110 HydrophobicContact CD1-CE1 3.95Å; L196-Y1110 WeakPolarHBondContact CD1-OH 3.49Å; L196-Y1110 PolarHBondContact N-OH 3.11Å; L196-L1114 HydrophobicContact CD1-CD1 3.89Å; L196-L1114 HydrophobicContact CD1-CD2 3.41Å; L196-L1114 VanDerWaalsContact CD1-CD2 3.41Å; L196-L1114 HydrophobicContact CD1-CG 4.23Å; L196-L1114 HydrophobicContact CD2-CD2 4.34Å; L196-L1114 HydrophobicContact CG-CD2 4.17Å
197	Q	87.4	Confident	77.6	Confident	14 Å²	14	77.6 Å²	77.6	7%	0.065	39%	0.389	C	S	.	.	S	Bend	trans	-114.3	149.9	-179.2	-60.5	177.5	13.7	0	0	110.5	Y141 F151 V194 P195 Q199 L963	Y141-Q197 VanDerWaalsContact CE1-NE2 3.27Å; Y141-Q197 PolarHBondContact OH-NE2 3.18Å; Y141-Q197 PolarHBondContact OH-OE1 2.58Å; F151-Q197 HydrophobicContact CE2-CB 4.49Å; F151-Q197 HydrophobicContact CE2-CG 4.15Å; F151-Q197 HydrophobicContact CZ-CB 4.37Å; F151-Q197 HydrophobicContact CZ-CG 4.04Å; V194-Q197 PolarHBondContact O-N 3.3Å; P195-Q197 PolarHBondContact O-N 3.03Å; Q197-Q199 PolarHBondContact O-N 3.26Å; Q197-L963 HydrophobicContact CB-CD2 3.96Å; Q197-L963 VanDerWaalsContact CD-CD2 3.49Å; Q197-L963 HydrophobicContact CG-CD2 3.87Å
198	P	82.2	Confident	77.6	Confident	30 Å²	30	75.2 Å²	75.2	20%	0.195	36%	0.364	C	S	.	.			trans	-61.7	122.3	175.6	-22.2	33.4	0	0	0	111.8	F151 I154 F155 N200	F151-P198 HydrophobicContact CB-CG 4.1Å; F151-P198 HydrophobicContact CD1-CG 3.81Å; F151-P198 HydrophobicContact CD2-CG 4.45Å; F151-P198 HydrophobicContact CE1-CG 4.33Å; F151-P198 HydrophobicContact CG-CG 3.89Å; I154-P198 HydrophobicContact CB-CB 4.41Å; I154-P198 HydrophobicContact CB-CG 4.1Å; I154-P198 HydrophobicContact CD1-CB 4.38Å; I154-P198 HydrophobicContact CD1-CG 3.74Å; I154-P198 HydrophobicContact CG2-CB 3.54Å; I154-P198 HydrophobicContact CG2-CG 3.78Å; F155-P198 HydrophobicContact CE2-CG 4.28Å; F155-P198 HydrophobicContact CZ-CG 4Å; P198-N200 PolarHBondContact O-N 3Å
199	Q	67.8	Low	77.6	Confident	136 Å²	136	75 Å²	75	64%	0.636	36%	0.361	S	S	*	.			trans	-79.8	52	178.7	-60.8	-174.5	11.5	0	0	111.9	V194 Q197 K201	V194-Q199 HydrophobicContact CG1-CG 3.96Å; Q197-Q199 PolarHBondContact O-N 3.26Å; Q199-K201 PolarHBondContact O-N 2.98Å
200	N	56.7	Low	77.6	Confident	77 Å²	77	69.4 Å²	69.4	41%	0.412	34%	0.337	S	S	.	.			trans	-85.2	99.6	-178.2	-160.9	-15.3	0	0	0	110.5	P198 D202 W203	P198-N200 PolarHBondContact O-N 3Å; N200-D202 PolarHBondContact O-N 2.73Å; N200-D202 VanDerWaalsContact O-N 3.1Å; N200-D202 WeakPolarHBondContact OD1-CB 3.35Å; N200-D202 PolarHBondContact OD1-N 3.19Å; N200-D202 VanDerWaalsContact OD1-N 3.08Å; N200-W203 HydrophobicContact CB-CB 4.29Å; N200-W203 WeakPolarHBondContact O-CB 3.43Å; N200-W203 PolarHBondContact O-N 3.07Å
201	K	49	Very low	77.6	Confident	198 Å²	198	64.3 Å²	64.3	86%	0.861	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.7	174.4	-72.8	-178.6	178.4	175	0	113	Q199	Q199-K201 PolarHBondContact O-N 2.98Å
202	D	44.6	Very low	77.6	Confident	144 Å²	144	63.2 Å²	63.2	77%	0.77	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	2.4	177.1	-61.4	-39.8	0	0	0	113.6	N200 K204	N200-D202 PolarHBondContact O-N 2.73Å; N200-D202 VanDerWaalsContact O-N 3.1Å; N200-D202 WeakPolarHBondContact OD1-CB 3.35Å; N200-D202 PolarHBondContact OD1-N 3.19Å; N200-D202 VanDerWaalsContact OD1-N 3.08Å; D202-K204 PolarHBondContact O-N 2.98Å
203	W	55.8	Low	77.3	Confident	90 Å²	90	63.9 Å²	63.9	34%	0.341	32%	0.315	S	S	.	.			trans	-74.9	63	170	-160	-70.5	0	0	0	110.7	P137 I154 N200	P137-W203 HydrophobicContact CG-CZ2 4.41Å; I154-W203 HydrophobicContact CD1-CE3 4.39Å; I154-W203 HydrophobicContact CD1-CH2 3.6Å; I154-W203 HydrophobicContact CD1-CZ3 3.32Å; I154-W203 HydrophobicContact CG1-CH2 4.31Å; I154-W203 HydrophobicContact CG1-CZ3 3.81Å; N200-W203 HydrophobicContact CB-CB 4.29Å; N200-W203 WeakPolarHBondContact O-CB 3.43Å; N200-W203 PolarHBondContact O-N 3.07Å
204	K	60.3	Low	77	Confident	177 Å²	177	65.8 Å²	65.8	77%	0.77	33%	0.325	S	S	*	.			trans	-81.7	119.9	158.8	-72.5	-175	179.8	179.7	0	107.1	D202 M206	D202-K204 PolarHBondContact O-N 2.98Å; K204-M206 PolarHBondContact O-N 3.29Å
205	P	64.1	Low	76.8	Confident	85 Å²	85	64.2 Å²	64.2	55%	0.552	32%	0.316	S	S	*	.			trans	-53.5	131.5	175.7	19.5	-28.9	0	0	0	108.8	Q207	P205-Q207 PolarHBondContact O-N 2.75Å
206	M	76.4	Confident	76.6	Confident	48 Å²	48	67.1 Å²	67.1	24%	0.236	35%	0.349	C	S	.	.			trans	-69	99.3	-178.4	-78.3	-159.3	-50.7	0	0	109.5	K204 C208 S293 L294 K297	K204-M206 PolarHBondContact O-N 3.29Å; M206-C208 PolarHBondContact O-N 2.89Å; M206-S293 PolarHBondContact SD-OG 3.07Å; M206-L294 HydrophobicContact CE-CB 3.86Å; M206-L294 HydrophobicContact CE-CD1 3.94Å; M206-L294 VanDerWaalsContact CE-N 3.35Å; M206-K297 HydrophobicContact CE-CB 4.39Å; M206-K297 HydrophobicContact CE-CD 3.61Å; M206-K297 HydrophobicContact CE-CG 4.16Å; M206-K297 HydrophobicContact SD-CD 4.07Å
207	Q	83.7	Confident	76.5	Confident	105 Å²	105	71.3 Å²	71.3	49%	0.491	37%	0.365	S	S	.	.			trans	-79.6	112.2	-178.7	-167	171.3	37.7	0	0	110.3	P205 L209 V238 N290	P205-Q207 PolarHBondContact O-N 2.75Å; Q207-L209 WeakPolarHBondContact CG-O 3.49Å; Q207-L209 PolarHBondContact NE2-O 3.2Å; Q207-V238 HydrophobicContact CG-CG2 4.43Å; Q207-V238 WeakPolarHBondContact O-CG2 3.32Å; Q207-N290 PolarHBondContact O-ND2 3.21Å
208	C	89.5	Confident	76.5	Confident	5 Å²	5	72.9 Å²	72.9	3%	0.034	37%	0.374	C	S	.	.	S	Bend	trans	-86.1	-32	173.1	-60.2	0	0	0	0	111.9	L132 M206 V238 F287 N290	L132-C208 HydrophobicContact CD2-CB 3.58Å; M206-C208 PolarHBondContact O-N 2.89Å; C208-V238 WeakPolarHBondContact O-CG2 3.47Å; C208-F287 HydrophobicContact CB-CD2 3.82Å; C208-F287 HydrophobicContact CB-CE2 3.84Å; C208-F287 WeakPolarHBondContact O-CD2 3.32Å; C208-N290 HydrophobicContact CB-CB 4.43Å
209	L	89.1	Confident	77	Confident	15 Å²	15	75.8 Å²	75.8	8%	0.079	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	150.4	177.8	-64.9	173.6	0	0	0	110.1	L132 Q207 L212 I235 L280 F287	L132-L209 HydrophobicContact CD1-CD1 3.93Å; L132-L209 HydrophobicContact CD1-CG 4.42Å; Q207-L209 WeakPolarHBondContact CG-O 3.49Å; Q207-L209 PolarHBondContact NE2-O 3.2Å; L209-L212 HydrophobicContact CD1-CB 4.08Å; L209-L212 HydrophobicContact CD1-CD2 4.22Å; L209-I235 HydrophobicContact CD1-CG2 4.16Å; L209-I235 HydrophobicContact CD2-CG2 3.93Å; L209-L280 HydrophobicContact CD1-CD1 3.88Å; L209-L280 HydrophobicContact CD2-CD2 4.34Å; L209-F287 HydrophobicContact CD1-CD2 4.33Å; L209-F287 HydrophobicContact CD1-CE2 4.02Å; L209-F287 HydrophobicContact CD2-CD2 3.56Å; L209-F287 HydrophobicContact CD2-CE2 4.12Å; L209-F287 HydrophobicContact CD2-CG 4.42Å; L209-F287 HydrophobicContact CG-CD2 3.66Å; L209-F287 HydrophobicContact CG-CE2 3.79Å
210	K	86.9	Confident	78.1	Confident	78 Å²	78	69.5 Å²	69.5	34%	0.339	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-40.3	169.6	-70.1	-171.8	178.1	-166	0	111.3	V236 E240	K210-V236 HydrophobicContact CB-CB 4.18Å; K210-V236 HydrophobicContact CB-CG1 4.08Å; K210-V236 HydrophobicContact CD-CG1 4.33Å; K210-V236 PolarHBondContact N-O 2.66Å; K210-E240 IonicContact NZ-OE1 2.59Å; K210-E240 PolarHBondContact NZ-OE1 2.76Å
211	V	86.1	Confident	79.8	Confident	19 Å²	19	68.3 Å²	68.3	12%	0.115	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	135.3	-174.8	-176.8	0	0	0	0	110.1	T213 Y234 I235 V236 M325	V211-T213 HydrophobicContact CG1-CG2 3.94Å; V211-Y234 HydrophobicContact CG1-CD1 4.43Å; V211-I235 VanDerWaalsContact O-CA 3.3Å; V211-I235 WeakPolarHBondContact O-CA 3.38Å; V211-I235 WeakPolarHBondContact O-CG2 3.39Å; V211-V236 HydrophobicContact CB-CB 3.78Å; V211-V236 HydrophobicContact CB-CG2 3.79Å; V211-V236 HydrophobicContact CG2-CB 3.77Å; V211-V236 HydrophobicContact CG2-CG2 3.78Å; V211-V236 PolarHBondContact N-O 3.44Å; V211-V236 PolarHBondContact O-N 3.24Å; V211-M325 HydrophobicContact CB-CE 3.85Å; V211-M325 HydrophobicContact CG1-CE 3.44Å; V211-M325 VanDerWaalsContact CG1-CE 3.44Å; V211-M325 HydrophobicContact CG2-CE 3.13Å
212	L	88.3	Confident	81.8	Confident	17 Å²	17	61.1 Å²	61.1	9%	0.089	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	94.3	167	172	55	0	0	0	108.8	I128 R129 L132 L209 L233 I235 L276	I128-L212 HydrophobicContact CG2-CD2 4.41Å; R129-L212 HydrophobicContact CG-CD2 3.61Å; R129-L212 HydrophobicContact CG-CG 4.13Å; R129-L212 PolarHBondContact NE-O 2.96Å; R129-L212 VanDerWaalsContact NE-O 3.16Å; R129-L212 PolarHBondContact NH2-O 2.99Å; R129-L212 VanDerWaalsContact NH2-O 3.15Å; L132-L212 HydrophobicContact CD1-CD2 4.5Å; L209-L212 HydrophobicContact CD1-CB 4.08Å; L209-L212 HydrophobicContact CD1-CD2 4.22Å; L212-L233 HydrophobicContact CD1-CD1 4.44Å; L212-I235 HydrophobicContact CD1-CD1 3.64Å; L212-I235 HydrophobicContact CD1-CG1 3.64Å; L212-L276 HydrophobicContact CD1-CD2 4.18Å; L212-L276 HydrophobicContact CD2-CD2 4.34Å
213	T	86.8	Confident	84.1	Confident	33 Å²	33	58.8 Å²	58.8	20%	0.202	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	166.6	-173.5	-167	0	0	0	0	112.8	V211 L233 Y234 C327	V211-T213 HydrophobicContact CG1-CG2 3.94Å; T213-L233 CarbonylContact O-C 3.47Å; T213-L233 VanDerWaalsContact O-CA 3.3Å; T213-L233 WeakPolarHBondContact O-CA 3.46Å; T213-Y234 HydrophobicContact CG2-CD1 3.84Å; T213-Y234 HydrophobicContact CG2-CG 4.33Å; T213-Y234 PolarHBondContact N-O 3.37Å; T213-Y234 PolarHBondContact O-N 3.18Å; T213-C327 WeakPolarHBondContact CB-SG 3.35Å; T213-C327 WeakPolarHBondContact OG1-CB 3.35Å; T213-C327 PolarHBondContact OG1-SG 3.27Å
214	M	87.1	Confident	85.8	Confident	44 Å²	44	56.6 Å²	56.6	22%	0.217	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	132.5	166.6	-59.8	-56.3	-67.5	0	0	109	N218 M231 L233	M214-N218 HydrophobicContact CE-CB 4.33Å; M214-N218 VanDerWaalsContact CE-ND2 3.33Å; M214-N218 WeakPolarHBondContact CE-ND2 3.29Å; M214-M231 HydrophobicContact CE-CB 3.76Å; M214-M231 HydrophobicContact CE-CG 4.23Å; M214-M231 HydrophobicContact CE-SD 3.81Å; M214-M231 HydrophobicContact SD-SD 4.22Å; M214-L233 HydrophobicContact CE-CD2 4.22Å; M214-L233 HydrophobicContact SD-CD2 3.42Å; M214-L233 WeakPolarHBondContact SD-CD2 3.47Å
215	S	88.7	Confident	87.3	Confident	11 Å²	11	54 Å²	54	8%	0.077	31%	0.31	C	S	.	.			trans	-66.1	146	176.5	-174.6	0	0	0	0	110.5	W217 N218 Y232	S215-W217 PolarHBondContact O-N 2.9Å; S215-W217 PolarHBondContact OG-N 3.27Å; S215-N218 WeakPolarHBondContact O-CB 3.41Å; S215-N218 PolarHBondContact O-N 3.25Å; S215-Y232 WeakPolarHBondContact CB-O 3.41Å; S215-Y232 PolarHBondContact N-O 2.62Å
216	G	86.8	Confident	88.6	Confident	82 Å²	82	57.6 Å²	57.6	85%	0.845	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.4	171.4	0	0	0	0	0	114	N218	G216-N218 VanDerWaalsContact C-N 3.29Å
217	W	89.3	Confident	89.2	Confident	89 Å²	89	61.7 Å²	61.7	34%	0.337	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.8	172.4	-58.9	116.6	0	0	0	113.9	S215 Y232 T258 F262	S215-W217 PolarHBondContact O-N 2.9Å; S215-W217 PolarHBondContact OG-N 3.27Å; W217-Y232 HydrophobicContact CB-CD2 4.02Å; W217-Y232 WeakPolarHBondContact O-CD2 3.39Å; W217-T258 PolarHBondContact NE1-O 2.95Å; W217-F262 HydrophobicContact CB-CD2 3.66Å; W217-F262 HydrophobicContact CB-CE2 3.79Å; W217-F262 AromaticContact CD1-CD2 3.9Å; W217-F262 HydrophobicContact CD2-CB 3.7Å; W217-F262 AromaticContact CD2-CD2 3.63Å; W217-F262 HydrophobicContact CD2-CD2 3.63Å; W217-F262 AromaticContact CD2-CG 3.95Å; W217-F262 HydrophobicContact CD2-CG 3.95Å; W217-F262 HydrophobicContact CE3-CB 3.7Å; W217-F262 HydrophobicContact CE3-CD2 4.05Å; W217-F262 AromaticContact CE3-CG 3.99Å; W217-F262 HydrophobicContact CE3-CG 3.99Å; W217-F262 HydrophobicContact CG-CB 4.4Å; W217-F262 AromaticContact CG-CD2 3.44Å; W217-F262 HydrophobicContact CG-CD2 3.44Å; W217-F262 VanDerWaalsContact CG-CD2 3.44Å; W217-F262 HydrophobicContact CG-CE2 4.09Å; W217-F262 HydrophobicContact CG-CG 4.25Å; W217-F262 HydrophobicContact CH2-CB 3.85Å; W217-F262 HydrophobicContact CZ2-CB 3.84Å; W217-F262 HydrophobicContact CZ3-CB 3.77Å; W217-F262 HydrophobicContact CZ3-CG 4.49Å
218	N	88.4	Confident	89.5	Confident	47 Å²	47	57.3 Å²	57.3	25%	0.251	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-81.5	139.2	177.3	-168	70.7	0	0	0	110.5	M214 S215 G216 M231 Y232	M214-N218 HydrophobicContact CE-CB 4.33Å; M214-N218 VanDerWaalsContact CE-ND2 3.33Å; M214-N218 WeakPolarHBondContact CE-ND2 3.29Å; S215-N218 WeakPolarHBondContact O-CB 3.41Å; S215-N218 PolarHBondContact O-N 3.25Å; G216-N218 VanDerWaalsContact C-N 3.29Å; N218-M231 VanDerWaalsContact OD1-CA 3.32Å; N218-M231 WeakPolarHBondContact OD1-CA 3.24Å; N218-M231 WeakPolarHBondContact OD1-CB 3.24Å; N218-Y232 PolarHBondContact OD1-N 3.34Å
219	P	91	Very high	89.7	Confident	91 Å²	91	57.3 Å²	57.3	59%	0.591	32%	0.322	S	S	*	.	S	Bend	cis	-81.5	157.3	5.3	33.4	-35.9	0	0	0	114
220	P	91.9	Very high	89.9	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.032	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-57.3	138.6	176.7	-24.6	34.3	0	0	0	112.8	R224 K225 D229 L230 Y232	P220-R224 HydrophobicContact CB-CB 4.32Å; P220-K225 HydrophobicContact CB-CG 4.06Å; P220-K225 WeakPolarHBondContact O-CE 3.43Å; P220-D229 HydrophobicContact CB-CB 4.01Å; P220-D229 HydrophobicContact CG-CB 4.19Å; P220-L230 WeakPolarHBondContact CD-O 3.32Å; P220-Y232 HydrophobicContact CB-CE2 3.83Å; P220-Y232 HydrophobicContact CG-CD2 4.21Å; P220-Y232 HydrophobicContact CG-CE2 3.88Å
221	P	92	Very high	90.2	Very high	52 Å²	52	54 Å²	54	34%	0.338	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-67.3	158	176.2	27.5	-33.6	0	0	0	111.1	N223 R224 K225 F262	P221-N223 VanDerWaalsContact C-N 3.29Å; P221-N223 WeakPolarHBondContact CB-OD1 3.47Å; P221-N223 WeakPolarHBondContact CG-OD1 3.47Å; P221-N223 PolarHBondContact O-N 2.8Å; P221-R224 HydrophobicContact CG-CB 3.99Å; P221-R224 HydrophobicContact CG-CG 3.72Å; P221-R224 WeakPolarHBondContact O-CA 3.49Å; P221-R224 WeakPolarHBondContact O-CB 3.36Å; P221-R224 PolarHBondContact O-N 3.35Å; P221-K225 PolarHBondContact O-N 3.46Å; P221-F262 HydrophobicContact CG-CE1 4.39Å
222	G	91.9	Very high	90.6	Very high	47 Å²	47	53.2 Å²	53.2	49%	0.485	30%	0.303	S	S	.	.	H	α-helix	trans	-54.6	-40.1	-171.7	0	0	0	0	0	114.5	R224 K225 M226	G222-R224 VanDerWaalsContact C-N 3.29Å; G222-R224 PolarHBondContact O-N 3.21Å; G222-K225 PolarHBondContact O-N 3.18Å; G222-M226 WeakPolarHBondContact O-CG 3.4Å; G222-M226 PolarHBondContact O-N 2.91Å; G222-M226 VanDerWaalsContact O-N 3.13Å
223	N	92.2	Very high	90.7	Very high	94 Å²	94	52.4 Å²	52.4	50%	0.503	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-35.6	174.7	63.7	-27.5	0	0	0	113	P221 M226 H227	P221-N223 VanDerWaalsContact C-N 3.29Å; P221-N223 WeakPolarHBondContact CB-OD1 3.47Å; P221-N223 WeakPolarHBondContact CG-OD1 3.47Å; P221-N223 PolarHBondContact O-N 2.8Å; N223-M226 HydrophobicContact CB-CE 4.5Å; N223-H227 PolarHBondContact O-ND1 2.91Å
224	R	92.1	Very high	91	Very high	45 Å²	45	53 Å²	53	17%	0.17	30%	0.298	C	S	.	.	H	α-helix	trans	-79.7	-35.5	178.3	-68	-51.2	-52.5	167.8	4.3	112.6	P220 P221 G222 M226 H227 G228 D229 Y232 P264	P220-R224 HydrophobicContact CB-CB 4.32Å; P221-R224 HydrophobicContact CG-CB 3.99Å; P221-R224 HydrophobicContact CG-CG 3.72Å; P221-R224 WeakPolarHBondContact O-CA 3.49Å; P221-R224 WeakPolarHBondContact O-CB 3.36Å; P221-R224 PolarHBondContact O-N 3.35Å; G222-R224 VanDerWaalsContact C-N 3.29Å; G222-R224 PolarHBondContact O-N 3.21Å; R224-M226 PolarHBondContact O-N 3.44Å; R224-H227 CarbonylContact O-C 3.34Å; R224-H227 WeakPolarHBondContact O-CA 3.4Å; R224-H227 WeakPolarHBondContact O-CB 3.26Å; R224-H227 PolarHBondContact O-N 2.87Å; R224-G228 PolarHBondContact O-N 3.44Å; R224-D229 HydrophobicContact CB-CB 4.1Å; R224-D229 WeakPolarHBondContact CB-OD2 3.48Å; R224-D229 IonicContact CZ-OD1 3.71Å; R224-D229 IonicContact CZ-OD2 3.4Å; R224-D229 IonicContact NE-OD1 3.81Å; R224-D229 IonicContact NE-OD2 2.81Å; R224-D229 PolarHBondContact NE-OD2 3.36Å; R224-D229 IonicContact NH2-OD1 2.83Å; R224-D229 PolarHBondContact NH2-OD1 3.41Å; R224-D229 IonicContact NH2-OD2 3.11Å; R224-D229 PolarHBondContact NH2-OD2 3Å; R224-D229 VanDerWaalsContact NH2-OD2 3.11Å; R224-D229 WeakPolarHBondContact O-CB 3.39Å; R224-D229 PolarHBondContact O-N 3.33Å; R224-D229 VanDerWaalsContact O-N 3.11Å; R224-Y232 WeakPolarHBondContact CB-OH 3.36Å; R224-P264 HydrophobicContact CG-CG 4.31Å
225	K	91.8	Very high	91.2	Very high	123 Å²	123	51 Å²	51	54%	0.535	29%	0.288	S	S	.	.	H	α-helix	trans	-55.2	-41.6	169	-68.5	-176.3	175.6	-179.7	0	111.5	P220 P221 G222 H227 G228	P220-K225 HydrophobicContact CB-CG 4.06Å; P220-K225 WeakPolarHBondContact O-CE 3.43Å; P221-K225 PolarHBondContact O-N 3.46Å; G222-K225 PolarHBondContact O-N 3.18Å; K225-H227 PolarHBondContact O-N 3.24Å; K225-G228 PolarHBondContact O-N 2.97Å
226	M	90.1	Very high	91.3	Very high	160 Å²	160	51 Å²	51	79%	0.788	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.4	174.5	-68.3	-172.4	-68.7	0	0	113.9	G222 N223 R224 G228	G222-M226 WeakPolarHBondContact O-CG 3.4Å; G222-M226 PolarHBondContact O-N 2.91Å; G222-M226 VanDerWaalsContact O-N 3.13Å; N223-M226 HydrophobicContact CB-CE 4.5Å; R224-M226 PolarHBondContact O-N 3.44Å; M226-G228 VanDerWaalsContact C-N 3.28Å
227	H	89.4	Confident	91.6	Very high	134 Å²	134	47.1 Å²	47.1	62%	0.62	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	5.1	171.2	-72.5	75.4	0	0	0	112.8	N223 R224 K225	N223-H227 PolarHBondContact O-ND1 2.91Å; R224-H227 CarbonylContact O-C 3.34Å; R224-H227 WeakPolarHBondContact O-CA 3.4Å; R224-H227 WeakPolarHBondContact O-CB 3.26Å; R224-H227 PolarHBondContact O-N 2.87Å; K225-H227 PolarHBondContact O-N 3.24Å
228	G	90.8	Very high	91.7	Very high	12 Å²	12	45 Å²	45	12%	0.124	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.5	8.2	178.8	0	0	0	0	0	114.9	R224 K225 M226 L230 S248 T249	R224-G228 PolarHBondContact O-N 3.44Å; K225-G228 PolarHBondContact O-N 2.97Å; M226-G228 VanDerWaalsContact C-N 3.28Å; G228-L230 PolarHBondContact O-N 3.31Å; G228-S248 CarbonylContact O-C 3.24Å; G228-S248 WeakPolarHBondContact O-CA 3.45Å; G228-S248 WeakPolarHBondContact O-CB 3.25Å; G228-T249 PolarHBondContact O-N 2.95Å
229	D	94.1	Very high	91.9	Very high	5 Å²	5	47 Å²	47	3%	0.027	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	121.2	174.3	-63.8	11.4	0	0	0	109.6	P220 R224 Y232 T246	P220-D229 HydrophobicContact CB-CB 4.01Å; P220-D229 HydrophobicContact CG-CB 4.19Å; R224-D229 HydrophobicContact CB-CB 4.1Å; R224-D229 WeakPolarHBondContact CB-OD2 3.48Å; R224-D229 IonicContact CZ-OD1 3.71Å; R224-D229 IonicContact CZ-OD2 3.4Å; R224-D229 IonicContact NE-OD1 3.81Å; R224-D229 IonicContact NE-OD2 2.81Å; R224-D229 PolarHBondContact NE-OD2 3.36Å; R224-D229 IonicContact NH2-OD1 2.83Å; R224-D229 PolarHBondContact NH2-OD1 3.41Å; R224-D229 IonicContact NH2-OD2 3.11Å; R224-D229 PolarHBondContact NH2-OD2 3Å; R224-D229 VanDerWaalsContact NH2-OD2 3.11Å; R224-D229 WeakPolarHBondContact O-CB 3.39Å; R224-D229 PolarHBondContact O-N 3.33Å; R224-D229 VanDerWaalsContact O-N 3.11Å; D229-Y232 HydrophobicContact CB-CE1 4.23Å; D229-Y232 WeakPolarHBondContact OD2-CE1 3.32Å; D229-Y232 PolarHBondContact OD2-OH 3.37Å; D229-T246 HydrophobicContact CB-CG2 4.08Å
230	L	93.1	Very high	91.9	Very high	22 Å²	22	48.8 Å²	48.8	12%	0.115	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-44.8	-177	-57.9	174	0	0	0	111.9	Y116 V118 A121 P220 G228 A247 S248 T249	Y116-L230 VanDerWaalsContact O-CD1 3.27Å; Y116-L230 WeakPolarHBondContact O-CD1 3.38Å; V118-L230 HydrophobicContact CG2-CB 4.19Å; V118-L230 HydrophobicContact CG2-CD2 3.9Å; A121-L230 HydrophobicContact CB-CD1 4.1Å; P220-L230 WeakPolarHBondContact CD-O 3.32Å; G228-L230 PolarHBondContact O-N 3.31Å; L230-A247 WeakPolarHBondContact CB-O 3.49Å; L230-A247 PolarHBondContact N-O 3.43Å; L230-S248 VanDerWaalsContact CD1-C 3.44Å; L230-S248 WeakPolarHBondContact CD1-O 3.28Å; L230-T249 HydrophobicContact CD2-CG2 3.97Å; L230-T249 HydrophobicContact CG-CG2 4.44Å
231	M	92.5	Very high	91.9	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.015	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	163.6	177.7	61.8	177.2	74.9	0	0	111.8	A121 R122 V125 M214 N218 L233 A247	A121-M231 HydrophobicContact CB-CE 3.59Å; A121-M231 HydrophobicContact CB-SD 4.38Å; R122-M231 HydrophobicContact CB-CE 4.25Å; R122-M231 HydrophobicContact CG-CE 3.4Å; R122-M231 VanDerWaalsContact CG-CE 3.4Å; V125-M231 HydrophobicContact CG2-SD 4.42Å; M214-M231 HydrophobicContact CE-CB 3.76Å; M214-M231 HydrophobicContact CE-CG 4.23Å; M214-M231 HydrophobicContact CE-SD 3.81Å; M214-M231 HydrophobicContact SD-SD 4.22Å; N218-M231 VanDerWaalsContact OD1-CA 3.32Å; N218-M231 WeakPolarHBondContact OD1-CA 3.24Å; N218-M231 WeakPolarHBondContact OD1-CB 3.24Å; M231-L233 HydrophobicContact SD-CD2 4.07Å; M231-A247 HydrophobicContact CG-CB 3.43Å; M231-A247 VanDerWaalsContact CG-CB 3.43Å; M231-A247 PolarHBondContact N-O 2.8Å; M231-A247 PolarHBondContact O-N 3.09Å; M231-A247 HydrophobicContact SD-CB 4.36Å
232	Y	93.4	Very high	91.9	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.3	174.3	-57.7	-54.4	0	0	0	111	S215 W217 N218 P220 R224 D229 V245 T246 F262 P264	S215-Y232 WeakPolarHBondContact CB-O 3.41Å; S215-Y232 PolarHBondContact N-O 2.62Å; W217-Y232 HydrophobicContact CB-CD2 4.02Å; W217-Y232 WeakPolarHBondContact O-CD2 3.39Å; N218-Y232 PolarHBondContact OD1-N 3.34Å; P220-Y232 HydrophobicContact CB-CE2 3.83Å; P220-Y232 HydrophobicContact CG-CD2 4.21Å; P220-Y232 HydrophobicContact CG-CE2 3.88Å; R224-Y232 WeakPolarHBondContact CB-OH 3.36Å; D229-Y232 HydrophobicContact CB-CE1 4.23Å; D229-Y232 WeakPolarHBondContact OD2-CE1 3.32Å; D229-Y232 PolarHBondContact OD2-OH 3.37Å; Y232-V245 CarbonylContact C-O 3.5Å; Y232-V245 WeakPolarHBondContact CA-O 3.35Å; Y232-T246 HydrophobicContact CD1-CG2 3.87Å; Y232-T246 HydrophobicContact CE1-CG2 3.58Å; Y232-F262 HydrophobicContact CD2-CE2 4.04Å; Y232-F262 HydrophobicContact CD2-CZ 4.47Å; Y232-F262 AromaticContact CE2-CE2 3.57Å; Y232-F262 HydrophobicContact CE2-CE2 3.57Å; Y232-F262 AromaticContact CE2-CZ 3.57Å; Y232-F262 HydrophobicContact CE2-CZ 3.57Å; Y232-F262 AromaticContact CZ-CE2 3.9Å; Y232-F262 AromaticContact CZ-CZ 3.71Å; Y232-P264 HydrophobicContact CE1-CB 4.49Å
233	L	92.3	Very high	91.9	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.9	177.5	-49.3	172.6	0	0	0	110.3	V125 L212 T213 M214 M231 S244 V245 F252 L276	V125-L233 HydrophobicContact CG1-CD2 4.38Å; V125-L233 HydrophobicContact CG2-CD1 3.79Å; V125-L233 HydrophobicContact CG2-CD2 4.26Å; L212-L233 HydrophobicContact CD1-CD1 4.44Å; T213-L233 CarbonylContact O-C 3.47Å; T213-L233 VanDerWaalsContact O-CA 3.3Å; T213-L233 WeakPolarHBondContact O-CA 3.46Å; M214-L233 HydrophobicContact CE-CD2 4.22Å; M214-L233 HydrophobicContact SD-CD2 3.42Å; M214-L233 WeakPolarHBondContact SD-CD2 3.47Å; M231-L233 HydrophobicContact SD-CD2 4.07Å; L233-S244 WeakPolarHBondContact O-CA 3.29Å; L233-V245 HydrophobicContact CB-CB 4.18Å; L233-V245 PolarHBondContact N-O 3.32Å; L233-V245 PolarHBondContact O-N 3.23Å; L233-F252 HydrophobicContact CD1-CD1 4.33Å; L233-F252 HydrophobicContact CD1-CE1 4.27Å; L233-L276 HydrophobicContact CD1-CD1 4.46Å; L233-L276 HydrophobicContact CD1-CD2 4.04Å
234	Y	91.6	Very high	92	Very high	46 Å²	46	51.6 Å²	51.6	18%	0.18	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.7	172.6	178.7	-103.4	0	0	0	109.1	V211 T213 V236 H242	V211-Y234 HydrophobicContact CG1-CD1 4.43Å; T213-Y234 HydrophobicContact CG2-CD1 3.84Å; T213-Y234 HydrophobicContact CG2-CG 4.33Å; T213-Y234 PolarHBondContact N-O 3.37Å; T213-Y234 PolarHBondContact O-N 3.18Å; Y234-V236 HydrophobicContact CE1-CG2 3.78Å; Y234-H242 HydrophobicContact CE2-CB 4.4Å; Y234-H242 AromaticContact CZ-ND1 3.67Å; Y234-H242 PolarHBondContact OH-ND1 2.97Å
235	I	91.8	Very high	92.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.7	-171.9	-53.7	-178.3	0	0	0	109.4	L209 V211 L212 V243 V245 L276 L280	L209-I235 HydrophobicContact CD1-CG2 4.16Å; L209-I235 HydrophobicContact CD2-CG2 3.93Å; V211-I235 VanDerWaalsContact O-CA 3.3Å; V211-I235 WeakPolarHBondContact O-CA 3.38Å; V211-I235 WeakPolarHBondContact O-CG2 3.39Å; L212-I235 HydrophobicContact CD1-CD1 3.64Å; L212-I235 HydrophobicContact CD1-CG1 3.64Å; I235-V243 HydrophobicContact CB-CG2 3.71Å; I235-V243 HydrophobicContact CG2-CG2 4.26Å; I235-V243 PolarHBondContact N-O 3.44Å; I235-V243 PolarHBondContact O-N 2.94Å; I235-V245 HydrophobicContact CD1-CB 4.49Å; I235-V245 HydrophobicContact CD1-CG2 3.63Å; I235-V245 HydrophobicContact CG1-CG2 4.27Å; I235-L276 HydrophobicContact CD1-CD1 4.08Å; I235-L280 HydrophobicContact CD1-CD2 3.83Å; I235-L280 HydrophobicContact CG2-CD2 4.08Å
236	V	91.8	Very high	92.3	Very high	12 Å²	12	43.6 Å²	43.6	7%	0.073	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.8	170.5	-174.3	0	0	0	0	108.2	K210 V211 Y234 R241 H242	K210-V236 HydrophobicContact CB-CB 4.18Å; K210-V236 HydrophobicContact CB-CG1 4.08Å; K210-V236 HydrophobicContact CD-CG1 4.33Å; K210-V236 PolarHBondContact N-O 2.66Å; V211-V236 HydrophobicContact CB-CB 3.78Å; V211-V236 HydrophobicContact CB-CG2 3.79Å; V211-V236 HydrophobicContact CG2-CB 3.77Å; V211-V236 HydrophobicContact CG2-CG2 3.78Å; V211-V236 PolarHBondContact N-O 3.44Å; V211-V236 PolarHBondContact O-N 3.24Å; Y234-V236 HydrophobicContact CE1-CG2 3.78Å; V236-R241 WeakPolarHBondContact CA-O 3.49Å; V236-H242 WeakPolarHBondContact CG2-ND1 3.41Å
237	T	92.4	Very high	92.6	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	164.7	178.7	72.5	0	0	0	0	110.8	E239 E240 R241	T237-E239 PolarHBondContact O-N 3.18Å; T237-E239 PolarHBondContact OG1-N 3.16Å; T237-E240 PolarHBondContact O-N 3.22Å; T237-R241 HydrophobicContact CG2-CB 4.2Å; T237-R241 PolarHBondContact N-O 3.41Å; T237-R241 WeakPolarHBondContact OG1-CB 3.47Å; T237-R241 PolarHBondContact OG1-N 3.28Å; T237-R241 VanDerWaalsContact OG1-N 3.15Å
238	V	90.2	Very high	92.8	Very high	46 Å²	46	30.1 Å²	30.1	28%	0.279	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.9	172.9	176.7	0	0	0	0	111.6	Q207 C208 E240	Q207-V238 HydrophobicContact CG-CG2 4.43Å; Q207-V238 WeakPolarHBondContact O-CG2 3.32Å; C208-V238 WeakPolarHBondContact O-CG2 3.47Å; V238-E240 PolarHBondContact O-N 2.84Å
239	E	93.8	Very high	93	Very high	89 Å²	89	32.2 Å²	32.2	42%	0.416	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	9.6	175.2	-57.6	154.2	158.4	0	0	112.9	T237 R241 S284 P285 A286	T237-E239 PolarHBondContact O-N 3.18Å; T237-E239 PolarHBondContact OG1-N 3.16Å; E239-R241 PolarHBondContact O-N 3.28Å; E239-S284 PolarHBondContact OE2-OG 2.88Å; E239-P285 WeakPolarHBondContact OE1-CD 3.15Å; E239-A286 HydrophobicContact CG-CB 3.76Å; E239-A286 VanDerWaalsContact OE1-CB 3.28Å; E239-A286 WeakPolarHBondContact OE1-CB 3.43Å; E239-A286 PolarHBondContact OE1-N 3.5Å; E239-A286 VanDerWaalsContact OE1-N 3.12Å
240	E	91	Very high	92.9	Very high	127 Å²	127	41 Å²	41	59%	0.593	19%	0.187	S	C	*	.			trans	63.7	21.9	-179.9	-47.3	-162.5	151.1	0	0	114.6	K210 T237 V238 H242	K210-E240 IonicContact NZ-OE1 2.59Å; K210-E240 PolarHBondContact NZ-OE1 2.76Å; T237-E240 PolarHBondContact O-N 3.22Å; V238-E240 PolarHBondContact O-N 2.84Å; E240-H242 PolarHBondContact O-CD2 3.41Å; E240-H242 VanDerWaalsContact O-CD2 3.29Å
241	R	92	Very high	92.9	Very high	123 Å²	123	40 Å²	40	46%	0.464	18%	0.182	S	C	.	.			trans	-82.6	122.5	174	-166.2	-177.6	178.7	-178	1.1	109.8	V236 T237 E239 V243 I283	V236-R241 WeakPolarHBondContact CA-O 3.49Å; T237-R241 HydrophobicContact CG2-CB 4.2Å; T237-R241 PolarHBondContact N-O 3.41Å; T237-R241 WeakPolarHBondContact OG1-CB 3.47Å; T237-R241 PolarHBondContact OG1-N 3.28Å; T237-R241 VanDerWaalsContact OG1-N 3.15Å; E239-R241 PolarHBondContact O-N 3.28Å; R241-V243 HydrophobicContact CG-CG1 3.93Å; R241-I283 PolarHBondContact NH1-O 2.87Å
242	H	92	Very high	93.1	Very high	117 Å²	117	39.9 Å²	39.9	54%	0.542	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.1	174.3	-60.7	-98.4	0	0	0	109.9	Y234 V236 E240	Y234-H242 HydrophobicContact CE2-CB 4.4Å; Y234-H242 AromaticContact CZ-ND1 3.67Å; Y234-H242 PolarHBondContact OH-ND1 2.97Å; V236-H242 WeakPolarHBondContact CG2-ND1 3.41Å; E240-H242 PolarHBondContact O-CD2 3.41Å; E240-H242 VanDerWaalsContact O-CD2 3.29Å
243	V	91.9	Very high	93.2	Very high	11 Å²	11	40.7 Å²	40.7	7%	0.067	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.9	-178.8	-58.1	0	0	0	0	111.5	I235 R241 V245 L254 I283	I235-V243 HydrophobicContact CB-CG2 3.71Å; I235-V243 HydrophobicContact CG2-CG2 4.26Å; I235-V243 PolarHBondContact N-O 3.44Å; I235-V243 PolarHBondContact O-N 2.94Å; R241-V243 HydrophobicContact CG-CG1 3.93Å; V243-V245 HydrophobicContact CG2-CG2 4.43Å; V243-L254 HydrophobicContact CB-CD2 3.9Å; V243-L254 HydrophobicContact CG1-CD2 4.42Å; V243-L254 HydrophobicContact CG2-CD2 4.18Å; V243-I283 HydrophobicContact CG2-CD1 4.06Å
244	S	93.8	Very high	93.3	Very high	6 Å²	6	41.1 Å²	41.1	4%	0.042	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.4	174.3	-62.2	0	0	0	0	109.1	L233 N255 S257	L233-S244 WeakPolarHBondContact O-CA 3.29Å; S244-N255 WeakPolarHBondContact CB-OD1 3.19Å; S244-N255 PolarHBondContact O-N 2.85Å; S244-S257 VanDerWaalsContact CB-O 3.25Å; S244-S257 WeakPolarHBondContact CB-O 3.49Å; S244-S257 PolarHBondContact OG-O 2.92Å
245	V	95.2	Very high	93.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.9	-177.8	-177.5	0	0	0	0	109.3	Y232 L233 I235 V243 F252 Y253 L254 L276 L279	Y232-V245 CarbonylContact C-O 3.5Å; Y232-V245 WeakPolarHBondContact CA-O 3.35Å; L233-V245 HydrophobicContact CB-CB 4.18Å; L233-V245 PolarHBondContact N-O 3.32Å; L233-V245 PolarHBondContact O-N 3.23Å; I235-V245 HydrophobicContact CD1-CB 4.49Å; I235-V245 HydrophobicContact CD1-CG2 3.63Å; I235-V245 HydrophobicContact CG1-CG2 4.27Å; V243-V245 HydrophobicContact CG2-CG2 4.43Å; V245-F252 HydrophobicContact CG1-CB 4.04Å; V245-F252 HydrophobicContact CG1-CD1 4.26Å; V245-Y253 CarbonylContact C-O 3.39Å; V245-Y253 WeakPolarHBondContact CA-O 3.48Å; V245-Y253 WeakPolarHBondContact CG1-O 3.4Å; V245-L254 HydrophobicContact CG2-CD2 3.98Å; V245-L276 HydrophobicContact CG1-CD1 4.31Å; V245-L279 HydrophobicContact CG1-CD2 3.72Å; V245-L279 HydrophobicContact CG2-CD2 4.31Å
246	T	95.3	Very high	93.4	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	125.2	167.5	-51.6	0	0	0	0	108.6	D229 Y232 F252 Y253 N255	D229-T246 HydrophobicContact CB-CG2 4.08Å; Y232-T246 HydrophobicContact CD1-CG2 3.87Å; Y232-T246 HydrophobicContact CE1-CG2 3.58Å; T246-F252 WeakPolarHBondContact O-CA 3.26Å; T246-Y253 VanDerWaalsContact CB-CZ 3.43Å; T246-Y253 HydrophobicContact CG2-CE1 3.67Å; T246-Y253 PolarHBondContact N-O 3.47Å; T246-Y253 PolarHBondContact O-N 3.42Å; T246-N255 WeakPolarHBondContact OG1-CB 3.37Å; T246-N255 PolarHBondContact OG1-ND2 3.01Å
247	A	95.4	Very high	93.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128.2	161.6	0	0	0	0	0	107.9	A121 L230 M231 F252	A121-A247 HydrophobicContact CB-CB 4.4Å; L230-A247 WeakPolarHBondContact CB-O 3.49Å; L230-A247 PolarHBondContact N-O 3.43Å; M231-A247 HydrophobicContact CG-CB 3.43Å; M231-A247 VanDerWaalsContact CG-CB 3.43Å; M231-A247 PolarHBondContact N-O 2.8Å; M231-A247 PolarHBondContact O-N 3.09Å; M231-A247 HydrophobicContact SD-CB 4.36Å; A247-F252 HydrophobicContact CB-CD1 3.7Å; A247-F252 HydrophobicContact CB-CE1 3.44Å; A247-F252 VanDerWaalsContact CB-CE1 3.44Å; A247-F252 HydrophobicContact CB-CZ 4.26Å
248	S	95.1	Very high	93.2	Very high	11 Å²	11	47.2 Å²	47.2	8%	0.077	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	169.8	-179.6	71	0	0	0	0	110.4	G228 L230 R250 G251	G228-S248 CarbonylContact O-C 3.24Å; G228-S248 WeakPolarHBondContact O-CA 3.45Å; G228-S248 WeakPolarHBondContact O-CB 3.25Å; L230-S248 VanDerWaalsContact CD1-C 3.44Å; L230-S248 WeakPolarHBondContact CD1-O 3.28Å; S248-R250 PolarHBondContact O-N 3.29Å; S248-R250 PolarHBondContact OG-N 2.94Å; S248-G251 WeakPolarHBondContact CA-O 3.49Å; S248-G251 PolarHBondContact N-O 2.89Å; S248-G251 PolarHBondContact O-N 2.78Å; S248-G251 PolarHBondContact OG-O 3.09Å
249	T	94.1	Very high	92.8	Very high	56 Å²	56	48.7 Å²	48.7	34%	0.344	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.1	173.3	55.4	0	0	0	0	113.7	P115 Y116 G228 L230	P115-T249 CarbonylContact C-O 3.5Å; P115-T249 WeakPolarHBondContact CA-O 3.27Å; P115-T249 WeakPolarHBondContact CB-O 3.36Å; Y116-T249 PolarHBondContact N-O 3.48Å; Y116-T249 WeakPolarHBondContact O-CA 3.43Å; G228-T249 PolarHBondContact O-N 2.95Å; L230-T249 HydrophobicContact CD2-CG2 3.97Å; L230-T249 HydrophobicContact CG-CG2 4.44Å
250	R	92.4	Very high	92.6	Very high	191 Å²	191	54.3 Å²	54.3	72%	0.721	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	6.4	179.5	-54.3	-175.9	75.9	-179.7	4.8	113.9	S248	S248-R250 PolarHBondContact O-N 3.29Å; S248-R250 PolarHBondContact OG-N 2.94Å
251	G	93.9	Very high	92.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	111.1	-154.6	-174.5	0	0	0	0	0	113.4	S248	S248-G251 WeakPolarHBondContact CA-O 3.49Å; S248-G251 PolarHBondContact N-O 2.89Å; S248-G251 PolarHBondContact O-N 2.78Å; S248-G251 PolarHBondContact OG-O 3.09Å
252	F	96.3	Very high	92.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.6	-167	-58.3	-95	0	0	0	111.7	Y116 H124 V125 L233 V245 T246 A247 L272 S273 H274 L276 L279	Y116-F252 HydrophobicContact CD2-CE2 4.45Å; Y116-F252 HydrophobicContact CE1-CE2 4.34Å; Y116-F252 AromaticContact CE2-CE2 3.82Å; Y116-F252 HydrophobicContact CE2-CE2 3.82Å; Y116-F252 AromaticContact CZ-CE2 3.76Å; H124-F252 HydrophobicContact CB-CZ 4.49Å; H124-F252 AromaticContact CD2-CE2 3.3Å; H124-F252 WeakPolarHBondContact CD2-CE2 3.48Å; H124-F252 AromaticContact CD2-CZ 3.31Å; H124-F252 WeakPolarHBondContact CD2-CZ 3.37Å; H124-F252 AromaticContact NE2-CE2 3.57Å; V125-F252 HydrophobicContact CG2-CE1 4.15Å; V125-F252 HydrophobicContact CG2-CZ 4.49Å; L233-F252 HydrophobicContact CD1-CD1 4.33Å; L233-F252 HydrophobicContact CD1-CE1 4.27Å; V245-F252 HydrophobicContact CG1-CB 4.04Å; V245-F252 HydrophobicContact CG1-CD1 4.26Å; T246-F252 WeakPolarHBondContact O-CA 3.26Å; A247-F252 HydrophobicContact CB-CD1 3.7Å; A247-F252 HydrophobicContact CB-CE1 3.44Å; A247-F252 VanDerWaalsContact CB-CE1 3.44Å; A247-F252 HydrophobicContact CB-CZ 4.26Å; F252-L272 WeakPolarHBondContact O-CA 3.33Å; F252-S273 PolarHBondContact N-O 3.31Å; F252-S273 PolarHBondContact O-N 3.18Å; F252-H274 WeakPolarHBondContact CD2-O 3.33Å; F252-H274 WeakPolarHBondContact CE2-O 3.42Å; F252-L276 HydrophobicContact CB-CD1 4.46Å; F252-L276 HydrophobicContact CD1-CB 4.16Å; F252-L276 HydrophobicContact CD1-CD1 4.23Å; F252-L276 HydrophobicContact CD2-CB 4.02Å; F252-L276 HydrophobicContact CE1-CB 4.35Å; F252-L276 HydrophobicContact CE2-CB 4.23Å; F252-L276 HydrophobicContact CG-CB 4.01Å; F252-L276 HydrophobicContact CG-CD1 4.38Å; F252-L276 HydrophobicContact CZ-CB 4.41Å; F252-L279 HydrophobicContact CB-CD2 3.79Å
253	Y	95.3	Very high	92.5	Very high	20 Å²	20	45.8 Å²	45.8	8%	0.078	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.5	175.5	70.2	-91.9	0	0	0	113.2	V245 T246 N255 P264 P266 F271 L272	V245-Y253 CarbonylContact C-O 3.39Å; V245-Y253 WeakPolarHBondContact CA-O 3.48Å; V245-Y253 WeakPolarHBondContact CG1-O 3.4Å; T246-Y253 VanDerWaalsContact CB-CZ 3.43Å; T246-Y253 HydrophobicContact CG2-CE1 3.67Å; T246-Y253 PolarHBondContact N-O 3.47Å; T246-Y253 PolarHBondContact O-N 3.42Å; Y253-N255 HydrophobicContact CE2-CB 4.17Å; Y253-P264 PolarHBondContact OH-O 3.22Å; Y253-P266 HydrophobicContact CD2-CB 4.14Å; Y253-P266 HydrophobicContact CD2-CG 4.16Å; Y253-P266 HydrophobicContact CE2-CB 4.23Å; Y253-P266 HydrophobicContact CE2-CG 3.87Å; Y253-F271 VanDerWaalsContact CA-O 3.23Å; Y253-F271 WeakPolarHBondContact CA-O 3.45Å; Y253-F271 WeakPolarHBondContact CB-O 3.37Å; Y253-L272 HydrophobicContact CD1-CD1 4.25Å
254	L	94.4	Very high	92.3	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.8	173.7	-69.8	-172.2	0	0	0	111.1	V243 V245 P266 A267 F271 I283	V243-L254 HydrophobicContact CB-CD2 3.9Å; V243-L254 HydrophobicContact CG1-CD2 4.42Å; V243-L254 HydrophobicContact CG2-CD2 4.18Å; V245-L254 HydrophobicContact CG2-CD2 3.98Å; L254-P266 CarbonylContact O-C 3.5Å; L254-P266 WeakPolarHBondContact O-CA 3.48Å; L254-A267 HydrophobicContact CB-CB 3.77Å; L254-A267 PolarHBondContact O-N 3.31Å; L254-F271 HydrophobicContact CD1-CD2 4.32Å; L254-I283 HydrophobicContact CD1-CB 4.46Å; L254-I283 HydrophobicContact CD1-CD1 4.49Å; L254-I283 HydrophobicContact CD1-CG2 3.71Å; L254-I283 HydrophobicContact CD2-CD1 3.9Å; L254-I283 HydrophobicContact CG-CG2 4.2Å
255	N	92.2	Very high	92.1	Very high	11 Å²	11	52.6 Å²	52.6	6%	0.059	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	169.9	169.9	76.2	33.2	0	0	0	111.8	S244 T246 Y253 S257 K265	S244-N255 WeakPolarHBondContact CB-OD1 3.19Å; S244-N255 PolarHBondContact O-N 2.85Å; T246-N255 WeakPolarHBondContact OG1-CB 3.37Å; T246-N255 PolarHBondContact OG1-ND2 3.01Å; Y253-N255 HydrophobicContact CE2-CB 4.17Å; N255-S257 VanDerWaalsContact C-N 3.26Å; N255-S257 PolarHBondContact O-N 3.18Å; N255-S257 WeakPolarHBondContact OD1-CA 3.26Å; N255-S257 WeakPolarHBondContact OD1-CB 3.38Å; N255-S257 PolarHBondContact OD1-N 2.88Å; N255-S257 PolarHBondContact OD1-OG 3.4Å; N255-S257 VanDerWaalsContact OD1-OG 3.06Å; N255-K265 CarbonylContact C-O 3.54Å; N255-K265 WeakPolarHBondContact CA-O 3Å; N255-K265 WeakPolarHBondContact CB-O 3.41Å
256	Q	92.3	Very high	91.8	Very high	97 Å²	97	55.5 Å²	55.5	45%	0.453	27%	0.274	S	S	.	.	S	Bend	trans	-86.9	10.4	-178	-64.3	175.7	10.4	0	0	113.4	S263 K265 P266	Q256-S263 CarbonylContact C-O 3.37Å; Q256-S263 PolarHBondContact N-O 2.94Å; Q256-S263 VanDerWaalsContact N-O 3.13Å; Q256-K265 WeakPolarHBondContact CG-O 3.49Å; Q256-K265 PolarHBondContact N-O 3.36Å; Q256-P266 PolarHBondContact NE2-O 3.39Å
257	S	92.1	Very high	91.5	Very high	9 Å²	9	56.6 Å²	56.6	6%	0.063	28%	0.282	C	S	.	.			trans	-73.4	143.7	-179	-54.3	0	0	0	0	110.4	S244 N255 T261 S263	S244-S257 VanDerWaalsContact CB-O 3.25Å; S244-S257 WeakPolarHBondContact CB-O 3.49Å; S244-S257 PolarHBondContact OG-O 2.92Å; N255-S257 VanDerWaalsContact C-N 3.26Å; N255-S257 PolarHBondContact O-N 3.18Å; N255-S257 WeakPolarHBondContact OD1-CA 3.26Å; N255-S257 WeakPolarHBondContact OD1-CB 3.38Å; N255-S257 PolarHBondContact OD1-N 2.88Å; N255-S257 PolarHBondContact OD1-OG 3.4Å; N255-S257 VanDerWaalsContact OD1-OG 3.06Å; S257-T261 CarbonylContact C-O 3.53Å; S257-T261 WeakPolarHBondContact CA-O 3.46Å; S257-S263 PolarHBondContact N-O 3.23Å; S257-S263 PolarHBondContact OG-N 2.9Å; S257-S263 PolarHBondContact OG-O 2.97Å
258	T	87.8	Confident	91	Very high	69 Å²	69	64 Å²	64	42%	0.423	32%	0.322	S	S	.	.			trans	-110.9	177.2	169	69.3	0	0	0	0	109.6	W217 Y260 T261	W217-T258 PolarHBondContact NE1-O 2.95Å; T258-Y260 PolarHBondContact O-N 3.02Å; T258-Y260 PolarHBondContact OG1-N 3.29Å; T258-T261 PolarHBondContact N-O 3.17Å; T258-T261 WeakPolarHBondContact OG1-CB 3.34Å; T258-T261 PolarHBondContact OG1-N 3.39Å
259	T	83.4	Confident	90.4	Very high	78 Å²	78	67.3 Å²	67.3	48%	0.479	34%	0.343	S	S	.	.	S	Bend	trans	-56.6	-29.2	173.3	-49.3	0	0	0	0	112.5
260	Y	88.3	Confident	90.1	Very high	206 Å²	206	68.2 Å²	68.2	81%	0.808	35%	0.352	S	S	*	.	S	Bend	trans	-111.7	-20.3	-173.6	-55.1	-68.6	0	0	0	114.2	T258	T258-Y260 PolarHBondContact O-N 3.02Å; T258-Y260 PolarHBondContact OG1-N 3.29Å
261	T	91.5	Very high	89.8	Confident	90 Å²	90	62.1 Å²	62.1	55%	0.552	33%	0.331	S	S	*	.			trans	-126.3	120.3	-175.9	-51	0	0	0	0	110.6	S257 T258	S257-T261 CarbonylContact C-O 3.53Å; S257-T261 WeakPolarHBondContact CA-O 3.46Å; T258-T261 PolarHBondContact N-O 3.17Å; T258-T261 WeakPolarHBondContact OG1-CB 3.34Å; T258-T261 PolarHBondContact OG1-N 3.39Å
262	F	91.3	Very high	89.7	Confident	68 Å²	68	66.2 Å²	66.2	30%	0.298	35%	0.352	S	S	.	.			trans	-81.9	120	176.2	-173.3	-120.6	0	0	0	111.6	W217 P221 Y232 P264	W217-F262 HydrophobicContact CB-CD2 3.66Å; W217-F262 HydrophobicContact CB-CE2 3.79Å; W217-F262 AromaticContact CD1-CD2 3.9Å; W217-F262 HydrophobicContact CD2-CB 3.7Å; W217-F262 AromaticContact CD2-CD2 3.63Å; W217-F262 HydrophobicContact CD2-CD2 3.63Å; W217-F262 AromaticContact CD2-CG 3.95Å; W217-F262 HydrophobicContact CD2-CG 3.95Å; W217-F262 HydrophobicContact CE3-CB 3.7Å; W217-F262 HydrophobicContact CE3-CD2 4.05Å; W217-F262 AromaticContact CE3-CG 3.99Å; W217-F262 HydrophobicContact CE3-CG 3.99Å; W217-F262 HydrophobicContact CG-CB 4.4Å; W217-F262 AromaticContact CG-CD2 3.44Å; W217-F262 HydrophobicContact CG-CD2 3.44Å; W217-F262 VanDerWaalsContact CG-CD2 3.44Å; W217-F262 HydrophobicContact CG-CE2 4.09Å; W217-F262 HydrophobicContact CG-CG 4.25Å; W217-F262 HydrophobicContact CH2-CB 3.85Å; W217-F262 HydrophobicContact CZ2-CB 3.84Å; W217-F262 HydrophobicContact CZ3-CB 3.77Å; W217-F262 HydrophobicContact CZ3-CG 4.49Å; P221-F262 HydrophobicContact CG-CE1 4.39Å; Y232-F262 HydrophobicContact CD2-CE2 4.04Å; Y232-F262 HydrophobicContact CD2-CZ 4.47Å; Y232-F262 AromaticContact CE2-CE2 3.57Å; Y232-F262 HydrophobicContact CE2-CE2 3.57Å; Y232-F262 AromaticContact CE2-CZ 3.57Å; Y232-F262 HydrophobicContact CE2-CZ 3.57Å; Y232-F262 AromaticContact CZ-CE2 3.9Å; Y232-F262 AromaticContact CZ-CZ 3.71Å; F262-P264 HydrophobicContact CE1-CB 4.29Å; F262-P264 HydrophobicContact CE1-CG 3.8Å; F262-P264 HydrophobicContact CE2-CB 4.21Å; F262-P264 HydrophobicContact CZ-CB 3.77Å; F262-P264 HydrophobicContact CZ-CG 3.81Å
263	S	90.9	Very high	89.6	Confident	30 Å²	30	66.6 Å²	66.6	21%	0.21	36%	0.355	C	S	.	.			trans	-144.6	93.1	173.2	-175.2	0	0	0	0	109.8	Q256 S257 K265	Q256-S263 CarbonylContact C-O 3.37Å; Q256-S263 PolarHBondContact N-O 2.94Å; Q256-S263 VanDerWaalsContact N-O 3.13Å; S257-S263 PolarHBondContact N-O 3.23Å; S257-S263 PolarHBondContact OG-N 2.9Å; S257-S263 PolarHBondContact OG-O 2.97Å; S263-K265 PolarHBondContact O-N 3.33Å; S263-K265 VanDerWaalsContact O-N 3.12Å
264	P	87.4	Confident	89.5	Confident	20 Å²	20	66.6 Å²	66.6	13%	0.13	36%	0.356	C	S	.	.			trans	-77.3	5	-172.8	31.3	-35.8	0	0	0	113.8	R224 Y232 Y253 F262	R224-P264 HydrophobicContact CG-CG 4.31Å; Y232-P264 HydrophobicContact CE1-CB 4.49Å; Y253-P264 PolarHBondContact OH-O 3.22Å; F262-P264 HydrophobicContact CE1-CB 4.29Å; F262-P264 HydrophobicContact CE1-CG 3.8Å; F262-P264 HydrophobicContact CE2-CB 4.21Å; F262-P264 HydrophobicContact CZ-CB 3.77Å; F262-P264 HydrophobicContact CZ-CG 3.81Å
265	K	88.9	Confident	89.5	Confident	140 Å²	140	66.2 Å²	66.2	61%	0.609	35%	0.354	S	S	*	.	S	Bend	trans	-67.9	143.8	177.4	-67.6	-175.7	179.7	179.7	0	110.3	N255 Q256 S263	N255-K265 CarbonylContact C-O 3.54Å; N255-K265 WeakPolarHBondContact CA-O 3Å; N255-K265 WeakPolarHBondContact CB-O 3.41Å; Q256-K265 WeakPolarHBondContact CG-O 3.49Å; Q256-K265 PolarHBondContact N-O 3.36Å; S263-K265 PolarHBondContact O-N 3.33Å; S263-K265 VanDerWaalsContact O-N 3.12Å
266	P	90.3	Very high	89.6	Confident	62 Å²	62	65.7 Å²	65.7	40%	0.403	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-53.8	140.3	173.7	-25.7	34	0	0	0	112.3	Y253 L254 Q256	Y253-P266 HydrophobicContact CD2-CB 4.14Å; Y253-P266 HydrophobicContact CD2-CG 4.16Å; Y253-P266 HydrophobicContact CE2-CB 4.23Å; Y253-P266 HydrophobicContact CE2-CG 3.87Å; L254-P266 CarbonylContact O-C 3.5Å; L254-P266 WeakPolarHBondContact O-CA 3.48Å; Q256-P266 PolarHBondContact NE2-O 3.39Å
267	A	88.9	Confident	89.7	Confident	22 Å²	22	61.3 Å²	61.3	18%	0.182	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-66.7	163.3	173.6	0	0	0	0	0	111.2	L254 P269 S270	L254-A267 HydrophobicContact CB-CB 3.77Å; L254-A267 PolarHBondContact O-N 3.31Å; A267-P269 CarbonylContact C-O 3.59Å; A267-P269 CarbonylContact O-C 3.41Å; A267-P269 VanDerWaalsContact O-C 3.24Å; A267-S270 WeakPolarHBondContact O-CA 3.46Å; A267-S270 WeakPolarHBondContact O-CB 3.38Å; A267-S270 PolarHBondContact O-N 2.93Å
268	N	84.4	Confident	89.7	Confident	156 Å²	156	63.3 Å²	63.3	83%	0.834	34%	0.339	S	S	*	.	S	Bend	trans	-118.3	120.4	173.4	-169.4	13.3	0	0	0	109.1
269	P	83.2	Confident	90.1	Very high	80 Å²	80	60 Å²	60	52%	0.519	32%	0.319	S	S	.	.	S	Bend	cis	-64.7	147.9	-3.2	26.8	-34	0	0	0	113.4	A267 F271	A267-P269 CarbonylContact C-O 3.59Å; A267-P269 CarbonylContact O-C 3.41Å; A267-P269 VanDerWaalsContact O-C 3.24Å; P269-F271 HydrophobicContact CB-CE2 4.19Å; P269-F271 HydrophobicContact CB-CZ 4.12Å; P269-F271 HydrophobicContact CG-CE2 3.6Å; P269-F271 HydrophobicContact CG-CZ 3.63Å
270	S	86	Confident	90.6	Very high	76 Å²	76	56.3 Å²	56.3	53%	0.531	30%	0.296	S	S	.	.			trans	-87.3	116.7	179.7	179.3	0	0	0	0	110	A267	A267-S270 WeakPolarHBondContact O-CA 3.46Å; A267-S270 WeakPolarHBondContact O-CB 3.38Å; A267-S270 PolarHBondContact O-N 2.93Å
271	F	87.1	Confident	90.9	Very high	63 Å²	63	47.9 Å²	47.9	28%	0.276	27%	0.268	S	S	.	.			trans	-109.1	123.9	172.8	-58	-75.9	0	0	0	108.9	Y253 L254 P269 L279 Q282 I283	Y253-F271 VanDerWaalsContact CA-O 3.23Å; Y253-F271 WeakPolarHBondContact CA-O 3.45Å; Y253-F271 WeakPolarHBondContact CB-O 3.37Å; L254-F271 HydrophobicContact CD1-CD2 4.32Å; P269-F271 HydrophobicContact CB-CE2 4.19Å; P269-F271 HydrophobicContact CB-CZ 4.12Å; P269-F271 HydrophobicContact CG-CE2 3.6Å; P269-F271 HydrophobicContact CG-CZ 3.63Å; F271-L279 HydrophobicContact CB-CD1 3.58Å; F271-Q282 HydrophobicContact CD1-CB 4.48Å; F271-I283 HydrophobicContact CD2-CG2 3.95Å; F271-I283 HydrophobicContact CE2-CG2 4.37Å; F271-I283 HydrophobicContact CG-CG2 4.42Å
272	L	91.7	Very high	91	Very high	85 Å²	85	48.4 Å²	48.4	45%	0.445	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.2	172.5	175.3	67.4	0	0	0	107.5	F252 Y253	F252-L272 WeakPolarHBondContact O-CA 3.33Å; Y253-L272 HydrophobicContact CD1-CD1 4.25Å
273	S	93.9	Very high	91	Very high	9 Å²	9	45.6 Å²	45.6	6%	0.063	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147.4	175.7	-53.5	0	0	0	0	109.7	F252 Q282	F252-S273 PolarHBondContact N-O 3.31Å; F252-S273 PolarHBondContact O-N 3.18Å; S273-Q282 PolarHBondContact OG-NE2 3.09Å
274	H	94.2	Very high	91.2	Very high	19 Å²	19	44.2 Å²	44.2	9%	0.088	24%	0.242	C	C	.	.	S	Bend	trans	-70.1	-39.7	-179.7	-170	61.7	0	0	0	111.6	C81 E113 E114 Y116 F252	C81-H274 PolarHBondContact O-NE2 2.83Å; E113-H274 HydrophobicContact CG-CB 4.36Å; E113-H274 WeakPolarHBondContact CG-CD2 3.37Å; E113-H274 WeakPolarHBondContact OE1-CB 3.5Å; E113-H274 IonicContact OE1-CD2 2.7Å; E113-H274 IonicContact OE1-CG 3.42Å; E113-H274 WeakPolarHBondContact OE2-CB 3.27Å; E113-H274 IonicContact OE2-CD2 2.71Å; E113-H274 IonicContact OE2-CG 2.78Å; E114-H274 PolarHBondContact O-CE1 2.88Å; Y116-H274 AromaticContact CD2-CE1 3.71Å; Y116-H274 AromaticContact CE2-CE1 3.21Å; Y116-H274 WeakPolarHBondContact CE2-CE1 3.31Å; Y116-H274 AromaticContact CE2-ND1 3.49Å; Y116-H274 WeakPolarHBondContact CE2-ND1 3.45Å; Y116-H274 AromaticContact CE2-NE2 3.66Å; Y116-H274 WeakPolarHBondContact CE2-O 3.19Å; Y116-H274 AromaticContact CZ-CE1 3.97Å; Y116-H274 AromaticContact CZ-NE2 3.97Å; Y116-H274 PolarHBondContact OH-O 3.04Å; Y116-H274 VanDerWaalsContact OH-O 3.07Å; F252-H274 WeakPolarHBondContact CD2-O 3.33Å; F252-H274 WeakPolarHBondContact CE2-O 3.42Å
275	S	93.5	Very high	91.5	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.007	27%	0.265	C	S	.	.	S	Bend	trans	-93.4	139.3	172.5	179.1	0	0	0	0	111.9	H78 V277 E278 L279	H78-S275 PolarHBondContact CD2-OG 2.81Å; H78-S275 PolarHBondContact O-OG 3.29Å; S275-V277 VanDerWaalsContact C-N 3.27Å; S275-V277 PolarHBondContact O-N 3.41Å; S275-V277 PolarHBondContact OG-N 2.9Å; S275-E278 PolarHBondContact O-N 3.46Å; S275-L279 PolarHBondContact O-N 3.04Å
276	L	94.6	Very high	91.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-32.2	172.4	172.4	66.3	0	0	0	111.6	H124 V125 I128 L212 L233 I235 V245 F252 E278 L279 L280	H124-L276 PolarHBondContact NE2-N 2.88Å; V125-L276 HydrophobicContact CG2-CD2 4.29Å; I128-L276 HydrophobicContact CD1-CB 3.59Å; I128-L276 HydrophobicContact CD1-CD2 4.11Å; I128-L276 HydrophobicContact CD1-CG 4.18Å; L212-L276 HydrophobicContact CD1-CD2 4.18Å; L212-L276 HydrophobicContact CD2-CD2 4.34Å; L233-L276 HydrophobicContact CD1-CD1 4.46Å; L233-L276 HydrophobicContact CD1-CD2 4.04Å; I235-L276 HydrophobicContact CD1-CD1 4.08Å; V245-L276 HydrophobicContact CG1-CD1 4.31Å; F252-L276 HydrophobicContact CB-CD1 4.46Å; F252-L276 HydrophobicContact CD1-CB 4.16Å; F252-L276 HydrophobicContact CD1-CD1 4.23Å; F252-L276 HydrophobicContact CD2-CB 4.02Å; F252-L276 HydrophobicContact CE1-CB 4.35Å; F252-L276 HydrophobicContact CE2-CB 4.23Å; F252-L276 HydrophobicContact CG-CB 4.01Å; F252-L276 HydrophobicContact CG-CD1 4.38Å; F252-L276 HydrophobicContact CZ-CB 4.41Å; L276-E278 PolarHBondContact O-N 3.38Å; L276-L279 HydrophobicContact CD1-CD2 4.44Å; L276-L279 PolarHBondContact O-N 2.94Å; L276-L280 HydrophobicContact CD1-CD1 4.2Å; L276-L280 HydrophobicContact CD1-CG 4.08Å; L276-L280 HydrophobicContact CG-CD1 3.93Å; L276-L280 HydrophobicContact CG-CG 4.28Å; L276-L280 WeakPolarHBondContact O-CB 3.36Å; L276-L280 WeakPolarHBondContact O-CG 3.33Å; L276-L280 PolarHBondContact O-N 3.12Å
277	V	94.1	Very high	92	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.03	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-38.9	176.9	173.6	0	0	0	0	111.5	H78 I128 S275 L280 S281 F287 F291	H78-V277 HydrophobicContact CB-CB 3.74Å; H78-V277 HydrophobicContact CB-CG1 4.07Å; H78-V277 HydrophobicContact CB-CG2 3.64Å; I128-V277 HydrophobicContact CD1-CG2 3.76Å; I128-V277 HydrophobicContact CG1-CG2 3.86Å; I128-V277 HydrophobicContact CG2-CG2 4.01Å; S275-V277 VanDerWaalsContact C-N 3.27Å; S275-V277 PolarHBondContact O-N 3.41Å; S275-V277 PolarHBondContact OG-N 2.9Å; V277-L280 PolarHBondContact O-N 3.03Å; V277-S281 VanDerWaalsContact O-CB 3.29Å; V277-S281 WeakPolarHBondContact O-CB 3.49Å; V277-S281 PolarHBondContact O-N 2.97Å; V277-S281 PolarHBondContact O-OG 2.94Å; V277-F287 HydrophobicContact CG1-CE1 4Å; V277-F287 HydrophobicContact CG1-CZ 4.34Å; V277-F291 HydrophobicContact CG1-CD1 3.77Å; V277-F291 HydrophobicContact CG1-CE1 3.47Å; V277-F291 VanDerWaalsContact CG1-CE1 3.47Å; V277-F291 HydrophobicContact CG1-CE2 4.44Å; V277-F291 HydrophobicContact CG1-CG 4.37Å; V277-F291 HydrophobicContact CG1-CZ 3.85Å; V277-F291 HydrophobicContact CG2-CE2 4.4Å; V277-F291 HydrophobicContact CG2-CZ 4.12Å
278	E	93.3	Very high	92.2	Very high	51 Å²	51	44 Å²	44	24%	0.238	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-47.2	176.3	-70.4	175.7	163.1	0	0	110.8	R79 S275 L276 L280 S281 Q282	R79-E278 IonicContact CZ-OE1 3Å; R79-E278 IonicContact NH1-OE1 3.68Å; R79-E278 IonicContact NH2-OE1 3.64Å; R79-E278 PolarHBondContact NH2-OE1 3.33Å; S275-E278 PolarHBondContact O-N 3.46Å; L276-E278 PolarHBondContact O-N 3.38Å; E278-L280 VanDerWaalsContact C-N 3.34Å; E278-L280 PolarHBondContact O-N 3.42Å; E278-S281 PolarHBondContact O-N 3.45Å; E278-Q282 WeakPolarHBondContact O-CG 3.38Å; E278-Q282 PolarHBondContact O-N 3.43Å
279	L	95.1	Very high	92.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.2	-48.5	175	178.4	67.7	0	0	0	110.7	V245 F252 F271 S275 L276 S281 Q282 I283	V245-L279 HydrophobicContact CG1-CD2 3.72Å; V245-L279 HydrophobicContact CG2-CD2 4.31Å; F252-L279 HydrophobicContact CB-CD2 3.79Å; F271-L279 HydrophobicContact CB-CD1 3.58Å; S275-L279 PolarHBondContact O-N 3.04Å; L276-L279 HydrophobicContact CD1-CD2 4.44Å; L276-L279 PolarHBondContact O-N 2.94Å; L279-S281 VanDerWaalsContact C-N 3.31Å; L279-S281 PolarHBondContact O-N 3.43Å; L279-Q282 PolarHBondContact O-N 3.46Å; L279-Q282 VanDerWaalsContact O-N 3.17Å; L279-I283 HydrophobicContact CD1-CG2 4.33Å; L279-I283 WeakPolarHBondContact O-CG1 3.12Å; L279-I283 WeakPolarHBondContact O-CG2 3.5Å; L279-I283 PolarHBondContact O-N 2.91Å; L279-I283 VanDerWaalsContact O-N 3.13Å
280	L	94.8	Very high	93.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-39.6	179.5	-73	173.8	0	0	0	112.5	L209 I235 L276 V277 E278 Q282 I283 S284 F287	L209-L280 HydrophobicContact CD1-CD1 3.88Å; L209-L280 HydrophobicContact CD2-CD2 4.34Å; I235-L280 HydrophobicContact CD1-CD2 3.83Å; I235-L280 HydrophobicContact CG2-CD2 4.08Å; L276-L280 HydrophobicContact CD1-CD1 4.2Å; L276-L280 HydrophobicContact CD1-CG 4.08Å; L276-L280 HydrophobicContact CG-CD1 3.93Å; L276-L280 HydrophobicContact CG-CG 4.28Å; L276-L280 WeakPolarHBondContact O-CB 3.36Å; L276-L280 WeakPolarHBondContact O-CG 3.33Å; L276-L280 PolarHBondContact O-N 3.12Å; V277-L280 PolarHBondContact O-N 3.03Å; E278-L280 VanDerWaalsContact C-N 3.34Å; E278-L280 PolarHBondContact O-N 3.42Å; L280-Q282 VanDerWaalsContact C-N 3.29Å; L280-Q282 PolarHBondContact O-N 3.44Å; L280-I283 HydrophobicContact CD2-CD1 4.02Å; L280-I283 WeakPolarHBondContact O-CG1 3.28Å; L280-I283 PolarHBondContact O-N 3.15Å; L280-S284 PolarHBondContact O-N 2.91Å; L280-F287 HydrophobicContact CB-CD1 3.53Å; L280-F287 HydrophobicContact CB-CD2 4.32Å; L280-F287 HydrophobicContact CB-CE1 3.47Å; L280-F287 VanDerWaalsContact CB-CE1 3.47Å; L280-F287 HydrophobicContact CB-CE2 4.28Å; L280-F287 HydrophobicContact CB-CG 3.97Å; L280-F287 HydrophobicContact CB-CZ 3.87Å; L280-F287 HydrophobicContact CD1-CD2 4.39Å; L280-F287 HydrophobicContact CD1-CE1 4.21Å; L280-F287 HydrophobicContact CD1-CE2 3.81Å; L280-F287 HydrophobicContact CD1-CZ 3.71Å; L280-F287 HydrophobicContact CG-CZ 4.47Å
281	S	94	Very high	93.4	Very high	29 Å²	29	39.3 Å²	39.3	20%	0.203	20%	0.199	C	C	.	.	H	α-helix	trans	-68.5	-27	177.7	-62.4	0	0	0	0	113.1	V277 E278 L279	V277-S281 VanDerWaalsContact O-CB 3.29Å; V277-S281 WeakPolarHBondContact O-CB 3.49Å; V277-S281 PolarHBondContact O-N 2.97Å; V277-S281 PolarHBondContact O-OG 2.94Å; E278-S281 PolarHBondContact O-N 3.45Å; L279-S281 VanDerWaalsContact C-N 3.31Å; L279-S281 PolarHBondContact O-N 3.43Å
282	Q	92.6	Very high	93.6	Very high	101 Å²	101	38.9 Å²	38.9	47%	0.472	20%	0.201	S	C	.	.	H	α-helix	trans	-77	-35.2	173.6	-69.5	173.6	25.2	0	0	112.3	F271 S273 E278 L279 L280	F271-Q282 HydrophobicContact CD1-CB 4.48Å; S273-Q282 PolarHBondContact OG-NE2 3.09Å; E278-Q282 WeakPolarHBondContact O-CG 3.38Å; E278-Q282 PolarHBondContact O-N 3.43Å; L279-Q282 PolarHBondContact O-N 3.46Å; L279-Q282 VanDerWaalsContact O-N 3.17Å; L280-Q282 VanDerWaalsContact C-N 3.29Å; L280-Q282 PolarHBondContact O-N 3.44Å
283	I	92.4	Very high	93.5	Very high	9 Å²	9	37 Å²	37	5%	0.046	20%	0.195	C	C	.	.	H	α-helix	trans	-94.3	-18.3	-172.3	70.2	174.4	0	0	0	114.3	R241 V243 L254 F271 L279 L280	R241-I283 PolarHBondContact NH1-O 2.87Å; V243-I283 HydrophobicContact CG2-CD1 4.06Å; L254-I283 HydrophobicContact CD1-CB 4.46Å; L254-I283 HydrophobicContact CD1-CD1 4.49Å; L254-I283 HydrophobicContact CD1-CG2 3.71Å; L254-I283 HydrophobicContact CD2-CD1 3.9Å; L254-I283 HydrophobicContact CG-CG2 4.2Å; F271-I283 HydrophobicContact CD2-CG2 3.95Å; F271-I283 HydrophobicContact CE2-CG2 4.37Å; F271-I283 HydrophobicContact CG-CG2 4.42Å; L279-I283 HydrophobicContact CD1-CG2 4.33Å; L279-I283 WeakPolarHBondContact O-CG1 3.12Å; L279-I283 WeakPolarHBondContact O-CG2 3.5Å; L279-I283 PolarHBondContact O-N 2.91Å; L279-I283 VanDerWaalsContact O-N 3.13Å; L280-I283 HydrophobicContact CD2-CD1 4.02Å; L280-I283 WeakPolarHBondContact O-CG1 3.28Å; L280-I283 PolarHBondContact O-N 3.15Å
284	S	94.6	Very high	93.3	Very high	1 Å²	1	37 Å²	37	1%	0.007	19%	0.194	C	C	.	.			trans	-136.7	108.5	179.5	-177.2	0	0	0	0	111.8	E239 L280 A286 F287 K288	E239-S284 PolarHBondContact OE2-OG 2.88Å; L280-S284 PolarHBondContact O-N 2.91Å; S284-A286 VanDerWaalsContact C-N 3.28Å; S284-A286 PolarHBondContact O-N 3.04Å; S284-F287 PolarHBondContact O-N 2.74Å; S284-F287 PolarHBondContact OG-N 2.92Å; S284-K288 PolarHBondContact O-N 2.96Å
285	P	93.9	Very high	92.9	Very high	95 Å²	95	37.4 Å²	37.4	62%	0.617	20%	0.196	S	C	*	.	H	α-helix	trans	-58.8	-37.7	173	-24.8	34.4	0	0	0	113.1	E239 K288 K289	E239-P285 WeakPolarHBondContact OE1-CD 3.15Å; P285-K288 PolarHBondContact O-N 3.42Å; P285-K289 PolarHBondContact O-N 3.27Å
286	A	94.1	Very high	92.6	Very high	21 Å²	21	43 Å²	43	17%	0.174	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-43.4	175.8	0	0	0	0	0	112.4	E239 S284 K289 N290	E239-A286 HydrophobicContact CG-CB 3.76Å; E239-A286 VanDerWaalsContact OE1-CB 3.28Å; E239-A286 WeakPolarHBondContact OE1-CB 3.43Å; E239-A286 PolarHBondContact OE1-N 3.5Å; E239-A286 VanDerWaalsContact OE1-N 3.12Å; S284-A286 VanDerWaalsContact C-N 3.28Å; S284-A286 PolarHBondContact O-N 3.04Å; A286-K289 PolarHBondContact O-N 3.44Å; A286-N290 WeakPolarHBondContact O-CB 3.26Å; A286-N290 VanDerWaalsContact O-CG 3.32Å; A286-N290 PolarHBondContact O-N 3.46Å
287	F	94.8	Very high	92	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-50.4	175.2	178.6	-91.5	0	0	0	110.9	L132 C208 L209 V277 L280 S284 K289 N290 F291	L132-F287 HydrophobicContact CD2-CE2 4.17Å; C208-F287 HydrophobicContact CB-CD2 3.82Å; C208-F287 HydrophobicContact CB-CE2 3.84Å; C208-F287 WeakPolarHBondContact O-CD2 3.32Å; L209-F287 HydrophobicContact CD1-CD2 4.33Å; L209-F287 HydrophobicContact CD1-CE2 4.02Å; L209-F287 HydrophobicContact CD2-CD2 3.56Å; L209-F287 HydrophobicContact CD2-CE2 4.12Å; L209-F287 HydrophobicContact CD2-CG 4.42Å; L209-F287 HydrophobicContact CG-CD2 3.66Å; L209-F287 HydrophobicContact CG-CE2 3.79Å; V277-F287 HydrophobicContact CG1-CE1 4Å; V277-F287 HydrophobicContact CG1-CZ 4.34Å; L280-F287 HydrophobicContact CB-CD1 3.53Å; L280-F287 HydrophobicContact CB-CD2 4.32Å; L280-F287 HydrophobicContact CB-CE1 3.47Å; L280-F287 VanDerWaalsContact CB-CE1 3.47Å; L280-F287 HydrophobicContact CB-CE2 4.28Å; L280-F287 HydrophobicContact CB-CG 3.97Å; L280-F287 HydrophobicContact CB-CZ 3.87Å; L280-F287 HydrophobicContact CD1-CD2 4.39Å; L280-F287 HydrophobicContact CD1-CE1 4.21Å; L280-F287 HydrophobicContact CD1-CE2 3.81Å; L280-F287 HydrophobicContact CD1-CZ 3.71Å; L280-F287 HydrophobicContact CG-CZ 4.47Å; S284-F287 PolarHBondContact O-N 2.74Å; S284-F287 PolarHBondContact OG-N 2.92Å; F287-K289 VanDerWaalsContact C-N 3.32Å; F287-K289 PolarHBondContact O-N 3.25Å; F287-N290 PolarHBondContact O-N 2.92Å; F287-F291 HydrophobicContact CD1-CB 4.43Å; F287-F291 HydrophobicContact CE1-CB 4.09Å; F287-F291 HydrophobicContact CE1-CG 4.24Å; F287-F291 HydrophobicContact CZ-CB 4.22Å; F287-F291 HydrophobicContact CZ-CD2 4.03Å; F287-F291 HydrophobicContact CZ-CG 4.17Å; F287-F291 VanDerWaalsContact O-CB 3.26Å; F287-F291 WeakPolarHBondContact O-CB 3.36Å; F287-F291 PolarHBondContact O-N 2.69Å
288	K	94.5	Very high	91.5	Very high	124 Å²	124	48.5 Å²	48.5	54%	0.539	24%	0.244	S	C	.	.	H	α-helix	trans	-55.1	-47.1	179.6	-175	176.2	-178.9	174.8	0	111.8	S284 P285 T292	S284-K288 PolarHBondContact O-N 2.96Å; P285-K288 PolarHBondContact O-N 3.42Å; K288-T292 WeakPolarHBondContact O-CB 3.42Å; K288-T292 PolarHBondContact O-N 2.97Å; K288-T292 VanDerWaalsContact O-N 3.1Å; K288-T292 PolarHBondContact O-OG1 2.73Å
289	K	94.4	Very high	90.9	Very high	161 Å²	161	50 Å²	50	70%	0.7	26%	0.256	S	S	*	.	H	α-helix	trans	-62.6	-49.3	178.2	-177.2	-174	175.9	-174.1	0	111.8	P285 A286 F287 S293	P285-K289 PolarHBondContact O-N 3.27Å; A286-K289 PolarHBondContact O-N 3.44Å; F287-K289 VanDerWaalsContact C-N 3.32Å; F287-K289 PolarHBondContact O-N 3.25Å; K289-S293 PolarHBondContact O-N 2.93Å; K289-S293 VanDerWaalsContact O-N 3.1Å
290	N	92.9	Very high	90.1	Very high	45 Å²	45	57.6 Å²	57.6	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-69.6	-41.3	-175.3	-70.4	-1	0	0	0	111.7	Q207 C208 A286 F287 S293 L294	Q207-N290 PolarHBondContact O-ND2 3.21Å; C208-N290 HydrophobicContact CB-CB 4.43Å; A286-N290 WeakPolarHBondContact O-CB 3.26Å; A286-N290 VanDerWaalsContact O-CG 3.32Å; A286-N290 PolarHBondContact O-N 3.46Å; F287-N290 PolarHBondContact O-N 2.92Å; N290-S293 CarbonylContact O-C 3.55Å; N290-S293 WeakPolarHBondContact O-CB 3.35Å; N290-S293 PolarHBondContact O-N 3.29Å; N290-L294 WeakPolarHBondContact O-CB 3.47Å; N290-L294 PolarHBondContact O-N 3.25Å
291	F	91.6	Very high	89.3	Confident	7 Å²	7	60.5 Å²	60.5	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-41.8	177.2	-170.3	-99.6	0	0	0	111.9	L132 V277 F287 S293 L294 Q295	L132-F291 HydrophobicContact CD2-CD2 3.75Å; L132-F291 HydrophobicContact CD2-CE2 4.03Å; V277-F291 HydrophobicContact CG1-CD1 3.77Å; V277-F291 HydrophobicContact CG1-CE1 3.47Å; V277-F291 VanDerWaalsContact CG1-CE1 3.47Å; V277-F291 HydrophobicContact CG1-CE2 4.44Å; V277-F291 HydrophobicContact CG1-CG 4.37Å; V277-F291 HydrophobicContact CG1-CZ 3.85Å; V277-F291 HydrophobicContact CG2-CE2 4.4Å; V277-F291 HydrophobicContact CG2-CZ 4.12Å; F287-F291 HydrophobicContact CD1-CB 4.43Å; F287-F291 HydrophobicContact CE1-CB 4.09Å; F287-F291 HydrophobicContact CE1-CG 4.24Å; F287-F291 HydrophobicContact CZ-CB 4.22Å; F287-F291 HydrophobicContact CZ-CD2 4.03Å; F287-F291 HydrophobicContact CZ-CG 4.17Å; F287-F291 VanDerWaalsContact O-CB 3.26Å; F287-F291 WeakPolarHBondContact O-CB 3.36Å; F287-F291 PolarHBondContact O-N 2.69Å; F291-S293 VanDerWaalsContact C-N 3.28Å; F291-S293 PolarHBondContact O-N 3.41Å; F291-L294 HydrophobicContact CD2-CD2 4.32Å; F291-L294 WeakPolarHBondContact O-CA 3.3Å; F291-L294 WeakPolarHBondContact O-CB 3.49Å; F291-L294 PolarHBondContact O-N 2.7Å; F291-L294 VanDerWaalsContact O-N 3.09Å; F291-Q295 HydrophobicContact CD1-CG 4.19Å; F291-Q295 VanDerWaalsContact CD1-OE1 3.31Å; F291-Q295 HydrophobicContact CE1-CG 3.87Å; F291-Q295 HydrophobicContact CZ-CG 4.29Å; F291-Q295 WeakPolarHBondContact O-CG 3.49Å; F291-Q295 PolarHBondContact O-N 3.19Å
292	T	91.2	Very high	88.9	Confident	53 Å²	53	61 Å²	61	33%	0.325	30%	0.302	S	S	.	.	H	α-helix	trans	-60.8	-38.9	173.1	-53.5	0	0	0	0	111.4	K288 K296	K288-T292 WeakPolarHBondContact O-CB 3.42Å; K288-T292 PolarHBondContact O-N 2.97Å; K288-T292 VanDerWaalsContact O-N 3.1Å; K288-T292 PolarHBondContact O-OG1 2.73Å; T292-K296 WeakPolarHBondContact O-CG 3.44Å; T292-K296 PolarHBondContact O-N 3.21Å; T292-K296 VanDerWaalsContact O-N 3.13Å
293	S	89.5	Confident	88.4	Confident	46 Å²	46	59.4 Å²	59.4	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-35.6	175.1	-173.2	0	0	0	0	112.1	M206 K289 N290 F291 K297	M206-S293 PolarHBondContact SD-OG 3.07Å; K289-S293 PolarHBondContact O-N 2.93Å; K289-S293 VanDerWaalsContact O-N 3.1Å; N290-S293 CarbonylContact O-C 3.55Å; N290-S293 WeakPolarHBondContact O-CB 3.35Å; N290-S293 PolarHBondContact O-N 3.29Å; F291-S293 VanDerWaalsContact C-N 3.28Å; F291-S293 PolarHBondContact O-N 3.41Å; S293-K297 WeakPolarHBondContact O-CG 3.44Å; S293-K297 PolarHBondContact O-N 3.14Å
294	L	88.4	Confident	88.2	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-49	175.9	-176.5	68.8	0	0	0	111.2	L131 L132 L135 M206 N290 F291 K296 K297 R298	L131-L294 WeakPolarHBondContact O-CD2 3.47Å; L132-L294 HydrophobicContact CD2-CD2 4.2Å; L135-L294 HydrophobicContact CD1-CD1 3.64Å; L135-L294 HydrophobicContact CG-CD1 3.93Å; M206-L294 HydrophobicContact CE-CB 3.86Å; M206-L294 HydrophobicContact CE-CD1 3.94Å; M206-L294 VanDerWaalsContact CE-N 3.35Å; N290-L294 WeakPolarHBondContact O-CB 3.47Å; N290-L294 PolarHBondContact O-N 3.25Å; F291-L294 HydrophobicContact CD2-CD2 4.32Å; F291-L294 WeakPolarHBondContact O-CA 3.3Å; F291-L294 WeakPolarHBondContact O-CB 3.49Å; F291-L294 PolarHBondContact O-N 2.7Å; F291-L294 VanDerWaalsContact O-N 3.09Å; L294-K296 PolarHBondContact O-N 3.1Å; L294-K297 PolarHBondContact O-N 3.07Å; L294-R298 WeakPolarHBondContact O-CB 3.49Å; L294-R298 PolarHBondContact O-N 3.14Å
295	Q	87.4	Confident	87.7	Confident	28 Å²	28	61.5 Å²	61.5	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-54.5	-51.1	174	-77.6	174.3	-60.1	0	0	111.5	E74 F291 K297 R298 V299	E74-Q295 HydrophobicContact CG-CB 3.9Å; E74-Q295 HydrophobicContact CG-CG 4.35Å; E74-Q295 PolarHBondContact O-NE2 2.91Å; F291-Q295 HydrophobicContact CD1-CG 4.19Å; F291-Q295 VanDerWaalsContact CD1-OE1 3.31Å; F291-Q295 HydrophobicContact CE1-CG 3.87Å; F291-Q295 HydrophobicContact CZ-CG 4.29Å; F291-Q295 WeakPolarHBondContact O-CG 3.49Å; F291-Q295 PolarHBondContact O-N 3.19Å; Q295-K297 PolarHBondContact O-N 3.07Å; Q295-R298 WeakPolarHBondContact O-CB 3.4Å; Q295-R298 PolarHBondContact O-N 3.29Å; Q295-R298 VanDerWaalsContact O-N 3.09Å; Q295-V299 WeakPolarHBondContact O-CG2 3.5Å; Q295-V299 PolarHBondContact O-N 3.47Å
296	K	86.4	Confident	87	Confident	118 Å²	118	60.4 Å²	60.4	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-57.5	-44.2	177.2	-73.6	176.2	-179.5	-177.8	0	113.4	T292 L294 V299 Q300	T292-K296 WeakPolarHBondContact O-CG 3.44Å; T292-K296 PolarHBondContact O-N 3.21Å; T292-K296 VanDerWaalsContact O-N 3.13Å; L294-K296 PolarHBondContact O-N 3.1Å; K296-V299 PolarHBondContact O-N 2.99Å; K296-Q300 WeakPolarHBondContact O-CG 3.41Å; K296-Q300 PolarHBondContact O-N 3.13Å; K296-Q300 VanDerWaalsContact O-N 3.15Å
297	K	83.1	Confident	86.5	Confident	95 Å²	95	62.3 Å²	62.3	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-68.4	-34.8	176.9	-73.8	-167.3	-172.7	177.4	0	112.3	L135 M206 S293 L294 Q295 V299 Q300 R301	L135-K297 HydrophobicContact CD1-CB 3.64Å; L135-K297 HydrophobicContact CD1-CD 4.48Å; M206-K297 HydrophobicContact CE-CB 4.39Å; M206-K297 HydrophobicContact CE-CD 3.61Å; M206-K297 HydrophobicContact CE-CG 4.16Å; M206-K297 HydrophobicContact SD-CD 4.07Å; S293-K297 WeakPolarHBondContact O-CG 3.44Å; S293-K297 PolarHBondContact O-N 3.14Å; L294-K297 PolarHBondContact O-N 3.07Å; Q295-K297 PolarHBondContact O-N 3.07Å; K297-V299 VanDerWaalsContact C-N 3.31Å; K297-V299 PolarHBondContact O-N 3.27Å; K297-Q300 PolarHBondContact O-N 2.98Å; K297-R301 PolarHBondContact O-N 2.93Å
298	R	83	Confident	86.1	Confident	27 Å²	27	64.8 Å²	64.8	10%	0.102	32%	0.319	C	S	.	.	H	α-helix	trans	-63.3	-37.2	175.6	-171.4	179.2	-180	-110.1	0.8	111.7	D72 L135 L294 Q295	D72-R298 PolarHBondContact O-NH1 3.43Å; D72-R298 IonicContact OD1-NH2 2.74Å; D72-R298 PolarHBondContact OD1-NH2 3.49Å; L135-R298 HydrophobicContact CD2-CB 4.34Å; L294-R298 WeakPolarHBondContact O-CB 3.49Å; L294-R298 PolarHBondContact O-N 3.14Å; Q295-R298 WeakPolarHBondContact O-CB 3.4Å; Q295-R298 PolarHBondContact O-N 3.29Å; Q295-R298 VanDerWaalsContact O-N 3.09Å
299	V	80.4	Confident	85.9	Confident	83 Å²	83	59.1 Å²	59.1	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-74.6	-31.4	176.6	174.5	0	0	0	0	112.7	E74 Q295 K296 K297 R301	E74-V299 HydrophobicContact CB-CG2 3.97Å; E74-V299 HydrophobicContact CG-CG2 4.05Å; Q295-V299 WeakPolarHBondContact O-CG2 3.5Å; Q295-V299 PolarHBondContact O-N 3.47Å; K296-V299 PolarHBondContact O-N 2.99Å; K297-V299 VanDerWaalsContact C-N 3.31Å; K297-V299 PolarHBondContact O-N 3.27Å; V299-R301 VanDerWaalsContact C-N 3.27Å; V299-R301 PolarHBondContact O-N 3.39Å
300	Q	77.3	Confident	85.7	Confident	159 Å²	159	52.7 Å²	52.7	74%	0.743	27%	0.27	S	S	*	.	H	α-helix	trans	-71.6	-19.5	176.1	-73.7	173.5	0.1	0	0	113.7	K296 K297	K296-Q300 WeakPolarHBondContact O-CG 3.41Å; K296-Q300 PolarHBondContact O-N 3.13Å; K296-Q300 VanDerWaalsContact O-N 3.15Å; K297-Q300 PolarHBondContact O-N 2.98Å
301	R	79.1	Confident	85.7	Confident	60 Å²	60	52.7 Å²	52.7	23%	0.226	27%	0.268	C	S	.	.	S	Bend	trans	-85.2	146	176.2	-72.6	-168.3	-178	178.6	1.3	111.1	L135 K297 V299 E305	L135-R301 PolarHBondContact O-NH1 3.19Å; K297-R301 PolarHBondContact O-N 2.93Å; V299-R301 VanDerWaalsContact C-N 3.27Å; V299-R301 PolarHBondContact O-N 3.39Å; R301-E305 WeakPolarHBondContact CD-OE2 3.37Å
302	H	84.6	Confident	85.7	Confident	41 Å²	41	54.3 Å²	54.3	19%	0.19	28%	0.275	C	S	.	.			trans	-63.9	140.5	178.3	-170.4	-86.5	0	0	0	110.2	F304 E305 L1068	H302-F304 VanDerWaalsContact C-N 3.25Å; H302-F304 AromaticContact CE1-CD1 3.84Å; H302-F304 AromaticContact CE1-CD2 3.56Å; H302-F304 AromaticContact CE1-CG 3.43Å; H302-F304 VanDerWaalsContact CE1-CG 3.43Å; H302-F304 WeakPolarHBondContact CE1-CG 3.45Å; H302-F304 WeakPolarHBondContact ND1-CB 3.43Å; H302-F304 AromaticContact ND1-CD2 3.97Å; H302-F304 AromaticContact ND1-CG 3.55Å; H302-F304 PolarHBondContact ND1-N 3.5Å; H302-F304 VanDerWaalsContact ND1-N 3.14Å; H302-F304 PolarHBondContact O-N 3.32Å; H302-E305 HydrophobicContact CB-CG 4.43Å; H302-E305 PolarHBondContact N-OE1 3.37Å; H302-E305 WeakPolarHBondContact O-CB 3.25Å; H302-E305 PolarHBondContact O-N 3.47Å; H302-L1068 HydrophobicContact CB-CD1 3.55Å; H302-L1068 WeakPolarHBondContact ND1-CD1 3.33Å
303	P	83.3	Confident	85.8	Confident	67 Å²	67	53.2 Å²	53.2	44%	0.435	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-52.2	-39.7	179.9	-30	36.3	0	0	0	114.2	E305 R306 I307	P303-E305 PolarHBondContact O-N 3.41Å; P303-E305 VanDerWaalsContact O-N 3.11Å; P303-R306 PolarHBondContact O-N 3.21Å; P303-I307 WeakPolarHBondContact O-CG1 3.41Å; P303-I307 PolarHBondContact O-N 3.11Å
304	F	87	Confident	86.1	Confident	33 Å²	33	54.1 Å²	54.1	15%	0.145	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-60.7	-20.6	179.4	-65.9	-4.5	0	0	0	114.5	H302 R306 I307 A1034 K1065 L1068	H302-F304 VanDerWaalsContact C-N 3.25Å; H302-F304 AromaticContact CE1-CD1 3.84Å; H302-F304 AromaticContact CE1-CD2 3.56Å; H302-F304 AromaticContact CE1-CG 3.43Å; H302-F304 VanDerWaalsContact CE1-CG 3.43Å; H302-F304 WeakPolarHBondContact CE1-CG 3.45Å; H302-F304 WeakPolarHBondContact ND1-CB 3.43Å; H302-F304 AromaticContact ND1-CD2 3.97Å; H302-F304 AromaticContact ND1-CG 3.55Å; H302-F304 PolarHBondContact ND1-N 3.5Å; H302-F304 VanDerWaalsContact ND1-N 3.14Å; H302-F304 PolarHBondContact O-N 3.32Å; F304-R306 PolarHBondContact O-N 3.3Å; F304-I307 HydrophobicContact CD1-CD1 4Å; F304-I307 HydrophobicContact CE1-CD1 4.49Å; F304-A1034 HydrophobicContact CE1-CB 4.44Å; F304-K1065 HydrophobicContact CD2-CB 4.37Å; F304-K1065 HydrophobicContact CE2-CB 3.88Å; F304-K1065 HydrophobicContact CE2-CG 4.13Å; F304-L1068 HydrophobicContact CB-CB 4.24Å
305	E	84.6	Confident	86.3	Confident	21 Å²	21	54.2 Å²	54.2	10%	0.098	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-69.9	-16.6	174.5	-65.7	175.8	-128.5	0	0	112.5	S153 R301 H302 P303 L1068 R1072	S153-E305 VanDerWaalsContact CB-OE1 3.23Å; S153-E305 WeakPolarHBondContact CB-OE1 3.26Å; S153-E305 PolarHBondContact OG-OE1 3.02Å; S153-E305 PolarHBondContact OG-OE2 2.91Å; R301-E305 WeakPolarHBondContact CD-OE2 3.37Å; H302-E305 HydrophobicContact CB-CG 4.43Å; H302-E305 PolarHBondContact N-OE1 3.37Å; H302-E305 WeakPolarHBondContact O-CB 3.25Å; H302-E305 PolarHBondContact O-N 3.47Å; P303-E305 PolarHBondContact O-N 3.41Å; P303-E305 VanDerWaalsContact O-N 3.11Å; E305-L1068 HydrophobicContact CG-CD2 3.78Å; E305-R1072 PolarHBondContact O-NH1 2.93Å
306	R	79.3	Confident	86.7	Confident	72 Å²	72	53.1 Å²	53.1	27%	0.272	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-16.6	-172.2	-62.2	-177.7	-73.8	131.5	-7.6	113.9	P303 F304	P303-R306 PolarHBondContact O-N 3.21Å; F304-R306 PolarHBondContact O-N 3.3Å
307	I	83.8	Confident	87.1	Confident	61 Å²	61	47.5 Å²	47.5	31%	0.313	24%	0.237	S	C	.	.	S	Bend	trans	-77.8	131.2	-177.7	-63.5	171.3	0	0	0	109.3	P303 F304 A1034 M1035 R1072	P303-I307 WeakPolarHBondContact O-CG1 3.41Å; P303-I307 PolarHBondContact O-N 3.11Å; F304-I307 HydrophobicContact CD1-CD1 4Å; F304-I307 HydrophobicContact CE1-CD1 4.49Å; I307-A1034 HydrophobicContact CD1-CB 3.97Å; I307-M1035 HydrophobicContact CB-CE 3.95Å; I307-M1035 HydrophobicContact CG2-CE 4.2Å; I307-M1035 WeakPolarHBondContact O-CE 3.32Å; I307-R1072 PolarHBondContact O-NH2 2.98Å
308	A	85.7	Confident	87.6	Confident	51 Å²	51	43.3 Å²	43.3	42%	0.421	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-61.4	142.6	174.7	0	0	0	0	0	110.9	C146	C146-A308 HydrophobicContact CB-CB 4.35Å
309	T	91.6	Very high	88	Confident	6 Å²	6	43.8 Å²	43.8	4%	0.037	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-79.2	156.7	174.7	56.7	0	0	0	0	110.5	C146 S148 F311 M1035 R1072 V1073	C146-T309 WeakPolarHBondContact CB-O 3.47Å; C146-T309 PolarHBondContact O-N 3.32Å; C146-T309 PolarHBondContact O-OG1 3.12Å; S148-T309 WeakPolarHBondContact OG-CG2 3.5Å; T309-F311 VanDerWaalsContact C-N 3.27Å; T309-F311 WeakPolarHBondContact CB-O 3.19Å; T309-F311 PolarHBondContact O-N 3.33Å; T309-F311 PolarHBondContact OG1-O 3.48Å; T309-M1035 HydrophobicContact CG2-CE 4.09Å; T309-M1035 HydrophobicContact CG2-CG 4.15Å; T309-M1035 HydrophobicContact CG2-SD 4.41Å; T309-R1072 HydrophobicContact CG2-CB 3.96Å; T309-R1072 WeakPolarHBondContact CG2-O 3.41Å; T309-V1073 HydrophobicContact CG2-CG2 4.34Å
310	P	90.1	Very high	88.3	Confident	26 Å²	26	47.4 Å²	47.4	17%	0.169	24%	0.238	C	C	.	.	S	Bend	trans	-65.9	-31.4	176.4	-23.5	34	0	0	0	113.5	F377 M1035	P310-F377 HydrophobicContact CB-CE1 3.91Å; P310-F377 HydrophobicContact CB-CZ 3.54Å; P310-F377 HydrophobicContact CG-CE1 4.16Å; P310-F377 HydrophobicContact CG-CZ 3.9Å; P310-M1035 WeakPolarHBondContact CD-O 3.27Å; P310-M1035 WeakPolarHBondContact CG-O 3.45Å
311	F	92	Very high	88.4	Confident	44 Å²	44	44 Å²	44	19%	0.193	23%	0.228	C	C	.	.	S	Bend	trans	-127.5	144.2	177.1	-56.9	-70.2	0	0	0	109.8	T309 V313 F377 A384 H990	T309-F311 VanDerWaalsContact C-N 3.27Å; T309-F311 WeakPolarHBondContact CB-O 3.19Å; T309-F311 PolarHBondContact O-N 3.33Å; T309-F311 PolarHBondContact OG1-O 3.48Å; F311-V313 PolarHBondContact O-N 3.16Å; F311-F377 HydrophobicContact CE2-CE2 4.05Å; F311-F377 HydrophobicContact CE2-CZ 4.3Å; F311-F377 HydrophobicContact CZ-CE2 4.23Å; F311-A384 HydrophobicContact CE1-CB 4.29Å; F311-H990 AromaticContact CD1-CE1 3.51Å; F311-H990 AromaticContact CD1-NE2 3.62Å; F311-H990 AromaticContact CE1-CE1 3.22Å; F311-H990 WeakPolarHBondContact CE1-CE1 3.48Å; F311-H990 AromaticContact CE1-ND1 3.58Å; F311-H990 AromaticContact CE1-NE2 3.8Å; F311-H990 AromaticContact CE2-CE1 3.77Å; F311-H990 AromaticContact CG-CE1 3.91Å; F311-H990 AromaticContact CG-NE2 3.95Å; F311-H990 AromaticContact CZ-CE1 3.37Å; F311-H990 WeakPolarHBondContact CZ-CE1 3.4Å; F311-H990 AromaticContact CZ-ND1 3.83Å
312	Q	92.8	Very high	88.3	Confident	41 Å²	41	47.8 Å²	47.8	19%	0.192	25%	0.253	C	S	.	.			trans	-68.3	127.9	-179.5	-177.5	61.6	66.8	0	0	111.4	G143 N147 Y314	G143-Q312 VanDerWaalsContact C-CD 3.49Å; G143-Q312 PolarHBondContact O-OE1 3.13Å; G143-Q312 VanDerWaalsContact O-OE1 3.11Å; N147-Q312 PolarHBondContact O-NE2 3.03Å; Q312-Y314 HydrophobicContact CB-CE2 4.39Å; Q312-Y314 HydrophobicContact CG-CD1 3.85Å; Q312-Y314 HydrophobicContact CG-CD2 4.32Å; Q312-Y314 HydrophobicContact CG-CE1 3.34Å; Q312-Y314 HydrophobicContact CG-CE2 3.88Å; Q312-Y314 HydrophobicContact CG-CG 4.31Å
313	V	93.3	Very high	88.1	Confident	30 Å²	30	53.5 Å²	53.5	18%	0.182	28%	0.279	C	S	.	.			trans	-106.2	120.8	171.2	-178.1	0	0	0	0	108.4	F311 R1072 V1073	F311-V313 PolarHBondContact O-N 3.16Å; V313-R1072 WeakPolarHBondContact CG2-O 3.21Å; V313-V1073 WeakPolarHBondContact CG2-O 3.44Å
314	Y	94.3	Very high	87.6	Confident	65 Å²	65	53.5 Å²	53.5	26%	0.255	28%	0.284	S	S	.	.			trans	-96.6	138.2	-178.2	-63	-69.7	0	0	0	111.5	Q312 F985 P986	Q312-Y314 HydrophobicContact CB-CE2 4.39Å; Q312-Y314 HydrophobicContact CG-CD1 3.85Å; Q312-Y314 HydrophobicContact CG-CD2 4.32Å; Q312-Y314 HydrophobicContact CG-CE1 3.34Å; Q312-Y314 HydrophobicContact CG-CE2 3.88Å; Q312-Y314 HydrophobicContact CG-CG 4.31Å; Y314-F985 HydrophobicContact CD1-CB 3.76Å; Y314-F985 AromaticContact CD1-CD1 3.37Å; Y314-F985 HydrophobicContact CD1-CD1 3.37Å; Y314-F985 AromaticContact CD1-CD2 3.7Å; Y314-F985 HydrophobicContact CD1-CD2 3.7Å; Y314-F985 AromaticContact CD1-CE1 3.79Å; Y314-F985 HydrophobicContact CD1-CE1 3.79Å; Y314-F985 HydrophobicContact CD1-CE2 4.06Å; Y314-F985 AromaticContact CD1-CG 3.32Å; Y314-F985 HydrophobicContact CD1-CG 3.32Å; Y314-F985 HydrophobicContact CD1-CZ 4.12Å; Y314-F985 HydrophobicContact CD2-CB 3.85Å; Y314-F985 HydrophobicContact CD2-CG 4.32Å; Y314-F985 HydrophobicContact CE1-CB 4.04Å; Y314-F985 AromaticContact CE1-CD1 3.43Å; Y314-F985 HydrophobicContact CE1-CD1 3.43Å; Y314-F985 VanDerWaalsContact CE1-CD1 3.43Å; Y314-F985 AromaticContact CE1-CE1 3.98Å; Y314-F985 HydrophobicContact CE1-CE1 3.98Å; Y314-F985 AromaticContact CE1-CG 3.78Å; Y314-F985 HydrophobicContact CE1-CG 3.78Å; Y314-F985 HydrophobicContact CE2-CB 4.13Å; Y314-F985 HydrophobicContact CG-CB 3.66Å; Y314-F985 HydrophobicContact CG-CD1 4.16Å; Y314-F985 AromaticContact CG-CD2 3.85Å; Y314-F985 HydrophobicContact CG-CD2 3.85Å; Y314-F985 AromaticContact CG-CG 3.63Å; Y314-F985 HydrophobicContact CG-CG 3.63Å; Y314-P986 HydrophobicContact CE2-CG 4.09Å; Y314-P986 WeakPolarHBondContact CE2-O 3.48Å; Y314-P986 WeakPolarHBondContact OH-CG 3.28Å
315	S	93.6	Very high	86.8	Confident	10 Å²	10	57.8 Å²	57.8	7%	0.07	31%	0.307	C	S	.	.			trans	-91.1	127.8	171.6	-179.1	0	0	0	0	110.9	T317 Q960	S315-T317 PolarHBondContact O-N 3.12Å; S315-T317 PolarHBondContact OG-N 2.79Å; S315-T317 PolarHBondContact OG-O 2.93Å; S315-Q960 PolarHBondContact O-NE2 3.16Å
316	W	95.2	Very high	86.1	Confident	6 Å²	6	58.3 Å²	58.3	2%	0.023	31%	0.31	C	S	.	.	S	Bend	trans	-75.9	-9.4	177.2	71.1	-81.9	0	0	0	113.7	L193 L196 L950 R951 V955 Q960 I961 E1077 L1114	L193-W316 HydrophobicContact CD1-CH2 4.26Å; L193-W316 HydrophobicContact CD2-CH2 4.01Å; L196-W316 HydrophobicContact CD2-CZ2 3.77Å; W316-L950 HydrophobicContact CZ3-CD2 4.25Å; W316-L950 HydrophobicContact CZ3-CG 4Å; W316-R951 HydrophobicContact CH2-CB 4.28Å; W316-R951 HydrophobicContact CZ2-CB 4.03Å; W316-R951 HydrophobicContact CZ2-CG 4.15Å; W316-V955 HydrophobicContact CB-CG2 4.34Å; W316-V955 HydrophobicContact CG-CG2 4.34Å; W316-Q960 WeakPolarHBondContact O-CA 3.36Å; W316-I961 HydrophobicContact CE3-CD1 4.02Å; W316-I961 HydrophobicContact CE3-CG1 4.09Å; W316-I961 HydrophobicContact CZ3-CD1 3.59Å; W316-I961 HydrophobicContact CZ3-CG1 4.12Å; W316-I961 PolarHBondContact O-N 3.44Å; W316-E1077 PolarHBondContact NE1-OE1 3.39Å; W316-L1114 HydrophobicContact CZ2-CD2 4.39Å
317	T	95.2	Very high	85.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148	170.5	62.2	0	0	0	0	111.7	L196 S315 I961 L963	L196-T317 HydrophobicContact CD2-CG2 4.27Å; S315-T317 PolarHBondContact O-N 3.12Å; S315-T317 PolarHBondContact OG-N 2.79Å; S315-T317 PolarHBondContact OG-O 2.93Å; T317-I961 VanDerWaalsContact CA-O 3.31Å; T317-I961 WeakPolarHBondContact CA-O 3.29Å; T317-I961 HydrophobicContact CG2-CD1 4.43Å; T317-I961 HydrophobicContact CG2-CG1 3.97Å; T317-L963 HydrophobicContact CG2-CD1 4.22Å
318	A	93.8	Very high	84.5	Confident	6 Å²	6	53.4 Å²	53.4	5%	0.05	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147	169.5	0	0	0	0	0	110.8	Y141 Q960 I961 L962 L963 L982	Y141-A318 HydrophobicContact CD1-CB 3.74Å; Y141-A318 HydrophobicContact CG-CB 4.03Å; A318-Q960 HydrophobicContact CB-CG 4.24Å; A318-I961 PolarHBondContact N-O 2.98Å; A318-L962 CarbonylContact O-C 3.58Å; A318-L963 WeakPolarHBondContact O-CB 3.25Å; A318-L963 PolarHBondContact O-N 2.98Å; A318-L982 HydrophobicContact CB-CD1 3.76Å
319	P	91.3	Very high	84	Confident	37 Å²	37	56 Å²	56	24%	0.24	29%	0.29	C	S	.	.			trans	-69.6	163.9	178.2	31.7	-33.1	0	0	0	110.7	Y141 V321	Y141-P319 HydrophobicContact CD2-CG 4.3Å; Y141-P319 HydrophobicContact CE2-CG 3.8Å; Y141-P319 VanDerWaalsContact CZ-CD 3.47Å; P319-V321 HydrophobicContact CG-CG2 4.03Å; P319-V321 PolarHBondContact O-N 3.27Å
320	Q	85.9	Confident	83	Confident	160 Å²	160	58.9 Å²	58.9	75%	0.748	32%	0.315	S	S	*	.			trans	-67.9	117.7	168.1	-168.7	169	5.8	0	0	108.7	L962	Q320-L962 HydrophobicContact CB-CD1 3.81Å
321	V	80.3	Confident	82	Confident	88 Å²	88	59.8 Å²	59.8	53%	0.533	32%	0.317	S	S	.	.			trans	-118.2	129.4	176.3	-173.2	0	0	0	0	108.5	P319 H323	P319-V321 HydrophobicContact CG-CG2 4.03Å; P319-V321 PolarHBondContact O-N 3.27Å; V321-H323 PolarHBondContact O-N 3.47Å
322	D	77.8	Confident	80.7	Confident	139 Å²	139	59.7 Å²	59.7	74%	0.743	32%	0.318	S	S	*	.			trans	-62.9	134.9	173	-69.4	-33.2	0	0	0	109.8	A324	D322-A324 VanDerWaalsContact C-N 3.32Å; D322-A324 PolarHBondContact O-N 3.32Å
323	H	78.4	Confident	79.6	Confident	161 Å²	161	59.6 Å²	59.6	75%	0.745	32%	0.324	S	S	*	.			trans	-68.3	90.7	177.9	-167	83.3	0	0	0	110.5	V321 R329	V321-H323 PolarHBondContact O-N 3.47Å; H323-R329 PolarHBondContact CE1-NH2 3.32Å; H323-R329 PolarHBondContact NE2-NH2 2.93Å
324	A	73.8	Confident	78.2	Confident	66 Å²	66	66.7 Å²	66.7	55%	0.545	35%	0.349	S	S	.	.			trans	-73.7	147.8	177.6	0	0	0	0	0	111	D322 D326 R329	D322-A324 VanDerWaalsContact C-N 3.32Å; D322-A324 PolarHBondContact O-N 3.32Å; A324-D326 PolarHBondContact O-N 2.93Å; A324-R329 PolarHBondContact O-NH2 2.69Å
325	M	70.1	Confident	76.6	Confident	124 Å²	124	65.5 Å²	65.5	61%	0.611	35%	0.349	S	S	*	.			trans	-66.5	117.7	172.1	-178.6	166.9	59.5	0	0	109.4	V211	V211-M325 HydrophobicContact CB-CE 3.85Å; V211-M325 HydrophobicContact CG1-CE 3.44Å; V211-M325 VanDerWaalsContact CG1-CE 3.44Å; V211-M325 HydrophobicContact CG2-CE 3.13Å
326	D	70.3	Confident	75	Confident	31 Å²	31	68 Å²	68	17%	0.166	37%	0.366	C	S	.	.			trans	-134.3	111.3	-178.2	-178.9	5.1	0	0	0	109.9	K133 A324 V328 R329 A330	K133-D326 IonicContact NZ-OD1 2.61Å; K133-D326 PolarHBondContact NZ-OD1 3.27Å; K133-D326 IonicContact NZ-OD2 3.89Å; K133-D326 PolarHBondContact NZ-OD2 3.44Å; A324-D326 PolarHBondContact O-N 2.93Å; D326-V328 WeakPolarHBondContact OD1-CB 3.17Å; D326-V328 PolarHBondContact OD1-N 3.49Å; D326-R329 HydrophobicContact CB-CB 4.02Å; D326-R329 PolarHBondContact OD1-N 2.94Å; D326-R329 WeakPolarHBondContact OD2-CB 3.3Å; D326-A330 PolarHBondContact O-N 2.84Å
327	C	65.3	Low	73.2	Confident	19 Å²	19	74.7 Å²	74.7	13%	0.128	39%	0.391	C	S	.	.	H	α-helix	trans	-85.8	-18.7	-174.7	-55	0	0	0	0	112.4	T213 E331	T213-C327 WeakPolarHBondContact CB-SG 3.35Å; T213-C327 WeakPolarHBondContact OG1-CB 3.35Å; T213-C327 PolarHBondContact OG1-SG 3.27Å; C327-E331 VanDerWaalsContact O-CB 3.26Å; C327-E331 WeakPolarHBondContact O-CB 3.4Å; C327-E331 PolarHBondContact O-N 2.55Å
328	V	63.6	Low	71.3	Confident	11 Å²	11	79.7 Å²	79.7	7%	0.067	42%	0.418	C	S	.	.	H	α-helix	trans	-62.9	-56.6	167.3	-175.9	0	0	0	0	108.3	R129 D326 A330 E331 D332	R129-V328 HydrophobicContact CB-CG2 3.52Å; R129-V328 HydrophobicContact CG-CG2 3.93Å; D326-V328 WeakPolarHBondContact OD1-CB 3.17Å; D326-V328 PolarHBondContact OD1-N 3.49Å; V328-A330 PolarHBondContact O-N 3.49Å; V328-A330 VanDerWaalsContact O-N 3.15Å; V328-E331 PolarHBondContact O-N 3.32Å; V328-D332 WeakPolarHBondContact CG1-OD2 3.45Å; V328-D332 WeakPolarHBondContact O-CB 3.49Å; V328-D332 PolarHBondContact O-N 3.43Å
329	R	75.3	Confident	69.6	Low	105 Å²	105	79.7 Å²	79.7	40%	0.396	42%	0.418	S	S	.	.	H	α-helix	trans	-54.2	-39.5	178.2	-174.9	179.8	65.6	-148.5	-9.2	112.1	H323 A324 D326 A333	H323-R329 PolarHBondContact CE1-NH2 3.32Å; H323-R329 PolarHBondContact NE2-NH2 2.93Å; A324-R329 PolarHBondContact O-NH2 2.69Å; D326-R329 HydrophobicContact CB-CB 4.02Å; D326-R329 PolarHBondContact OD1-N 2.94Å; D326-R329 WeakPolarHBondContact OD2-CB 3.3Å; R329-A333 WeakPolarHBondContact O-CB 3.42Å; R329-A333 PolarHBondContact O-N 3.3Å; R329-A333 VanDerWaalsContact O-N 3.11Å
330	A	71.4	Confident	67.9	Low	67 Å²	67	84 Å²	84	55%	0.554	43%	0.431	S	S	*	.	H	α-helix	trans	-69.7	-38.4	177.4	0	0	0	0	0	113.6	D326 V328	D326-A330 PolarHBondContact O-N 2.84Å; V328-A330 PolarHBondContact O-N 3.49Å; V328-A330 VanDerWaalsContact O-N 3.15Å
331	E	67.7	Low	66.5	Low	46 Å²	46	78.4 Å²	78.4	22%	0.215	40%	0.404	C	S	.	.	H	α-helix	trans	-71.9	-48.7	177.8	-175.6	171.6	-172.2	0	0	111.3	R129 C327 V328 A333 Y334 T335	R129-E331 IonicContact NH1-OE2 2.67Å; R129-E331 PolarHBondContact NH1-OE2 2.92Å; R129-E331 VanDerWaalsContact NH1-OE2 3.15Å; C327-E331 VanDerWaalsContact O-CB 3.26Å; C327-E331 WeakPolarHBondContact O-CB 3.4Å; C327-E331 PolarHBondContact O-N 2.55Å; V328-E331 PolarHBondContact O-N 3.32Å; E331-A333 VanDerWaalsContact C-N 3.29Å; E331-A333 PolarHBondContact O-N 2.75Å; E331-Y334 WeakPolarHBondContact O-CB 3.33Å; E331-Y334 PolarHBondContact O-N 3.27Å; E331-T335 PolarHBondContact O-N 3.29Å; E331-T335 PolarHBondContact O-OG1 2.96Å
332	D	66.1	Low	65	Low	41 Å²	41	77.3 Å²	77.3	22%	0.219	39%	0.393	C	S	.	.	H	α-helix	trans	-66.4	-31.6	-179.2	-65.9	-11.6	0	0	0	111.8	R126 V328 Y334 T335 S336	R126-D332 IonicContact CZ-OD1 3.54Å; R126-D332 IonicContact NE-OD1 3.07Å; R126-D332 IonicContact NH2-OD1 2.87Å; R126-D332 PolarHBondContact NH2-OD1 2.71Å; R126-D332 VanDerWaalsContact NH2-OD1 3.1Å; V328-D332 WeakPolarHBondContact CG1-OD2 3.45Å; V328-D332 WeakPolarHBondContact O-CB 3.49Å; V328-D332 PolarHBondContact O-N 3.43Å; D332-Y334 PolarHBondContact O-N 3.3Å; D332-Y334 VanDerWaalsContact O-N 3.12Å; D332-T335 PolarHBondContact O-N 2.88Å; D332-S336 WeakPolarHBondContact O-CB 3.45Å; D332-S336 PolarHBondContact O-N 3.35Å; D332-S336 PolarHBondContact O-OG 3.02Å
333	A	68.4	Low	63.6	Low	39 Å²	39	77.6 Å²	77.6	32%	0.322	39%	0.39	S	S	.	.	H	α-helix	trans	-60	-20.6	172.1	0	0	0	0	0	113.3	R329 E331 R337	R329-A333 WeakPolarHBondContact O-CB 3.42Å; R329-A333 PolarHBondContact O-N 3.3Å; R329-A333 VanDerWaalsContact O-N 3.11Å; E331-A333 VanDerWaalsContact C-N 3.29Å; E331-A333 PolarHBondContact O-N 2.75Å; A333-R337 WeakPolarHBondContact O-CD 3.42Å; A333-R337 WeakPolarHBondContact O-CG 3.27Å; A333-R337 PolarHBondContact O-NE 2.89Å
334	Y	64.3	Low	62.4	Low	179 Å²	179	73.2 Å²	73.2	70%	0.702	37%	0.372	S	S	*	.	H	α-helix	trans	-92.9	-43.9	176.3	-163.1	-92.6	0	0	0	112	E331 D332	E331-Y334 WeakPolarHBondContact O-CB 3.33Å; E331-Y334 PolarHBondContact O-N 3.27Å; D332-Y334 PolarHBondContact O-N 3.3Å; D332-Y334 VanDerWaalsContact O-N 3.12Å
335	T	61	Low	61.1	Low	41 Å²	41	74.2 Å²	74.2	25%	0.252	37%	0.373	S	S	.	.	H	α-helix	trans	-69.3	-42.6	-178.3	-49.4	0	0	0	0	112.2	E331 D332 R337 L338 E342	E331-T335 PolarHBondContact O-N 3.29Å; E331-T335 PolarHBondContact O-OG1 2.96Å; D332-T335 PolarHBondContact O-N 2.88Å; T335-R337 VanDerWaalsContact C-N 3.25Å; T335-R337 PolarHBondContact O-N 3.01Å; T335-L338 PolarHBondContact O-N 2.8Å; T335-E342 HydrophobicContact CG2-CG 4.02Å
336	S	59.3	Low	60.2	Low	62 Å²	62	71.6 Å²	71.6	43%	0.434	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-60	-30.4	-178.6	56.9	0	0	0	0	113.9	D332 L338 G339	D332-S336 WeakPolarHBondContact O-CB 3.45Å; D332-S336 PolarHBondContact O-N 3.35Å; D332-S336 PolarHBondContact O-OG 3.02Å; S336-L338 VanDerWaalsContact C-N 3.29Å; S336-L338 PolarHBondContact O-N 2.78Å; S336-G339 PolarHBondContact O-N 3.4Å
337	R	58.6	Low	59.6	Low	146 Å²	146	76.8 Å²	76.8	55%	0.551	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-69	-26.1	-177.6	-66.3	-179.1	-166	-160.1	-1.4	113.6	A333 T335 G339	A333-R337 WeakPolarHBondContact O-CD 3.42Å; A333-R337 WeakPolarHBondContact O-CG 3.27Å; A333-R337 PolarHBondContact O-NE 2.89Å; T335-R337 VanDerWaalsContact C-N 3.25Å; T335-R337 PolarHBondContact O-N 3.01Å; R337-G339 VanDerWaalsContact C-N 3.32Å
338	L	55.6	Low	59.6	Low	105 Å²	105	79.4 Å²	79.4	55%	0.55	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-85	-6	-176	-71.9	158.3	0	0	0	113.1	T335 S336 Y340	T335-L338 PolarHBondContact O-N 2.8Å; S336-L338 VanDerWaalsContact C-N 3.29Å; S336-L338 PolarHBondContact O-N 2.78Å; L338-Y340 HydrophobicContact CB-CD2 3.59Å; L338-Y340 HydrophobicContact CB-CE2 3.91Å; L338-Y340 PolarHBondContact O-N 3.49Å
339	G	56.7	Low	60.6	Low	6 Å²	6	80.3 Å²	80.3	6%	0.062	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	13.4	178	0	0	0	0	0	114.8	S336 R337 W415 N416	S336-G339 PolarHBondContact O-N 3.4Å; R337-G339 VanDerWaalsContact C-N 3.32Å; G339-W415 VanDerWaalsContact CA-CE2 3.48Å; G339-W415 VanDerWaalsContact CA-CZ2 3.47Å; G339-N416 PolarHBondContact O-OD1 3.34Å
340	Y	56.3	Low	61.2	Low	129 Å²	129	79 Å²	79	51%	0.506	42%	0.419	S	S	.	.			trans	-81	130.4	170.9	-66.8	-65.9	0	0	0	109.8	L338	L338-Y340 HydrophobicContact CB-CD2 3.59Å; L338-Y340 HydrophobicContact CB-CE2 3.91Å; L338-Y340 PolarHBondContact O-N 3.49Å
341	E	55.5	Low	62.2	Low	41 Å²	41	75.9 Å²	75.9	19%	0.192	39%	0.393	C	S	.	.			trans	-70.4	131.1	166.6	-74.7	-164.2	173.2	0	0	110	H343 I344 R349	E341-H343 PolarHBondContact O-N 3.2Å; E341-I344 PolarHBondContact O-N 3.03Å; E341-R349 IonicContact OE1-NH1 3.17Å; E341-R349 PolarHBondContact OE1-NH1 3.08Å
342	E	48.8	Very low	63.4	Low	65 Å²	65	73.8 Å²	73.8	30%	0.304	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-22	-176	-60	-163.1	138	0	0	113.4	R126 T335	R126-E342 IonicContact CZ-OE1 3.52Å; R126-E342 IonicContact CZ-OE2 2.68Å; R126-E342 IonicContact NE-OE2 3.71Å; R126-E342 IonicContact NH1-OE1 2.69Å; R126-E342 IonicContact NH1-OE2 3.53Å; R126-E342 PolarHBondContact NH1-OE2 3.19Å; R126-E342 IonicContact NH2-OE1 3.57Å; R126-E342 PolarHBondContact NH2-OE1 3.14Å; R126-E342 IonicContact NH2-OE2 3.91Å; R126-E342 PolarHBondContact NH2-OE2 3.47Å; T335-E342 HydrophobicContact CG2-CG 4.02Å
343	H	49.3	Very low	64.7	Low	145 Å²	145	75 Å²	75	67%	0.671	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-17	-176.7	-58.3	99.2	0	0	0	113	R119 E341	R119-H343 PolarHBondContact NH2-O 3Å; E341-H343 PolarHBondContact O-N 3.2Å
344	I	52.8	Low	65.8	Low	70 Å²	70	75.9 Å²	75.9	36%	0.359	39%	0.385	S	S	.	.	S	Bend	trans	-131.4	83.9	-179.8	-45.7	178.3	0	0	0	110.2	E341 G346 Q347	E341-I344 PolarHBondContact O-N 3.03Å; I344-G346 PolarHBondContact O-N 3.14Å; I344-Q347 HydrophobicContact CG2-CB 3.91Å
345	P	46.2	Very low	67.2	Low	87 Å²	87	67.5 Å²	67.5	57%	0.565	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	122	-176.6	-21.9	33	0	0	0	112.7
346	G	51.4	Low	68.8	Low	69 Å²	69	65.6 Å²	65.6	71%	0.711	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	2.3	169.9	0	0	0	0	0	116.1	I344	I344-G346 PolarHBondContact O-N 3.14Å
347	Q	57.3	Low	70.4	Confident	140 Å²	140	65 Å²	65	65%	0.654	34%	0.335	S	S	*	.			trans	-117	128.9	170.6	-69	-178.7	-15.4	0	0	109.7	I344	I344-Q347 HydrophobicContact CG2-CB 3.91Å
348	T	66.6	Low	71.9	Confident	73 Å²	73	58.7 Å²	58.7	45%	0.448	31%	0.312	S	S	.	.			trans	-82.2	136.8	167.4	47.3	0	0	0	0	108.5	N417	T348-N417 WeakPolarHBondContact CB-ND2 3.35Å; T348-N417 PolarHBondContact OG1-ND2 3.35Å; T348-N417 VanDerWaalsContact OG1-ND2 3.14Å
349	R	83.8	Confident	73.6	Confident	30 Å²	30	55.3 Å²	55.3	11%	0.113	29%	0.292	C	S	.	.			trans	-67.6	136.9	-179.2	-160.9	170.4	174.4	-177.7	-5.7	109.7	E341 W351 E354 D382 N417	E341-R349 IonicContact OE1-NH1 3.17Å; E341-R349 PolarHBondContact OE1-NH1 3.08Å; R349-W351 HydrophobicContact CG-CD2 4.47Å; R349-W351 VanDerWaalsContact NH1-CH2 3.26Å; R349-W351 PolarHBondContact O-N 3.27Å; R349-E354 WeakPolarHBondContact CD-OE1 3.06Å; R349-E354 WeakPolarHBondContact CG-OE1 3.46Å; R349-E354 IonicContact CZ-OE1 3.8Å; R349-E354 IonicContact CZ-OE2 2.9Å; R349-E354 IonicContact NE-OE1 3.57Å; R349-E354 PolarHBondContact NE-OE1 3.37Å; R349-E354 IonicContact NE-OE2 2.96Å; R349-E354 PolarHBondContact NE-OE2 3.01Å; R349-E354 IonicContact NH2-OE2 3.72Å; R349-E354 PolarHBondContact NH2-OE2 2.94Å; R349-D382 IonicContact CZ-OD2 3.83Å; R349-D382 IonicContact NH1-OD2 3.88Å; R349-D382 PolarHBondContact NH1-OD2 3.38Å; R349-D382 IonicContact NH2-OD2 3.81Å; R349-D382 PolarHBondContact NH2-OD2 3.49Å; R349-D382 VanDerWaalsContact NH2-OD2 3.11Å; R349-N417 WeakPolarHBondContact O-CB 3.48Å; R349-N417 PolarHBondContact O-ND2 2.93Å
350	D	88.1	Confident	75.2	Confident	79 Å²	79	59 Å²	59	42%	0.422	31%	0.308	S	S	.	.			trans	-92.4	90.1	170.3	-168.2	-27.7	0	0	0	108.9	N352 E353 E354	D350-N352 PolarHBondContact O-N 2.84Å; D350-N352 PolarHBondContact OD1-N 3.05Å; D350-N352 VanDerWaalsContact OD1-N 3.13Å; D350-E353 HydrophobicContact CB-CB 3.94Å; D350-E353 PolarHBondContact O-N 3.45Å; D350-E353 PolarHBondContact OD1-N 3.41Å; D350-E354 PolarHBondContact O-N 3.19Å; D350-E354 VanDerWaalsContact O-N 3.07Å
351	W	92.4	Very high	76.9	Confident	1 Å²	1	55.6 Å²	55.6	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-35.9	-178.5	-66.7	107.4	0	0	0	112.9	R349 L355 D382 F383 A386 N416 I418	R349-W351 HydrophobicContact CG-CD2 4.47Å; R349-W351 VanDerWaalsContact NH1-CH2 3.26Å; R349-W351 PolarHBondContact O-N 3.27Å; W351-L355 VanDerWaalsContact O-CB 3.31Å; W351-L355 WeakPolarHBondContact O-CB 3.31Å; W351-L355 VanDerWaalsContact O-CD1 3.32Å; W351-L355 WeakPolarHBondContact O-CD1 3.02Å; W351-L355 WeakPolarHBondContact O-CG 3.46Å; W351-L355 PolarHBondContact O-N 3.24Å; W351-D382 HydrophobicContact CH2-CB 3.98Å; W351-D382 HydrophobicContact CZ3-CB 3.83Å; W351-F383 HydrophobicContact CB-CD2 3.83Å; W351-F383 HydrophobicContact CB-CE2 3.93Å; W351-F383 AromaticContact CD2-CD2 3.7Å; W351-F383 HydrophobicContact CD2-CD2 3.7Å; W351-F383 HydrophobicContact CD2-CE2 4.44Å; W351-F383 HydrophobicContact CE3-CB 3.9Å; W351-F383 AromaticContact CE3-CD2 3.73Å; W351-F383 HydrophobicContact CE3-CD2 3.73Å; W351-F383 HydrophobicContact CE3-CG 4.33Å; W351-F383 AromaticContact CG-CD2 3.76Å; W351-F383 HydrophobicContact CG-CD2 3.76Å; W351-F383 HydrophobicContact CG-CE2 4.06Å; W351-F383 HydrophobicContact CZ3-CB 3.97Å; W351-F383 HydrophobicContact CZ3-CD2 4.49Å; W351-A386 HydrophobicContact CH2-CB 3.78Å; W351-A386 HydrophobicContact CZ2-CB 3.35Å; W351-N416 PolarHBondContact NE1-ND2 2.94Å; W351-N416 PolarHBondContact NE1-O 2.86Å; W351-I418 VanDerWaalsContact CD1-CG1 3.44Å; W351-I418 HydrophobicContact CG-CD1 4.45Å; W351-I418 HydrophobicContact CG-CG1 4.16Å
352	N	93	Very high	78.5	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-69.8	-46.6	-179.3	179.8	71.2	0	0	0	110.2	D350 E354 L355 Q356 I481 P483 Y556	D350-N352 PolarHBondContact O-N 2.84Å; D350-N352 PolarHBondContact OD1-N 3.05Å; D350-N352 VanDerWaalsContact OD1-N 3.13Å; N352-E354 VanDerWaalsContact C-N 3.33Å; N352-E354 PolarHBondContact O-N 3.02Å; N352-L355 PolarHBondContact O-N 3.19Å; N352-Q356 VanDerWaalsContact O-CG 3.27Å; N352-Q356 WeakPolarHBondContact O-CG 3.29Å; N352-Q356 PolarHBondContact O-N 3.43Å; N352-Q356 PolarHBondContact OD1-NE2 3.01Å; N352-Q356 VanDerWaalsContact OD1-NE2 3.07Å; N352-I481 VanDerWaalsContact CB-O 3.25Å; N352-I481 WeakPolarHBondContact CB-O 3.3Å; N352-P483 VanDerWaalsContact ND2-CD 3.35Å; N352-P483 WeakPolarHBondContact ND2-CD 3.4Å; N352-Y556 PolarHBondContact ND2-OH 3.13Å
353	E	92.6	Very high	80.4	Confident	68 Å²	68	58.9 Å²	58.9	32%	0.318	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-44.4	178.6	-171.3	57.8	-152.5	0	0	111.8	D350 L355 Q356 T357 R554	D350-E353 HydrophobicContact CB-CB 3.94Å; D350-E353 PolarHBondContact O-N 3.45Å; D350-E353 PolarHBondContact OD1-N 3.41Å; E353-L355 PolarHBondContact O-N 3.38Å; E353-Q356 PolarHBondContact O-N 2.96Å; E353-T357 HydrophobicContact CG-CG2 4.1Å; E353-T357 WeakPolarHBondContact O-CB 3.48Å; E353-T357 WeakPolarHBondContact O-CG2 3.32Å; E353-T357 PolarHBondContact O-N 3.21Å; E353-T357 PolarHBondContact O-OG1 3.28Å; E353-T357 WeakPolarHBondContact OE1-CG2 3.34Å; E353-R554 IonicContact OE1-CZ 3.04Å; E353-R554 IonicContact OE1-NH1 2.69Å; E353-R554 IonicContact OE1-NH2 3.95Å; E353-R554 PolarHBondContact OE1-NH2 2.96Å; E353-R554 IonicContact OE2-CZ 3.69Å; E353-R554 IonicContact OE2-NH1 3.68Å; E353-R554 PolarHBondContact OE2-NH1 3.06Å; E353-R554 IonicContact OE2-NH2 3.85Å; E353-R554 PolarHBondContact OE2-NH2 2.97Å
354	E	92.6	Very high	82.3	Confident	56 Å²	56	61.2 Å²	61.2	26%	0.262	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-40.6	177.4	-71.6	-171.1	-147.3	0	0	113.3	R349 D350 N352 Q356 T357 T358 V379	R349-E354 WeakPolarHBondContact CD-OE1 3.06Å; R349-E354 WeakPolarHBondContact CG-OE1 3.46Å; R349-E354 IonicContact CZ-OE1 3.8Å; R349-E354 IonicContact CZ-OE2 2.9Å; R349-E354 IonicContact NE-OE1 3.57Å; R349-E354 PolarHBondContact NE-OE1 3.37Å; R349-E354 IonicContact NE-OE2 2.96Å; R349-E354 PolarHBondContact NE-OE2 3.01Å; R349-E354 IonicContact NH2-OE2 3.72Å; R349-E354 PolarHBondContact NH2-OE2 2.94Å; D350-E354 PolarHBondContact O-N 3.19Å; D350-E354 VanDerWaalsContact O-N 3.07Å; N352-E354 VanDerWaalsContact C-N 3.33Å; N352-E354 PolarHBondContact O-N 3.02Å; E354-Q356 VanDerWaalsContact C-N 3.34Å; E354-Q356 PolarHBondContact O-N 3.09Å; E354-T357 WeakPolarHBondContact CA-OG1 3.21Å; E354-T357 PolarHBondContact O-OG1 3.34Å; E354-T358 VanDerWaalsContact O-CG2 3.28Å; E354-T358 WeakPolarHBondContact O-CG2 3.39Å; E354-T358 PolarHBondContact O-N 3.31Å; E354-T358 PolarHBondContact O-OG1 2.86Å; E354-V379 HydrophobicContact CB-CG1 3.93Å; E354-V379 HydrophobicContact CB-CG2 4.4Å
355	L	92.9	Very high	84.1	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-38.6	176.8	-75.1	167.1	0	0	0	111.8	W351 N352 E353 T358 R359 V379 F383	W351-L355 VanDerWaalsContact O-CB 3.31Å; W351-L355 WeakPolarHBondContact O-CB 3.31Å; W351-L355 VanDerWaalsContact O-CD1 3.32Å; W351-L355 WeakPolarHBondContact O-CD1 3.02Å; W351-L355 WeakPolarHBondContact O-CG 3.46Å; W351-L355 PolarHBondContact O-N 3.24Å; N352-L355 PolarHBondContact O-N 3.19Å; E353-L355 PolarHBondContact O-N 3.38Å; L355-T358 PolarHBondContact O-OG1 3.41Å; L355-R359 WeakPolarHBondContact O-CG 3.32Å; L355-V379 HydrophobicContact CD2-CB 4.46Å; L355-V379 HydrophobicContact CD2-CG1 3.62Å; L355-V379 HydrophobicContact CG-CG1 3.84Å; L355-F383 HydrophobicContact CD1-CD2 4.34Å; L355-F383 HydrophobicContact CD1-CG 4.47Å
356	Q	94.1	Very high	85.9	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-80.5	-40.8	-178.6	-54.7	-31	-32.2	0	0	112.5	N352 E353 E354 T358 R359 E360 Y462 T463 Y556	N352-Q356 VanDerWaalsContact O-CG 3.27Å; N352-Q356 WeakPolarHBondContact O-CG 3.29Å; N352-Q356 PolarHBondContact O-N 3.43Å; N352-Q356 PolarHBondContact OD1-NE2 3.01Å; N352-Q356 VanDerWaalsContact OD1-NE2 3.07Å; E353-Q356 PolarHBondContact O-N 2.96Å; E354-Q356 VanDerWaalsContact C-N 3.34Å; E354-Q356 PolarHBondContact O-N 3.09Å; Q356-T358 VanDerWaalsContact C-N 3.31Å; Q356-T358 PolarHBondContact O-N 3.33Å; Q356-R359 WeakPolarHBondContact O-CA 3.36Å; Q356-R359 WeakPolarHBondContact O-CB 3.23Å; Q356-R359 PolarHBondContact O-N 3.4Å; Q356-E360 WeakPolarHBondContact O-CG 3.49Å; Q356-E360 PolarHBondContact O-N 3.48Å; Q356-Y462 HydrophobicContact CB-CD1 4.01Å; Q356-Y462 HydrophobicContact CB-CE1 4.15Å; Q356-Y462 HydrophobicContact CG-CD1 4.01Å; Q356-Y462 VanDerWaalsContact OE1-CD1 3.26Å; Q356-T463 PolarHBondContact NE2-O 2.89Å; Q356-T463 VanDerWaalsContact NE2-O 3.07Å; Q356-Y556 HydrophobicContact CG-CE1 4.16Å
357	T	92.9	Very high	87.6	Confident	50 Å²	50	59.8 Å²	59.8	31%	0.307	30%	0.3	S	S	.	.	H	α-helix	trans	-61.3	-38.6	177.6	49.2	0	0	0	0	112.2	E353 E354 R359 E360 L361	E353-T357 HydrophobicContact CG-CG2 4.1Å; E353-T357 WeakPolarHBondContact O-CB 3.48Å; E353-T357 WeakPolarHBondContact O-CG2 3.32Å; E353-T357 PolarHBondContact O-N 3.21Å; E353-T357 PolarHBondContact O-OG1 3.28Å; E353-T357 WeakPolarHBondContact OE1-CG2 3.34Å; E354-T357 WeakPolarHBondContact CA-OG1 3.21Å; E354-T357 PolarHBondContact O-OG1 3.34Å; T357-R359 VanDerWaalsContact C-N 3.28Å; T357-R359 PolarHBondContact O-N 3.41Å; T357-E360 PolarHBondContact O-N 2.86Å; T357-E360 VanDerWaalsContact O-N 3.14Å; T357-L361 PolarHBondContact O-N 3.13Å
358	T	92.1	Very high	89	Confident	13 Å²	13	55.9 Å²	55.9	8%	0.08	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-33.4	174.4	51.4	0	0	0	0	112.5	E354 L355 Q356 L361 A375 V379	E354-T358 VanDerWaalsContact O-CG2 3.28Å; E354-T358 WeakPolarHBondContact O-CG2 3.39Å; E354-T358 PolarHBondContact O-N 3.31Å; E354-T358 PolarHBondContact O-OG1 2.86Å; L355-T358 PolarHBondContact O-OG1 3.41Å; Q356-T358 VanDerWaalsContact C-N 3.31Å; Q356-T358 PolarHBondContact O-N 3.33Å; T358-L361 WeakPolarHBondContact O-CB 3.43Å; T358-A375 HydrophobicContact CG2-CB 3.68Å; T358-V379 HydrophobicContact CG2-CG2 3.8Å
359	R	89.6	Confident	90.2	Very high	33 Å²	33	56.7 Å²	56.7	13%	0.125	28%	0.276	C	S	.	.	H	α-helix	trans	-72.1	-29	173.2	-68.7	-178.9	69.8	-173.2	-6.2	112.9	L355 Q356 T357 L361 R372 D457 L461 T463	L355-R359 WeakPolarHBondContact O-CG 3.32Å; Q356-R359 WeakPolarHBondContact O-CA 3.36Å; Q356-R359 WeakPolarHBondContact O-CB 3.23Å; Q356-R359 PolarHBondContact O-N 3.4Å; T357-R359 VanDerWaalsContact C-N 3.28Å; T357-R359 PolarHBondContact O-N 3.41Å; R359-L361 VanDerWaalsContact C-N 3.28Å; R359-L361 PolarHBondContact O-N 3.35Å; R359-R372 PolarHBondContact O-NE 3.14Å; R359-R372 VanDerWaalsContact O-NE 3.1Å; R359-R372 PolarHBondContact O-NH2 2.89Å; R359-D457 IonicContact NE-OD1 2.84Å; R359-D457 IonicContact NH2-OD1 2.72Å; R359-L461 PolarHBondContact NH2-O 2.69Å; R359-L461 VanDerWaalsContact NH2-O 3.07Å; R359-T463 PolarHBondContact NH1-OG1 3.45Å; R359-T463 VanDerWaalsContact NH1-OG1 3.13Å
360	E	91.3	Very high	90.3	Very high	85 Å²	85	56 Å²	56	40%	0.397	27%	0.274	S	S	.	.	H	α-helix	trans	-79.1	-8.1	178.4	-70.6	167.1	172.1	0	0	113.7	Q356 T357 Y462 R554	Q356-E360 WeakPolarHBondContact O-CG 3.49Å; Q356-E360 PolarHBondContact O-N 3.48Å; T357-E360 PolarHBondContact O-N 2.86Å; T357-E360 VanDerWaalsContact O-N 3.14Å; E360-Y462 HydrophobicContact CG-CE1 4.01Å; E360-Y462 WeakPolarHBondContact CG-OH 3.47Å; E360-Y462 WeakPolarHBondContact OE1-CE1 3.46Å; E360-Y462 VanDerWaalsContact OE1-CZ 3.25Å; E360-Y462 PolarHBondContact OE1-OH 3.08Å; E360-R554 IonicContact OE1-CZ 2.97Å; E360-R554 IonicContact OE1-NE 2.91Å; E360-R554 PolarHBondContact OE1-NE 3.12Å; E360-R554 IonicContact OE1-NH2 2.86Å; E360-R554 PolarHBondContact OE1-NH2 3.31Å; E360-R554 IonicContact OE2-CZ 3.42Å; E360-R554 IonicContact OE2-NE 2.78Å; E360-R554 IonicContact OE2-NH2 3.23Å; E360-R554 PolarHBondContact OE2-NH2 3.33Å
361	L	91.4	Very high	90.3	Very high	56 Å²	56	57 Å²	57	29%	0.293	28%	0.28	S	S	.	.	S	Bend	trans	-56.3	145.6	177.2	-72	172.6	0	0	0	111.7	T357 T358 R359 R372 A375	T357-L361 PolarHBondContact O-N 3.13Å; T358-L361 WeakPolarHBondContact O-CB 3.43Å; R359-L361 VanDerWaalsContact C-N 3.28Å; R359-L361 PolarHBondContact O-N 3.35Å; L361-R372 HydrophobicContact CB-CB 3.94Å; L361-R372 HydrophobicContact CB-CG 3.95Å; L361-R372 HydrophobicContact CD1-CB 4.27Å; L361-R372 WeakPolarHBondContact O-CD 3.46Å; L361-A375 HydrophobicContact CD1-CB 3.86Å
362	P	88.8	Confident	90.3	Very high	73 Å²	73	58.1 Å²	58.1	47%	0.474	28%	0.284	S	S	.	.			trans	-53.6	152.1	176.3	-26.4	35.3	0	0	0	112.9	E368	P362-E368 HydrophobicContact CB-CB 4.26Å; P362-E368 HydrophobicContact CB-CG 3.97Å; P362-E368 WeakPolarHBondContact CB-OE2 3.24Å
363	R	89.4	Confident	90.3	Very high	102 Å²	102	59.2 Å²	59.2	39%	0.385	29%	0.289	S	S	.	.			trans	-141	24.5	-177.3	61.6	-180	176.9	-178.2	-1.2	113.3	R369 D457 E459	R363-R369 HydrophobicContact CB-CG 3.91Å; R363-D457 PolarHBondContact NH1-O 3.23Å; R363-D457 VanDerWaalsContact NH1-O 3.12Å; R363-D457 IonicContact NH1-OD2 2.79Å; R363-E459 IonicContact NH2-OE2 3.57Å; R363-E459 PolarHBondContact NH2-OE2 3.25Å
364	K	89.3	Confident	90.2	Very high	195 Å²	195	61.5 Å²	61.5	85%	0.848	30%	0.295	S	S	*	.	S	Bend	trans	-79	-41	-171.9	-66	-178.9	179.1	176.9	0	112.4	E368	K364-E368 WeakPolarHBondContact CB-OE2 3.36Å; K364-E368 PolarHBondContact N-OE2 3.46Å
365	N	89.6	Confident	90.2	Very high	68 Å²	68	60 Å²	60	36%	0.364	29%	0.292	S	S	.	.	S	Bend	trans	-116.8	168.2	-179.9	58.8	51.2	0	0	0	111.1	P367 E368 R369	N365-P367 WeakPolarHBondContact OD1-CD 3.43Å; N365-E368 PolarHBondContact ND2-OE1 3.38Å; N365-E368 VanDerWaalsContact OD1-CB 3.22Å; N365-E368 WeakPolarHBondContact OD1-CB 3.29Å; N365-E368 WeakPolarHBondContact OD1-CG 3.32Å; N365-E368 PolarHBondContact OD1-N 2.88Å; N365-R369 WeakPolarHBondContact O-CG 3.34Å; N365-R369 PolarHBondContact O-N 3.21Å; N365-R369 VanDerWaalsContact O-N 3.11Å
366	L	85.4	Confident	90.2	Very high	50 Å²	50	61 Å²	61	26%	0.262	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-47	-179.8	178.9	67.5	0	0	0	112.7	E368 R369 L370 D997	L366-E368 PolarHBondContact O-N 3.19Å; L366-R369 PolarHBondContact O-N 3.46Å; L366-R369 VanDerWaalsContact O-N 3.13Å; L366-L370 HydrophobicContact CD1-CD1 4.14Å; L366-L370 HydrophobicContact CD1-CD2 4.33Å; L366-L370 HydrophobicContact CD1-CG 4.01Å; L366-L370 HydrophobicContact CG-CD1 3.92Å; L366-L370 HydrophobicContact CG-CG 4.24Å; L366-L370 WeakPolarHBondContact O-CG 3.29Å; L366-L370 PolarHBondContact O-N 3.34Å; L366-D997 HydrophobicContact CD1-CB 4.05Å
367	P	85.7	Confident	90.2	Very high	78 Å²	78	61.3 Å²	61.3	51%	0.506	30%	0.298	S	S	.	.	H	α-helix	trans	-56.1	-44.5	177.4	-27.6	35.3	0	0	0	114	N365 R369 L370 L371	N365-P367 WeakPolarHBondContact OD1-CD 3.43Å; P367-R369 PolarHBondContact O-N 3.08Å; P367-L370 PolarHBondContact O-N 3.35Å; P367-L371 WeakPolarHBondContact O-CB 3.4Å; P367-L371 PolarHBondContact O-N 3.27Å
368	E	88.2	Confident	90.1	Very high	58 Å²	58	65 Å²	65	27%	0.271	31%	0.31	S	S	.	.	H	α-helix	trans	-60.7	-44.1	175.4	-77	170.4	-163	0	0	111.8	P362 K364 N365 L366 L371 R372	P362-E368 HydrophobicContact CB-CB 4.26Å; P362-E368 HydrophobicContact CB-CG 3.97Å; P362-E368 WeakPolarHBondContact CB-OE2 3.24Å; K364-E368 WeakPolarHBondContact CB-OE2 3.36Å; K364-E368 PolarHBondContact N-OE2 3.46Å; N365-E368 PolarHBondContact ND2-OE1 3.38Å; N365-E368 VanDerWaalsContact OD1-CB 3.22Å; N365-E368 WeakPolarHBondContact OD1-CB 3.29Å; N365-E368 WeakPolarHBondContact OD1-CG 3.32Å; N365-E368 PolarHBondContact OD1-N 2.88Å; L366-E368 PolarHBondContact O-N 3.19Å; E368-L371 PolarHBondContact O-N 3.25Å; E368-R372 VanDerWaalsContact O-CB 3.26Å; E368-R372 WeakPolarHBondContact O-CB 3.5Å; E368-R372 PolarHBondContact O-N 3.01Å
369	R	90.1	Very high	90.2	Very high	89 Å²	89	64.9 Å²	64.9	34%	0.336	31%	0.309	S	S	.	.	H	α-helix	trans	-63.4	-42.5	177.7	-72.1	-173.8	-64.7	151.3	8	112.1	R363 N365 L366 P367 R372 E373 D997	R363-R369 HydrophobicContact CB-CG 3.91Å; N365-R369 WeakPolarHBondContact O-CG 3.34Å; N365-R369 PolarHBondContact O-N 3.21Å; N365-R369 VanDerWaalsContact O-N 3.11Å; L366-R369 PolarHBondContact O-N 3.46Å; L366-R369 VanDerWaalsContact O-N 3.13Å; P367-R369 PolarHBondContact O-N 3.08Å; R369-R372 WeakPolarHBondContact O-CB 3.37Å; R369-R372 PolarHBondContact O-N 3.18Å; R369-E373 WeakPolarHBondContact O-CB 3.47Å; R369-E373 WeakPolarHBondContact O-CG 3.44Å; R369-E373 PolarHBondContact O-N 3.13Å; R369-D997 IonicContact CZ-OD1 3.63Å; R369-D997 IonicContact CZ-OD2 2.94Å; R369-D997 IonicContact NE-OD2 2.8Å; R369-D997 PolarHBondContact NE-OD2 3.43Å; R369-D997 VanDerWaalsContact NH1-CG 3.34Å; R369-D997 IonicContact NH1-OD1 2.86Å; R369-D997 PolarHBondContact NH1-OD1 3.28Å; R369-D997 IonicContact NH1-OD2 3.29Å; R369-D997 PolarHBondContact NH1-OD2 2.92Å; R369-D997 VanDerWaalsContact NH1-OD2 3.1Å; R369-D997 IonicContact NH2-OD1 2.69Å; R369-D997 PolarHBondContact NH2-OD1 3.14Å; R369-D997 IonicContact NH2-OD2 2.78Å; R369-D997 PolarHBondContact NH2-OD2 3.16Å
370	L	87.4	Confident	90.4	Very high	15 Å²	15	65 Å²	65	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-66.8	-43	177.4	-65.9	172.2	0	0	0	112.1	L366 P367 R372 E373 R374 L1027 V1031	L366-L370 HydrophobicContact CD1-CD1 4.14Å; L366-L370 HydrophobicContact CD1-CD2 4.33Å; L366-L370 HydrophobicContact CD1-CG 4.01Å; L366-L370 HydrophobicContact CG-CD1 3.92Å; L366-L370 HydrophobicContact CG-CG 4.24Å; L366-L370 WeakPolarHBondContact O-CG 3.29Å; L366-L370 PolarHBondContact O-N 3.34Å; P367-L370 PolarHBondContact O-N 3.35Å; L370-R372 VanDerWaalsContact C-N 3.28Å; L370-R372 PolarHBondContact O-N 3.45Å; L370-E373 PolarHBondContact O-N 3.11Å; L370-R374 VanDerWaalsContact O-CB 3.3Å; L370-R374 WeakPolarHBondContact O-CB 3.4Å; L370-R374 PolarHBondContact O-N 3.39Å; L370-L1027 HydrophobicContact CD1-CD2 3.49Å; L370-L1027 VanDerWaalsContact CD1-CD2 3.49Å; L370-L1027 HydrophobicContact CD2-CB 4.49Å; L370-L1027 HydrophobicContact CD2-CD2 3.89Å; L370-L1027 HydrophobicContact CG-CD2 4.33Å; L370-V1031 HydrophobicContact CD2-CG2 4.03Å
371	L	88.2	Confident	90.4	Very high	102 Å²	102	61.6 Å²	61.6	53%	0.534	30%	0.297	S	S	.	.	H	α-helix	trans	-58.9	-43.9	174.5	-179.4	67.3	0	0	0	110.8	P367 E368 A375	P367-L371 WeakPolarHBondContact O-CB 3.4Å; P367-L371 PolarHBondContact O-N 3.27Å; E368-L371 PolarHBondContact O-N 3.25Å; L371-A375 WeakPolarHBondContact O-CB 3.32Å; L371-A375 PolarHBondContact O-N 3.38Å
372	R	91.6	Very high	90.4	Very high	24 Å²	24	61.3 Å²	61.3	9%	0.091	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-51	175.9	176.4	173.6	-171.8	-101.4	1.3	112.1	R359 L361 E368 R369 L370 R374 A375 I376 D457	R359-R372 PolarHBondContact O-NE 3.14Å; R359-R372 VanDerWaalsContact O-NE 3.1Å; R359-R372 PolarHBondContact O-NH2 2.89Å; L361-R372 HydrophobicContact CB-CB 3.94Å; L361-R372 HydrophobicContact CB-CG 3.95Å; L361-R372 HydrophobicContact CD1-CB 4.27Å; L361-R372 WeakPolarHBondContact O-CD 3.46Å; E368-R372 VanDerWaalsContact O-CB 3.26Å; E368-R372 WeakPolarHBondContact O-CB 3.5Å; E368-R372 PolarHBondContact O-N 3.01Å; R369-R372 WeakPolarHBondContact O-CB 3.37Å; R369-R372 PolarHBondContact O-N 3.18Å; L370-R372 VanDerWaalsContact C-N 3.28Å; L370-R372 PolarHBondContact O-N 3.45Å; R372-R374 VanDerWaalsContact C-N 3.33Å; R372-R374 PolarHBondContact O-N 3.39Å; R372-A375 PolarHBondContact O-N 3.13Å; R372-I376 HydrophobicContact CG-CD1 3.78Å; R372-I376 HydrophobicContact CG-CG1 4.43Å; R372-I376 WeakPolarHBondContact O-CB 3.18Å; R372-I376 VanDerWaalsContact O-CG1 3.27Å; R372-I376 WeakPolarHBondContact O-CG1 3.46Å; R372-I376 PolarHBondContact O-N 3.46Å; R372-D457 IonicContact CZ-OD2 2.9Å; R372-D457 IonicContact NH1-OD2 3.76Å; R372-D457 PolarHBondContact NH1-OD2 3.5Å; R372-D457 IonicContact NH2-OD1 3.54Å; R372-D457 PolarHBondContact NH2-OD1 3.05Å; R372-D457 IonicContact NH2-OD2 3.66Å; R372-D457 PolarHBondContact NH2-OD2 3.09Å
373	E	92.2	Very high	90.7	Very high	24 Å²	24	57.9 Å²	57.9	11%	0.112	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-42	178.7	-73.2	-176.5	161.8	0	0	111.7	R369 L370 A375 I376 F377 A995 S996 V1031	R369-E373 WeakPolarHBondContact O-CB 3.47Å; R369-E373 WeakPolarHBondContact O-CG 3.44Å; R369-E373 PolarHBondContact O-N 3.13Å; L370-E373 PolarHBondContact O-N 3.11Å; E373-A375 PolarHBondContact O-N 3.46Å; E373-I376 PolarHBondContact O-N 3.4Å; E373-F377 WeakPolarHBondContact O-CB 3.41Å; E373-F377 PolarHBondContact O-N 2.94Å; E373-A995 VanDerWaalsContact OE2-CA 3.29Å; E373-A995 WeakPolarHBondContact OE2-CA 3.39Å; E373-S996 WeakPolarHBondContact OE1-CB 3.48Å; E373-S996 PolarHBondContact OE1-N 3.26Å; E373-S996 PolarHBondContact OE2-N 3.19Å; E373-V1031 HydrophobicContact CB-CG1 3.86Å; E373-V1031 HydrophobicContact CB-CG2 3.96Å
374	R	91.9	Very high	91	Very high	116 Å²	116	53.2 Å²	53.2	44%	0.438	26%	0.256	S	S	.	.	H	α-helix	trans	-58.4	-47.1	173.8	-178.6	-174.2	172.8	-173.6	-2.3	111.5	E65 L370 R372 F377 K378 N1030	E65-R374 IonicContact OE1-NH2 2.82Å; L370-R374 VanDerWaalsContact O-CB 3.3Å; L370-R374 WeakPolarHBondContact O-CB 3.4Å; L370-R374 PolarHBondContact O-N 3.39Å; R372-R374 VanDerWaalsContact C-N 3.33Å; R372-R374 PolarHBondContact O-N 3.39Å; R374-F377 PolarHBondContact O-N 3.41Å; R374-K378 WeakPolarHBondContact O-CB 3.3Å; R374-K378 PolarHBondContact O-N 3.38Å; R374-N1030 VanDerWaalsContact CD-O 3.29Å; R374-N1030 WeakPolarHBondContact CD-O 3.45Å; R374-N1030 WeakPolarHBondContact CG-O 3.44Å
375	A	91.5	Very high	91.1	Very high	24 Å²	24	45.3 Å²	45.3	20%	0.198	23%	0.227	C	C	.	.	H	α-helix	trans	-66.7	-44.5	-179.2	0	0	0	0	0	111.7	T358 L361 L371 R372 E373 K378 V379	T358-A375 HydrophobicContact CG2-CB 3.68Å; L361-A375 HydrophobicContact CD1-CB 3.86Å; L371-A375 WeakPolarHBondContact O-CB 3.32Å; L371-A375 PolarHBondContact O-N 3.38Å; R372-A375 PolarHBondContact O-N 3.13Å; E373-A375 PolarHBondContact O-N 3.46Å; A375-K378 PolarHBondContact O-N 2.85Å; A375-V379 WeakPolarHBondContact O-CG2 3.47Å; A375-V379 PolarHBondContact O-N 3.46Å
376	I	93	Very high	91.2	Very high	25 Å²	25	42 Å²	42	13%	0.128	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-51.1	175	-69.5	170.6	0	0	0	109.8	R372 E373 K378 V379 H380 P993	R372-I376 HydrophobicContact CG-CD1 3.78Å; R372-I376 HydrophobicContact CG-CG1 4.43Å; R372-I376 WeakPolarHBondContact O-CB 3.18Å; R372-I376 VanDerWaalsContact O-CG1 3.27Å; R372-I376 WeakPolarHBondContact O-CG1 3.46Å; R372-I376 PolarHBondContact O-N 3.46Å; E373-I376 PolarHBondContact O-N 3.4Å; I376-K378 PolarHBondContact O-N 3.45Å; I376-V379 PolarHBondContact O-N 3.02Å; I376-H380 WeakPolarHBondContact O-CB 3.41Å; I376-H380 PolarHBondContact O-CD2 3.48Å; I376-H380 PolarHBondContact O-N 2.95Å; I376-P993 HydrophobicContact CG2-CB 3.78Å; I376-P993 HydrophobicContact CG2-CG 3.89Å
377	F	94.2	Very high	91.6	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.035	20%	0.197	C	C	.	.	H	α-helix	trans	-57	-49.2	-179.8	179.3	-102.7	0	0	0	112	P310 F311 E373 R374 H380 S381 V1031 Y1032 H1036	P310-F377 HydrophobicContact CB-CE1 3.91Å; P310-F377 HydrophobicContact CB-CZ 3.54Å; P310-F377 HydrophobicContact CG-CE1 4.16Å; P310-F377 HydrophobicContact CG-CZ 3.9Å; F311-F377 HydrophobicContact CE2-CE2 4.05Å; F311-F377 HydrophobicContact CE2-CZ 4.3Å; F311-F377 HydrophobicContact CZ-CE2 4.23Å; E373-F377 WeakPolarHBondContact O-CB 3.41Å; E373-F377 PolarHBondContact O-N 2.94Å; R374-F377 PolarHBondContact O-N 3.41Å; F377-H380 PolarHBondContact O-N 3.37Å; F377-S381 PolarHBondContact O-N 3.27Å; F377-S381 PolarHBondContact O-OG 3.22Å; F377-V1031 HydrophobicContact CB-CG1 4.44Å; F377-Y1032 HydrophobicContact CB-CD1 4.33Å; F377-Y1032 AromaticContact CD1-CD1 3.88Å; F377-Y1032 HydrophobicContact CD1-CD1 3.88Å; F377-Y1032 AromaticContact CD2-CD1 3.4Å; F377-Y1032 HydrophobicContact CD2-CD1 3.4Å; F377-Y1032 AromaticContact CD2-CE1 3.59Å; F377-Y1032 HydrophobicContact CD2-CE1 3.59Å; F377-Y1032 AromaticContact CE1-CD1 3.96Å; F377-Y1032 HydrophobicContact CE1-CD1 3.96Å; F377-Y1032 HydrophobicContact CE1-CG 4.49Å; F377-Y1032 AromaticContact CE2-CD1 3.48Å; F377-Y1032 HydrophobicContact CE2-CD1 3.48Å; F377-Y1032 VanDerWaalsContact CE2-CD1 3.48Å; F377-Y1032 AromaticContact CE2-CE1 3.84Å; F377-Y1032 HydrophobicContact CE2-CE1 3.84Å; F377-Y1032 HydrophobicContact CE2-CG 4.42Å; F377-Y1032 AromaticContact CG-CD1 3.59Å; F377-Y1032 HydrophobicContact CG-CD1 3.59Å; F377-Y1032 HydrophobicContact CG-CE1 4.1Å; F377-Y1032 AromaticContact CZ-CD1 3.76Å; F377-Y1032 HydrophobicContact CZ-CD1 3.76Å; F377-Y1032 HydrophobicContact CZ-CG 4.35Å; F377-H1036 AromaticContact CE2-CD2 3.87Å; F377-H1036 AromaticContact CE2-NE2 3.61Å; F377-H1036 AromaticContact CZ-CD2 3.6Å; F377-H1036 AromaticContact CZ-NE2 3.85Å
378	K	91.8	Very high	92	Very high	127 Å²	127	36.6 Å²	36.6	55%	0.552	18%	0.177	S	C	*	.	H	α-helix	trans	-61.5	-47.3	-179.1	-176.6	171.9	-179	174.9	0	113.1	R374 A375 I376 H380 S381 D382	R374-K378 WeakPolarHBondContact O-CB 3.3Å; R374-K378 PolarHBondContact O-N 3.38Å; A375-K378 PolarHBondContact O-N 2.85Å; I376-K378 PolarHBondContact O-N 3.45Å; K378-H380 VanDerWaalsContact C-N 3.31Å; K378-H380 PolarHBondContact O-N 3.34Å; K378-S381 PolarHBondContact O-N 3.39Å; K378-S381 PolarHBondContact O-OG 2.88Å; K378-D382 WeakPolarHBondContact O-CB 3.34Å; K378-D382 VanDerWaalsContact O-CG 3.24Å; K378-D382 PolarHBondContact O-N 2.86Å
379	V	92.8	Very high	92.2	Very high	11 Å²	11	39.3 Å²	39.3	7%	0.067	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-38.5	179.3	177.5	0	0	0	0	110.6	E354 L355 T358 A375 I376 F383	E354-V379 HydrophobicContact CB-CG1 3.93Å; E354-V379 HydrophobicContact CB-CG2 4.4Å; L355-V379 HydrophobicContact CD2-CB 4.46Å; L355-V379 HydrophobicContact CD2-CG1 3.62Å; L355-V379 HydrophobicContact CG-CG1 3.84Å; T358-V379 HydrophobicContact CG2-CG2 3.8Å; A375-V379 WeakPolarHBondContact O-CG2 3.47Å; A375-V379 PolarHBondContact O-N 3.46Å; I376-V379 PolarHBondContact O-N 3.02Å; V379-F383 VanDerWaalsContact O-CB 3.26Å; V379-F383 WeakPolarHBondContact O-CB 3.44Å; V379-F383 PolarHBondContact O-N 3.07Å
380	H	94	Very high	92.3	Very high	34 Å²	34	35.1 Å²	35.1	16%	0.157	17%	0.169	C	C	.	.	H	α-helix	trans	-67.6	-40.2	176.5	-87	-86.1	0	0	0	113.4	I376 F377 K378 F383 A384 P993	I376-H380 WeakPolarHBondContact O-CB 3.41Å; I376-H380 PolarHBondContact O-CD2 3.48Å; I376-H380 PolarHBondContact O-N 2.95Å; F377-H380 PolarHBondContact O-N 3.37Å; K378-H380 VanDerWaalsContact C-N 3.31Å; K378-H380 PolarHBondContact O-N 3.34Å; H380-F383 PolarHBondContact O-N 2.87Å; H380-A384 WeakPolarHBondContact O-CB 3.44Å; H380-A384 PolarHBondContact O-N 3.13Å; H380-P993 HydrophobicContact CB-CG 3.73Å
381	S	92.9	Very high	92.6	Very high	14 Å²	14	34.4 Å²	34.4	10%	0.098	17%	0.165	C	C	.	.	H	α-helix	trans	-64.3	-43.5	175.5	58.8	0	0	0	0	111.4	F377 K378 A384 A385	F377-S381 PolarHBondContact O-N 3.27Å; F377-S381 PolarHBondContact O-OG 3.22Å; K378-S381 PolarHBondContact O-N 3.39Å; K378-S381 PolarHBondContact O-OG 2.88Å; S381-A384 PolarHBondContact O-N 3.27Å; S381-A385 PolarHBondContact O-N 2.8Å
382	D	91.4	Very high	92.8	Very high	50 Å²	50	31.8 Å²	31.8	27%	0.267	15%	0.151	S	C	.	.	H	α-helix	trans	-62.8	-45.9	176.6	-72.3	-2.8	0	0	0	111.6	R349 W351 K378 A384 A385 A386	R349-D382 IonicContact CZ-OD2 3.83Å; R349-D382 IonicContact NH1-OD2 3.88Å; R349-D382 PolarHBondContact NH1-OD2 3.38Å; R349-D382 IonicContact NH2-OD2 3.81Å; R349-D382 PolarHBondContact NH2-OD2 3.49Å; R349-D382 VanDerWaalsContact NH2-OD2 3.11Å; W351-D382 HydrophobicContact CH2-CB 3.98Å; W351-D382 HydrophobicContact CZ3-CB 3.83Å; K378-D382 WeakPolarHBondContact O-CB 3.34Å; K378-D382 VanDerWaalsContact O-CG 3.24Å; K378-D382 PolarHBondContact O-N 2.86Å; D382-A384 VanDerWaalsContact C-N 3.32Å; D382-A384 PolarHBondContact O-N 2.76Å; D382-A385 PolarHBondContact O-N 3.18Å; D382-A386 WeakPolarHBondContact O-CB 3.47Å; D382-A386 PolarHBondContact O-N 3.32Å
383	F	93.9	Very high	92.8	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.009	15%	0.152	C	C	.	.	H	α-helix	trans	-61	-41.8	177.6	-178.4	-100.5	0	0	0	111.2	W351 L355 V379 H380 A386 A387 I418 G465 V467	W351-F383 HydrophobicContact CB-CD2 3.83Å; W351-F383 HydrophobicContact CB-CE2 3.93Å; W351-F383 AromaticContact CD2-CD2 3.7Å; W351-F383 HydrophobicContact CD2-CD2 3.7Å; W351-F383 HydrophobicContact CD2-CE2 4.44Å; W351-F383 HydrophobicContact CE3-CB 3.9Å; W351-F383 AromaticContact CE3-CD2 3.73Å; W351-F383 HydrophobicContact CE3-CD2 3.73Å; W351-F383 HydrophobicContact CE3-CG 4.33Å; W351-F383 AromaticContact CG-CD2 3.76Å; W351-F383 HydrophobicContact CG-CD2 3.76Å; W351-F383 HydrophobicContact CG-CE2 4.06Å; W351-F383 HydrophobicContact CZ3-CB 3.97Å; W351-F383 HydrophobicContact CZ3-CD2 4.49Å; L355-F383 HydrophobicContact CD1-CD2 4.34Å; L355-F383 HydrophobicContact CD1-CG 4.47Å; V379-F383 VanDerWaalsContact O-CB 3.26Å; V379-F383 WeakPolarHBondContact O-CB 3.44Å; V379-F383 PolarHBondContact O-N 3.07Å; H380-F383 PolarHBondContact O-N 2.87Å; F383-A386 PolarHBondContact O-N 2.96Å; F383-A387 WeakPolarHBondContact O-CB 3.45Å; F383-A387 PolarHBondContact O-N 3.47Å; F383-I418 HydrophobicContact CD2-CD1 4.05Å; F383-I418 HydrophobicContact CD2-CG1 4.48Å; F383-I418 HydrophobicContact CE2-CD1 3.77Å; F383-I418 HydrophobicContact CE2-CG1 3.85Å; F383-I418 HydrophobicContact CE2-CG2 4.37Å; F383-I418 HydrophobicContact CZ-CD1 4.46Å; F383-I418 HydrophobicContact CZ-CG2 4.31Å; F383-G465 WeakPolarHBondContact CE1-O 3.45Å; F383-G465 WeakPolarHBondContact CZ-O 3.31Å; F383-V467 HydrophobicContact CD1-CG2 3.77Å; F383-V467 HydrophobicContact CE1-CG2 3.72Å
384	A	94.9	Very high	92.7	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.033	15%	0.149	C	C	.	.	H	α-helix	trans	-63	-42.7	176.2	0	0	0	0	0	112.2	F311 H380 S381 D382 T388 V467 H990	F311-A384 HydrophobicContact CE1-CB 4.29Å; H380-A384 WeakPolarHBondContact O-CB 3.44Å; H380-A384 PolarHBondContact O-N 3.13Å; S381-A384 PolarHBondContact O-N 3.27Å; D382-A384 VanDerWaalsContact C-N 3.32Å; D382-A384 PolarHBondContact O-N 2.76Å; A384-T388 WeakPolarHBondContact O-CB 3.25Å; A384-T388 PolarHBondContact O-N 3.11Å; A384-T388 PolarHBondContact O-OG1 2.88Å; A384-V467 HydrophobicContact CB-CG2 4.36Å; A384-H990 HydrophobicContact CB-CB 4.15Å
385	A	91.8	Very high	92.7	Very high	28 Å²	28	26.4 Å²	26.4	23%	0.231	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-43.7	176.2	0	0	0	0	0	111.9	S381 D382 T388 R389	S381-A385 PolarHBondContact O-N 2.8Å; D382-A385 PolarHBondContact O-N 3.18Å; A385-T388 PolarHBondContact O-N 3.13Å; A385-R389 PolarHBondContact O-N 2.94Å; A385-R389 VanDerWaalsContact O-N 3.15Å
386	A	91.4	Very high	92.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.7	-47.8	176.5	0	0	0	0	0	112.1	W351 D382 F383 T388 R389 G390 W415 I418	W351-A386 HydrophobicContact CH2-CB 3.78Å; W351-A386 HydrophobicContact CZ2-CB 3.35Å; D382-A386 WeakPolarHBondContact O-CB 3.47Å; D382-A386 PolarHBondContact O-N 3.32Å; F383-A386 PolarHBondContact O-N 2.96Å; A386-T388 VanDerWaalsContact C-N 3.27Å; A386-T388 PolarHBondContact O-N 3.29Å; A386-R389 PolarHBondContact O-N 3.01Å; A386-G390 PolarHBondContact O-N 3.22Å; A386-W415 VanDerWaalsContact O-CZ3 3.27Å; A386-W415 WeakPolarHBondContact O-CZ3 3.45Å; A386-I418 HydrophobicContact CB-CD1 3.96Å
387	A	94.8	Very high	92.3	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.5	-38.7	176.5	0	0	0	0	0	112.1	F383 G390 A391 I418 F420 V467 A478	F383-A387 WeakPolarHBondContact O-CB 3.45Å; F383-A387 PolarHBondContact O-N 3.47Å; A387-G390 PolarHBondContact O-N 3.01Å; A387-A391 VanDerWaalsContact O-CB 3.32Å; A387-A391 WeakPolarHBondContact O-CB 3.39Å; A387-A391 PolarHBondContact O-N 3.24Å; A387-I418 HydrophobicContact CB-CD1 4.38Å; A387-F420 WeakPolarHBondContact O-CE1 3.44Å; A387-V467 HydrophobicContact CB-CB 3.84Å; A387-V467 HydrophobicContact CB-CG1 4.02Å; A387-V467 HydrophobicContact CB-CG2 4.03Å; A387-A478 HydrophobicContact CB-CB 3.7Å
388	T	94.6	Very high	92	Very high	13 Å²	13	33.3 Å²	33.3	8%	0.08	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-48.7	177.1	-58.1	0	0	0	0	111.5	A384 A385 A386 G390 A391 M392 P986 V988	A384-T388 WeakPolarHBondContact O-CB 3.25Å; A384-T388 PolarHBondContact O-N 3.11Å; A384-T388 PolarHBondContact O-OG1 2.88Å; A385-T388 PolarHBondContact O-N 3.13Å; A386-T388 VanDerWaalsContact C-N 3.27Å; A386-T388 PolarHBondContact O-N 3.29Å; T388-G390 PolarHBondContact O-N 3.09Å; T388-A391 PolarHBondContact O-N 2.9Å; T388-M392 HydrophobicContact CG2-SD 4.43Å; T388-M392 WeakPolarHBondContact O-CG 3.48Å; T388-M392 PolarHBondContact O-N 2.84Å; T388-M392 VanDerWaalsContact O-N 3.11Å; T388-P986 HydrophobicContact CG2-CB 4.08Å; T388-P986 HydrophobicContact CG2-CG 3.46Å; T388-P986 VanDerWaalsContact CG2-CG 3.46Å; T388-V988 HydrophobicContact CG2-CG2 3.7Å; T388-V988 WeakPolarHBondContact OG1-CG2 3.41Å
389	R	91.4	Very high	91.8	Very high	116 Å²	116	28 Å²	28	44%	0.438	16%	0.162	S	C	.	.	H	α-helix	trans	-61.5	-42.4	176.3	-70	-171.6	-65.1	-94.5	0.9	112.1	A385 A386 M392 A393 W415	A385-R389 PolarHBondContact O-N 2.94Å; A385-R389 VanDerWaalsContact O-N 3.15Å; A386-R389 PolarHBondContact O-N 3.01Å; R389-M392 PolarHBondContact O-N 3.13Å; R389-A393 WeakPolarHBondContact O-CB 3.32Å; R389-A393 PolarHBondContact O-N 2.67Å; R389-W415 HydrophobicContact CB-CH2 3.84Å; R389-W415 HydrophobicContact CB-CZ3 4.28Å
390	G	92.1	Very high	91.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-43.9	177.7	0	0	0	0	0	112.8	A386 A387 T388 M392 A393 V394	A386-G390 PolarHBondContact O-N 3.22Å; A387-G390 PolarHBondContact O-N 3.01Å; T388-G390 PolarHBondContact O-N 3.09Å; G390-M392 PolarHBondContact O-N 3.39Å; G390-A393 PolarHBondContact O-N 3.38Å; G390-V394 WeakPolarHBondContact O-CG2 3.35Å; G390-V394 PolarHBondContact O-N 3.07Å
391	A	95	Very high	91.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-42.5	176.9	0	0	0	0	0	112.1	A387 T388 V394 I395 F420 V469 V476	A387-A391 VanDerWaalsContact O-CB 3.32Å; A387-A391 WeakPolarHBondContact O-CB 3.39Å; A387-A391 PolarHBondContact O-N 3.24Å; T388-A391 PolarHBondContact O-N 2.9Å; A391-V394 PolarHBondContact O-N 2.94Å; A391-I395 WeakPolarHBondContact O-CG1 3.23Å; A391-I395 PolarHBondContact O-N 2.94Å; A391-I395 VanDerWaalsContact O-N 3.14Å; A391-F420 HydrophobicContact CB-CD1 4.4Å; A391-F420 HydrophobicContact CB-CE1 4.31Å; A391-V469 HydrophobicContact CB-CB 3.81Å; A391-V469 HydrophobicContact CB-CG1 3.94Å; A391-V469 HydrophobicContact CB-CG2 3.86Å; A391-V476 HydrophobicContact CB-CB 4.03Å; A391-V476 HydrophobicContact CB-CG1 3.97Å; A391-V476 HydrophobicContact CB-CG2 4.36Å
392	M	92.6	Very high	91.2	Very high	47 Å²	47	38 Å²	38	23%	0.232	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-46.6	173.6	-67.7	172.5	66.4	0	0	111.3	T388 R389 G390 V394 I395 D396 Y471 P986	T388-M392 HydrophobicContact CG2-SD 4.43Å; T388-M392 WeakPolarHBondContact O-CG 3.48Å; T388-M392 PolarHBondContact O-N 2.84Å; T388-M392 VanDerWaalsContact O-N 3.11Å; R389-M392 PolarHBondContact O-N 3.13Å; G390-M392 PolarHBondContact O-N 3.39Å; M392-V394 VanDerWaalsContact C-N 3.3Å; M392-V394 PolarHBondContact O-N 3.44Å; M392-I395 PolarHBondContact O-N 3.4Å; M392-D396 WeakPolarHBondContact O-CB 3.49Å; M392-D396 VanDerWaalsContact O-CG 3.31Å; M392-D396 PolarHBondContact O-N 2.97Å; M392-Y471 HydrophobicContact CB-CE1 4.27Å; M392-Y471 HydrophobicContact CE-CE2 4.32Å; M392-Y471 HydrophobicContact CG-CD1 4.28Å; M392-Y471 HydrophobicContact CG-CD2 4.35Å; M392-Y471 HydrophobicContact CG-CE1 4.2Å; M392-Y471 HydrophobicContact CG-CE2 4.23Å; M392-Y471 HydrophobicContact CG-CG 4.38Å; M392-P986 HydrophobicContact CG-CB 4.45Å; M392-P986 HydrophobicContact CG-CG 4.24Å; M392-P986 HydrophobicContact SD-CG 3.73Å
393	A	90.4	Very high	91	Very high	13 Å²	13	36.8 Å²	36.8	11%	0.107	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-36.1	179.2	0	0	0	0	0	113.1	R389 G390 G397 N398 V399	R389-A393 WeakPolarHBondContact O-CB 3.32Å; R389-A393 PolarHBondContact O-N 2.67Å; G390-A393 PolarHBondContact O-N 3.38Å; A393-G397 PolarHBondContact O-N 3.26Å; A393-N398 HydrophobicContact CB-CB 4.34Å; A393-N398 WeakPolarHBondContact O-CB 3.2Å; A393-N398 PolarHBondContact O-N 3.32Å; A393-V399 HydrophobicContact CB-CG2 3.78Å; A393-V399 PolarHBondContact O-N 3.38Å
394	V	91.3	Very high	90.7	Very high	8 Å²	8	41 Å²	41	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-51	174	167.5	0	0	0	0	110.9	G390 A391 M392 D396 G397 V399 F413 F420	G390-V394 WeakPolarHBondContact O-CG2 3.35Å; G390-V394 PolarHBondContact O-N 3.07Å; A391-V394 PolarHBondContact O-N 2.94Å; M392-V394 VanDerWaalsContact C-N 3.3Å; M392-V394 PolarHBondContact O-N 3.44Å; V394-D396 VanDerWaalsContact C-N 3.33Å; V394-D396 PolarHBondContact O-N 3.33Å; V394-G397 PolarHBondContact O-N 3.44Å; V394-G397 VanDerWaalsContact O-N 3.1Å; V394-V399 HydrophobicContact CG2-CB 4.03Å; V394-V399 HydrophobicContact CG2-CG1 4.36Å; V394-V399 HydrophobicContact CG2-CG2 4.1Å; V394-F413 HydrophobicContact CB-CG 4.44Å; V394-F413 HydrophobicContact CG1-CB 4.46Å; V394-F413 HydrophobicContact CG1-CD1 4.04Å; V394-F413 HydrophobicContact CG1-CD2 3.45Å; V394-F413 VanDerWaalsContact CG1-CD2 3.45Å; V394-F413 HydrophobicContact CG1-CE1 4.11Å; V394-F413 HydrophobicContact CG1-CE2 3.55Å; V394-F413 HydrophobicContact CG1-CG 3.72Å; V394-F413 HydrophobicContact CG1-CZ 3.89Å; V394-F413 HydrophobicContact CG2-CB 3.73Å; V394-F413 HydrophobicContact CG2-CD1 4.25Å; V394-F413 HydrophobicContact CG2-CD2 4.28Å; V394-F413 HydrophobicContact CG2-CG 3.84Å; V394-F420 HydrophobicContact CG2-CB 4.19Å; V394-F420 HydrophobicContact CG2-CD2 4.35Å; V394-F420 HydrophobicContact CG2-CG 4.16Å
395	I	91.5	Very high	90.2	Very high	31 Å²	31	44.6 Å²	44.6	16%	0.159	27%	0.272	C	S	.	.	H	α-helix	trans	-67.9	-33.3	-178.4	-63.6	-54.9	0	0	0	112.3	A391 M392 G397 L422 Y471 R472 Y474 V476	A391-I395 WeakPolarHBondContact O-CG1 3.23Å; A391-I395 PolarHBondContact O-N 2.94Å; A391-I395 VanDerWaalsContact O-N 3.14Å; M392-I395 PolarHBondContact O-N 3.4Å; I395-G397 PolarHBondContact O-N 2.93Å; I395-L422 HydrophobicContact CD1-CD2 3.79Å; I395-Y471 HydrophobicContact CB-CD1 3.75Å; I395-Y471 HydrophobicContact CB-CE1 4.18Å; I395-Y471 HydrophobicContact CG1-CD1 4.12Å; I395-Y471 HydrophobicContact CG2-CD1 3.71Å; I395-Y471 HydrophobicContact CG2-CE1 4.02Å; I395-R472 HydrophobicContact CG2-CB 4.3Å; I395-Y474 HydrophobicContact CD1-CD1 4.45Å; I395-Y474 HydrophobicContact CD1-CD2 4.04Å; I395-Y474 HydrophobicContact CD1-CG 3.77Å; I395-Y474 HydrophobicContact CG2-CD2 4.04Å; I395-V476 HydrophobicContact CD1-CG2 3.79Å; I395-V476 HydrophobicContact CG1-CG2 3.83Å
396	D	88.7	Confident	90	Very high	64 Å²	64	46.5 Å²	46.5	34%	0.342	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.1	175.4	-69.6	-20.5	0	0	0	113.2	M392 V394 N398 R472	M392-D396 WeakPolarHBondContact O-CB 3.49Å; M392-D396 VanDerWaalsContact O-CG 3.31Å; M392-D396 PolarHBondContact O-N 2.97Å; V394-D396 VanDerWaalsContact C-N 3.33Å; V394-D396 PolarHBondContact O-N 3.33Å; D396-N398 VanDerWaalsContact C-N 3.32Å; D396-R472 IonicContact OD1-NH1 2.85Å; D396-R472 PolarHBondContact OD1-NH1 2.92Å
397	G	87.7	Confident	89.5	Confident	60 Å²	60	52.8 Å²	52.8	62%	0.619	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	19.7	178.6	0	0	0	0	0	113.9	A393 V394 I395	A393-G397 PolarHBondContact O-N 3.26Å; V394-G397 PolarHBondContact O-N 3.44Å; V394-G397 VanDerWaalsContact O-N 3.1Å; I395-G397 PolarHBondContact O-N 2.93Å
398	N	86.8	Confident	88.9	Confident	77 Å²	77	54.9 Å²	54.9	41%	0.412	32%	0.318	S	S	.	.			trans	-81.8	-15.3	177	-66.6	-47.5	0	0	0	112.6	A393 D396	A393-N398 HydrophobicContact CB-CB 4.34Å; A393-N398 WeakPolarHBondContact O-CB 3.2Å; A393-N398 PolarHBondContact O-N 3.32Å; D396-N398 VanDerWaalsContact C-N 3.32Å
399	V	88.1	Confident	88.4	Confident	17 Å²	17	59.9 Å²	59.9	10%	0.103	34%	0.336	C	S	.	.	S	Bend	trans	-110.3	130.8	179.6	-174.1	0	0	0	0	110	A393 V394 F413 W415	A393-V399 HydrophobicContact CB-CG2 3.78Å; A393-V399 PolarHBondContact O-N 3.38Å; V394-V399 HydrophobicContact CG2-CB 4.03Å; V394-V399 HydrophobicContact CG2-CG1 4.36Å; V394-V399 HydrophobicContact CG2-CG2 4.1Å; V399-F413 HydrophobicContact CB-CD1 4.38Å; V399-F413 HydrophobicContact CG1-CB 4.1Å; V399-F413 HydrophobicContact CG1-CD1 4.21Å; V399-W415 HydrophobicContact CG1-CB 4.21Å; V399-W415 HydrophobicContact CG2-CB 4.18Å; V399-W415 HydrophobicContact CG2-CG 4.06Å
400	M	87.8	Confident	87.9	Confident	162 Å²	162	56.6 Å²	56.6	80%	0.798	33%	0.326	S	S	*	.			trans	-77.6	137.6	175.2	-69.8	-172.6	62.8	0	0	111.1
401	A	90.6	Very high	87.8	Confident	15 Å²	15	58.3 Å²	58.3	12%	0.124	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-67.4	146.3	172.5	0	0	0	0	0	111.3	N403 P404 Q411 M412 F413	A401-N403 VanDerWaalsContact C-N 3.27Å; A401-P404 WeakPolarHBondContact O-CD 3.29Å; A401-Q411 HydrophobicContact CB-CB 3.77Å; A401-Q411 HydrophobicContact CB-CG 3.77Å; A401-M412 CarbonylContact C-O 3.54Å; A401-M412 WeakPolarHBondContact CA-O 3.33Å; A401-F413 HydrophobicContact CB-CD1 4.09Å; A401-F413 HydrophobicContact CB-CE1 3.74Å; A401-F413 HydrophobicContact CB-CZ 4.2Å
402	I	88.5	Confident	87.6	Confident	91 Å²	91	61.8 Å²	61.8	47%	0.467	35%	0.351	S	S	.	.	S	Bend	trans	-67.8	-34.9	173.9	-58.8	163.8	0	0	0	110.3	P404 M412 I414	I402-P404 WeakPolarHBondContact O-CD 3.36Å; I402-M412 HydrophobicContact CD1-CB 4.43Å; I402-M412 PolarHBondContact N-O 2.94Å; I402-I414 HydrophobicContact CD1-CB 4.28Å; I402-I414 HydrophobicContact CD1-CD1 3.42Å; I402-I414 VanDerWaalsContact CD1-CD1 3.42Å; I402-I414 HydrophobicContact CD1-CG1 3.65Å; I402-I414 HydrophobicContact CG1-CD1 4.32Å
403	N	87.5	Confident	87.6	Confident	24 Å²	24	60.1 Å²	60.1	13%	0.128	34%	0.342	C	S	.	.	S	Bend	trans	-113.9	64.1	-178.6	56.6	-25	0	0	0	110.9	A401 G405 E406 M410 Q411 M412	A401-N403 VanDerWaalsContact C-N 3.27Å; N403-G405 PolarHBondContact O-N 2.64Å; N403-G405 VanDerWaalsContact O-N 3.07Å; N403-E406 HydrophobicContact CB-CG 4.3Å; N403-E406 PolarHBondContact ND2-OE2 2.92Å; N403-E406 PolarHBondContact O-N 2.68Å; N403-E406 VanDerWaalsContact O-N 3.11Å; N403-M410 PolarHBondContact ND2-O 3.34Å; N403-Q411 WeakPolarHBondContact OD1-CA 3.26Å; N403-M412 PolarHBondContact OD1-N 3.39Å; N403-M412 PolarHBondContact OD1-O 3.04Å
404	P	87.3	Confident	87.7	Confident	90 Å²	90	62.1 Å²	62.1	58%	0.584	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-14.9	-174.1	29.7	-36.5	0	0	0	113.8	A401 I402	A401-P404 WeakPolarHBondContact O-CD 3.29Å; I402-P404 WeakPolarHBondContact O-CD 3.36Å
405	G	84.9	Confident	87.6	Confident	81 Å²	81	62.8 Å²	62.8	84%	0.835	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-12.9	176.3	0	0	0	0	0	114.6	N403	N403-G405 PolarHBondContact O-N 2.64Å; N403-G405 VanDerWaalsContact O-N 3.07Å
406	E	86.1	Confident	87.4	Confident	67 Å²	67	62 Å²	62	31%	0.313	35%	0.348	S	S	.	.	S	Bend	trans	-87.8	163.8	175.5	-64.6	-165.2	152.6	0	0	111.7	N403 M410 Q411 R427	N403-E406 HydrophobicContact CB-CG 4.3Å; N403-E406 PolarHBondContact ND2-OE2 2.92Å; N403-E406 PolarHBondContact O-N 2.68Å; N403-E406 VanDerWaalsContact O-N 3.11Å; E406-M410 HydrophobicContact CB-CB 4.23Å; E406-Q411 PolarHBondContact O-NE2 2.82Å; E406-R427 IonicContact OE1-NH2 3.94Å; E406-R427 PolarHBondContact OE1-NH2 2.9Å
407	E	82.7	Confident	87.4	Confident	132 Å²	132	61.6 Å²	61.6	62%	0.617	35%	0.346	S	S	*	.			trans	-60	148.8	176.3	-67	-175.1	175.9	0	0	111.4	R409 M410 Q411	E407-R409 PolarHBondContact O-N 2.83Å; E407-M410 HydrophobicContact CB-CG 4.4Å; E407-M410 WeakPolarHBondContact O-CA 3.4Å; E407-M410 PolarHBondContact O-N 3.07Å; E407-Q411 PolarHBondContact O-N 2.98Å
408	T	80.9	Confident	87.7	Confident	45 Å²	45	58.7 Å²	58.7	28%	0.276	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-56.7	-30.9	-175	49.5	0	0	0	0	114.2	M410 Q411 L422 V897	T408-M410 VanDerWaalsContact C-N 3.26Å; T408-M410 PolarHBondContact O-N 3.36Å; T408-Q411 PolarHBondContact O-N 3.47Å; T408-L422 WeakPolarHBondContact O-CD1 3.24Å; T408-V897 HydrophobicContact CG2-CB 4.45Å; T408-V897 HydrophobicContact CG2-CG1 3.66Å; T408-V897 HydrophobicContact CG2-CG2 4.21Å
409	R	83.6	Confident	88	Confident	118 Å²	118	57.4 Å²	57.4	45%	0.445	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-69.7	-21.3	175.8	-64.1	-176.3	178.4	-163.6	-1.7	113.7	E407 F424 D436	E407-R409 PolarHBondContact O-N 2.83Å; R409-F424 HydrophobicContact CB-CB 4.19Å; R409-F424 HydrophobicContact CB-CD2 3.91Å; R409-F424 HydrophobicContact CB-CG 4.1Å; R409-F424 HydrophobicContact CG-CD1 4.49Å; R409-F424 HydrophobicContact CG-CD2 3.95Å; R409-F424 HydrophobicContact CG-CE2 4.17Å; R409-F424 HydrophobicContact CG-CG 4.12Å; R409-D436 IonicContact NH1-OD2 2.58Å
410	M	82.5	Confident	88.4	Confident	46 Å²	46	56.6 Å²	56.6	23%	0.227	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-101.1	-2.3	-179.5	-51.6	-170.3	179.5	0	0	112.4	N403 E406 E407 T408 V426 R427	N403-M410 PolarHBondContact ND2-O 3.34Å; E406-M410 HydrophobicContact CB-CB 4.23Å; E407-M410 HydrophobicContact CB-CG 4.4Å; E407-M410 WeakPolarHBondContact O-CA 3.4Å; E407-M410 PolarHBondContact O-N 3.07Å; T408-M410 VanDerWaalsContact C-N 3.26Å; T408-M410 PolarHBondContact O-N 3.36Å; M410-V426 HydrophobicContact CB-CG1 4.11Å; M410-V426 HydrophobicContact CB-CG2 4.4Å; M410-V426 HydrophobicContact CE-CG1 4.23Å; M410-V426 HydrophobicContact CG-CB 4.39Å; M410-V426 HydrophobicContact CG-CG1 3.67Å; M410-V426 HydrophobicContact CG-CG2 4.05Å; M410-V426 HydrophobicContact SD-CG1 3.81Å; M410-R427 HydrophobicContact CE-CG 4.48Å; M410-R427 HydrophobicContact SD-CG 4.46Å
411	Q	89.1	Confident	88.7	Confident	36 Å²	36	50.4 Å²	50.4	17%	0.168	28%	0.275	C	S	.	.			trans	-69.4	136.2	-178	-75.7	175	-3.1	0	0	111.4	A401 N403 E406 E407 T408 F413	A401-Q411 HydrophobicContact CB-CB 3.77Å; A401-Q411 HydrophobicContact CB-CG 3.77Å; N403-Q411 WeakPolarHBondContact OD1-CA 3.26Å; E406-Q411 PolarHBondContact O-NE2 2.82Å; E407-Q411 PolarHBondContact O-N 2.98Å; T408-Q411 PolarHBondContact O-N 3.47Å; Q411-F413 HydrophobicContact CB-CE1 4.47Å; Q411-F413 HydrophobicContact CB-CE2 3.82Å; Q411-F413 HydrophobicContact CB-CZ 3.63Å; Q411-F413 WeakPolarHBondContact O-CE2 3.38Å
412	M	90.3	Very high	88.7	Confident	73 Å²	73	50.9 Å²	50.9	36%	0.36	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	145.4	176.4	-62	-179.6	-69.4	0	0	108.9	A401 I402 N403 F419	A401-M412 CarbonylContact C-O 3.54Å; A401-M412 WeakPolarHBondContact CA-O 3.33Å; I402-M412 HydrophobicContact CD1-CB 4.43Å; I402-M412 PolarHBondContact N-O 2.94Å; N403-M412 PolarHBondContact OD1-N 3.39Å; N403-M412 PolarHBondContact OD1-O 3.04Å; M412-F419 HydrophobicContact CB-CE2 3.81Å; M412-F419 HydrophobicContact CB-CZ 4.05Å; M412-F419 HydrophobicContact CG-CE2 4.12Å; M412-F419 HydrophobicContact CG-CZ 3.88Å; M412-F419 HydrophobicContact SD-CE2 3.86Å; M412-F419 HydrophobicContact SD-CZ 3.59Å; M412-F419 VanDerWaalsContact SD-CZ 3.59Å
413	F	93.9	Very high	88.7	Confident	13 Å²	13	47.2 Å²	47.2	6%	0.057	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148.3	-173.3	-49	-99.9	0	0	0	110.2	V394 V399 A401 Q411 F420	V394-F413 HydrophobicContact CB-CG 4.44Å; V394-F413 HydrophobicContact CG1-CB 4.46Å; V394-F413 HydrophobicContact CG1-CD1 4.04Å; V394-F413 HydrophobicContact CG1-CD2 3.45Å; V394-F413 VanDerWaalsContact CG1-CD2 3.45Å; V394-F413 HydrophobicContact CG1-CE1 4.11Å; V394-F413 HydrophobicContact CG1-CE2 3.55Å; V394-F413 HydrophobicContact CG1-CG 3.72Å; V394-F413 HydrophobicContact CG1-CZ 3.89Å; V394-F413 HydrophobicContact CG2-CB 3.73Å; V394-F413 HydrophobicContact CG2-CD1 4.25Å; V394-F413 HydrophobicContact CG2-CD2 4.28Å; V394-F413 HydrophobicContact CG2-CG 3.84Å; V399-F413 HydrophobicContact CB-CD1 4.38Å; V399-F413 HydrophobicContact CG1-CB 4.1Å; V399-F413 HydrophobicContact CG1-CD1 4.21Å; A401-F413 HydrophobicContact CB-CD1 4.09Å; A401-F413 HydrophobicContact CB-CE1 3.74Å; A401-F413 HydrophobicContact CB-CZ 4.2Å; Q411-F413 HydrophobicContact CB-CE1 4.47Å; Q411-F413 HydrophobicContact CB-CE2 3.82Å; Q411-F413 HydrophobicContact CB-CZ 3.63Å; Q411-F413 WeakPolarHBondContact O-CE2 3.38Å; F413-F420 HydrophobicContact CB-CB 4.19Å; F413-F420 PolarHBondContact N-O 3.36Å; F413-F420 PolarHBondContact O-N 2.94Å
414	I	91.8	Very high	88.7	Confident	54 Å²	54	47 Å²	47	28%	0.277	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.4	166.7	-75.9	159.2	0	0	0	107.6	I402 I418 F419 I481 L486	I402-I414 HydrophobicContact CD1-CB 4.28Å; I402-I414 HydrophobicContact CD1-CD1 3.42Å; I402-I414 VanDerWaalsContact CD1-CD1 3.42Å; I402-I414 HydrophobicContact CD1-CG1 3.65Å; I402-I414 HydrophobicContact CG1-CD1 4.32Å; I414-I418 VanDerWaalsContact CA-O 3.32Å; I414-I418 WeakPolarHBondContact CA-O 3.44Å; I414-F419 HydrophobicContact CG1-CD2 4.36Å; I414-I481 HydrophobicContact CD1-CD1 4.19Å; I414-I481 HydrophobicContact CG1-CD1 4.09Å; I414-I481 HydrophobicContact CG2-CD1 4.39Å; I414-L486 HydrophobicContact CD1-CD1 3.85Å
415	W	89.4	Confident	88.6	Confident	23 Å²	23	44 Å²	44	9%	0.087	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	130.1	174.9	-179.2	89	0	0	0	109.3	G339 A386 R389 V399 N417 I418 F420	G339-W415 VanDerWaalsContact CA-CE2 3.48Å; G339-W415 VanDerWaalsContact CA-CZ2 3.47Å; A386-W415 VanDerWaalsContact O-CZ3 3.27Å; A386-W415 WeakPolarHBondContact O-CZ3 3.45Å; R389-W415 HydrophobicContact CB-CH2 3.84Å; R389-W415 HydrophobicContact CB-CZ3 4.28Å; V399-W415 HydrophobicContact CG1-CB 4.21Å; V399-W415 HydrophobicContact CG2-CB 4.18Å; V399-W415 HydrophobicContact CG2-CG 4.06Å; W415-N417 VanDerWaalsContact C-N 3.29Å; W415-N417 PolarHBondContact O-N 3.45Å; W415-I418 PolarHBondContact N-O 2.97Å; W415-I418 WeakPolarHBondContact O-CB 3.28Å; W415-I418 PolarHBondContact O-N 3.44Å; W415-F420 HydrophobicContact CB-CD2 4.33Å; W415-F420 HydrophobicContact CB-CE2 3.77Å; W415-F420 HydrophobicContact CE3-CE2 4.5Å; W415-F420 HydrophobicContact CE3-CZ 4.34Å
416	N	87.1	Confident	88.4	Confident	14 Å²	14	42.1 Å²	42.1	8%	0.075	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	46	-174.9	-167.9	26.8	0	0	0	113.4	G339 W351 I418	G339-N416 PolarHBondContact O-OD1 3.34Å; W351-N416 PolarHBondContact NE1-ND2 2.94Å; W351-N416 PolarHBondContact NE1-O 2.86Å; N416-I418 PolarHBondContact O-N 3.4Å; N416-I418 VanDerWaalsContact O-N 3.11Å
417	N	88.9	Confident	88	Confident	55 Å²	55	46.8 Å²	46.8	29%	0.294	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	22.3	-175.8	-63.8	-16.3	0	0	0	115.6	T348 R349 W415	T348-N417 WeakPolarHBondContact CB-ND2 3.35Å; T348-N417 PolarHBondContact OG1-ND2 3.35Å; T348-N417 VanDerWaalsContact OG1-ND2 3.14Å; R349-N417 WeakPolarHBondContact O-CB 3.48Å; R349-N417 PolarHBondContact O-ND2 2.93Å; W415-N417 VanDerWaalsContact C-N 3.29Å; W415-N417 PolarHBondContact O-N 3.45Å
418	I	93.2	Very high	87.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134.9	172	-56.2	177.1	0	0	0	108.1	W351 F383 A386 A387 I414 W415 N416 F420 A478 Q479	W351-I418 VanDerWaalsContact CD1-CG1 3.44Å; W351-I418 HydrophobicContact CG-CD1 4.45Å; W351-I418 HydrophobicContact CG-CG1 4.16Å; F383-I418 HydrophobicContact CD2-CD1 4.05Å; F383-I418 HydrophobicContact CD2-CG1 4.48Å; F383-I418 HydrophobicContact CE2-CD1 3.77Å; F383-I418 HydrophobicContact CE2-CG1 3.85Å; F383-I418 HydrophobicContact CE2-CG2 4.37Å; F383-I418 HydrophobicContact CZ-CD1 4.46Å; F383-I418 HydrophobicContact CZ-CG2 4.31Å; A386-I418 HydrophobicContact CB-CD1 3.96Å; A387-I418 HydrophobicContact CB-CD1 4.38Å; I414-I418 VanDerWaalsContact CA-O 3.32Å; I414-I418 WeakPolarHBondContact CA-O 3.44Å; W415-I418 PolarHBondContact N-O 2.97Å; W415-I418 WeakPolarHBondContact O-CB 3.28Å; W415-I418 PolarHBondContact O-N 3.44Å; N416-I418 PolarHBondContact O-N 3.4Å; N416-I418 VanDerWaalsContact O-N 3.11Å; I418-F420 HydrophobicContact CB-CE2 3.6Å; I418-F420 HydrophobicContact CB-CZ 3.7Å; I418-F420 HydrophobicContact CG2-CD2 4.36Å; I418-F420 HydrophobicContact CG2-CE1 4.02Å; I418-F420 HydrophobicContact CG2-CE2 3.7Å; I418-F420 HydrophobicContact CG2-CZ 3.5Å; I418-F420 VanDerWaalsContact O-CD2 3.24Å; I418-F420 WeakPolarHBondContact O-CD2 3.48Å; I418-F420 WeakPolarHBondContact O-CE2 3.39Å; I418-A478 HydrophobicContact CG2-CB 3.96Å; I418-Q479 WeakPolarHBondContact CG2-O 3.49Å
419	F	94.7	Very high	87.7	Confident	50 Å²	50	47.5 Å²	47.5	22%	0.219	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.1	174.6	175.8	-98	0	0	0	110.4	M412 I414 A478 Q479 I481	M412-F419 HydrophobicContact CB-CE2 3.81Å; M412-F419 HydrophobicContact CB-CZ 4.05Å; M412-F419 HydrophobicContact CG-CE2 4.12Å; M412-F419 HydrophobicContact CG-CZ 3.88Å; M412-F419 HydrophobicContact SD-CE2 3.86Å; M412-F419 HydrophobicContact SD-CZ 3.59Å; M412-F419 VanDerWaalsContact SD-CZ 3.59Å; I414-F419 HydrophobicContact CG1-CD2 4.36Å; F419-A478 CarbonylContact O-C 3.58Å; F419-A478 WeakPolarHBondContact O-CA 3.45Å; F419-Q479 PolarHBondContact N-O 2.63Å; F419-Q479 PolarHBondContact O-N 3Å; F419-I481 HydrophobicContact CB-CD1 4.46Å; F419-I481 HydrophobicContact CB-CG1 4Å
420	F	95.5	Very high	87.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.1	179.3	-57.2	-94.7	0	0	0	111.3	A387 A391 V394 F413 W415 I418 V476 T477 A478	A387-F420 WeakPolarHBondContact O-CE1 3.44Å; A391-F420 HydrophobicContact CB-CD1 4.4Å; A391-F420 HydrophobicContact CB-CE1 4.31Å; V394-F420 HydrophobicContact CG2-CB 4.19Å; V394-F420 HydrophobicContact CG2-CD2 4.35Å; V394-F420 HydrophobicContact CG2-CG 4.16Å; F413-F420 HydrophobicContact CB-CB 4.19Å; F413-F420 PolarHBondContact N-O 3.36Å; F413-F420 PolarHBondContact O-N 2.94Å; W415-F420 HydrophobicContact CB-CD2 4.33Å; W415-F420 HydrophobicContact CB-CE2 3.77Å; W415-F420 HydrophobicContact CE3-CE2 4.5Å; W415-F420 HydrophobicContact CE3-CZ 4.34Å; I418-F420 HydrophobicContact CB-CE2 3.6Å; I418-F420 HydrophobicContact CB-CZ 3.7Å; I418-F420 HydrophobicContact CG2-CD2 4.36Å; I418-F420 HydrophobicContact CG2-CE1 4.02Å; I418-F420 HydrophobicContact CG2-CE2 3.7Å; I418-F420 HydrophobicContact CG2-CZ 3.5Å; I418-F420 VanDerWaalsContact O-CD2 3.24Å; I418-F420 WeakPolarHBondContact O-CD2 3.48Å; I418-F420 WeakPolarHBondContact O-CE2 3.39Å; F420-V476 HydrophobicContact CB-CG1 4.12Å; F420-V476 HydrophobicContact CD1-CG1 3.92Å; F420-T477 VanDerWaalsContact CA-O 3.29Å; F420-T477 WeakPolarHBondContact CA-O 3.25Å; F420-A478 HydrophobicContact CD1-CB 3.66Å; F420-A478 HydrophobicContact CE1-CB 3.49Å; F420-A478 VanDerWaalsContact CE1-CB 3.49Å; F420-A478 HydrophobicContact CZ-CB 4.38Å
421	S	93.4	Very high	87.8	Confident	31 Å²	31	49.5 Å²	49.5	22%	0.217	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.7	174.6	63.2	0	0	0	0	111.5	V476 T477	S421-V476 WeakPolarHBondContact O-CA 3.39Å; S421-T477 PolarHBondContact N-O 2.91Å; S421-T477 PolarHBondContact O-N 3.35Å
422	L	91.9	Very high	87.5	Confident	25 Å²	25	54.6 Å²	54.6	13%	0.131	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	138.8	176.9	-57.9	-179.7	0	0	0	110.4	I395 T408 F424 V476	I395-L422 HydrophobicContact CD1-CD2 3.79Å; T408-L422 WeakPolarHBondContact O-CD1 3.24Å; L422-F424 HydrophobicContact CB-CD2 3.7Å; L422-F424 HydrophobicContact CB-CE2 4.05Å; L422-F424 HydrophobicContact CD1-CD2 4.39Å; L422-F424 HydrophobicContact CD1-CE2 4.22Å; L422-F424 PolarHBondContact O-N 2.83Å; L422-V476 HydrophobicContact CD2-CG2 3.99Å
423	G	87.4	Confident	87.2	Confident	14 Å²	14	51.6 Å²	51.6	14%	0.144	24%	0.241	C	C	.	.			trans	-77.5	53.9	-178.4	0	0	0	0	0	114.7	R475	G423-R475 PolarHBondContact N-O 3.31Å
424	F	88.9	Confident	86.9	Confident	21 Å²	21	52.5 Å²	52.5	9%	0.092	25%	0.254	C	S	.	.	S	Bend	trans	-108.5	156.2	173.9	-67.8	-72.8	0	0	0	111.3	R409 L422 V426 Y474	R409-F424 HydrophobicContact CB-CB 4.19Å; R409-F424 HydrophobicContact CB-CD2 3.91Å; R409-F424 HydrophobicContact CB-CG 4.1Å; R409-F424 HydrophobicContact CG-CD1 4.49Å; R409-F424 HydrophobicContact CG-CD2 3.95Å; R409-F424 HydrophobicContact CG-CE2 4.17Å; R409-F424 HydrophobicContact CG-CG 4.12Å; L422-F424 HydrophobicContact CB-CD2 3.7Å; L422-F424 HydrophobicContact CB-CE2 4.05Å; L422-F424 HydrophobicContact CD1-CD2 4.39Å; L422-F424 HydrophobicContact CD1-CE2 4.22Å; L422-F424 PolarHBondContact O-N 2.83Å; F424-V426 PolarHBondContact O-N 2.9Å; F424-Y474 AromaticContact CE2-CD1 3.78Å; F424-Y474 HydrophobicContact CE2-CD1 3.78Å; F424-Y474 HydrophobicContact CE2-CE1 4.01Å; F424-Y474 AromaticContact CZ-CD1 3.76Å; F424-Y474 HydrophobicContact CZ-CD1 3.76Å; F424-Y474 AromaticContact CZ-CE1 3.83Å; F424-Y474 HydrophobicContact CZ-CE1 3.83Å
425	D	84.9	Confident	86.8	Confident	27 Å²	27	50.6 Å²	50.6	14%	0.144	25%	0.248	C	C	.	.			trans	-75.9	106.5	171.5	-171.2	14.4	0	0	0	110.1	H429 Y430 R431 G435 D436 A439	D425-H429 PolarHBondContact OD1-N 3.44Å; D425-Y430 PolarHBondContact OD1-N 3.41Å; D425-Y430 PolarHBondContact OD2-N 3.14Å; D425-R431 PolarHBondContact OD2-N 3.11Å; D425-G435 WeakPolarHBondContact OD2-CA 3.36Å; D425-D436 PolarHBondContact N-OD1 3.19Å; D425-A439 HydrophobicContact CB-CB 4.1Å
426	V	79.7	Confident	86.8	Confident	41 Å²	41	52.9 Å²	52.9	25%	0.248	26%	0.262	C	S	.	.			trans	-94	130.9	-179.1	175.2	0	0	0	0	108.7	M410 F424 D428 H429	M410-V426 HydrophobicContact CB-CG1 4.11Å; M410-V426 HydrophobicContact CB-CG2 4.4Å; M410-V426 HydrophobicContact CE-CG1 4.23Å; M410-V426 HydrophobicContact CG-CB 4.39Å; M410-V426 HydrophobicContact CG-CG1 3.67Å; M410-V426 HydrophobicContact CG-CG2 4.05Å; M410-V426 HydrophobicContact SD-CG1 3.81Å; F424-V426 PolarHBondContact O-N 2.9Å; V426-D428 PolarHBondContact O-N 3.28Å; V426-H429 PolarHBondContact O-N 3.17Å; V426-H429 PolarHBondContact O-ND1 3.38Å
427	R	77.7	Confident	86.9	Confident	164 Å²	164	53.7 Å²	53.7	62%	0.619	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	37.9	175.9	-59.2	172.3	-174.8	-173.3	2.9	113.4	E406 M410 H429	E406-R427 IonicContact OE1-NH2 3.94Å; E406-R427 PolarHBondContact OE1-NH2 2.9Å; M410-R427 HydrophobicContact CE-CG 4.48Å; M410-R427 HydrophobicContact SD-CG 4.46Å; R427-H429 PolarHBondContact O-N 3.04Å; R427-H429 VanDerWaalsContact O-N 3.13Å; R427-H429 PolarHBondContact O-ND1 3.42Å
428	D	79.8	Confident	87.1	Confident	91 Å²	91	51 Å²	51	49%	0.487	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	25.7	178.7	-70	-13	0	0	0	114.9	V426 Y430 R431	V426-D428 PolarHBondContact O-N 3.28Å; D428-Y430 PolarHBondContact O-N 3.08Å; D428-R431 HydrophobicContact CB-CB 3.84Å; D428-R431 WeakPolarHBondContact O-CB 3.44Å; D428-R431 PolarHBondContact O-N 3.27Å; D428-R431 IonicContact OD2-CZ 3.06Å; D428-R431 IonicContact OD2-NE 3.1Å; D428-R431 IonicContact OD2-NH1 3.56Å; D428-R431 PolarHBondContact OD2-NH1 3.04Å
429	H	78.1	Confident	87	Confident	102 Å²	102	51.2 Å²	51.2	47%	0.472	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-36.9	-178.9	-77.7	45.4	0	0	0	111.9	D425 V426 R427 F501	D425-H429 PolarHBondContact OD1-N 3.44Å; V426-H429 PolarHBondContact O-N 3.17Å; V426-H429 PolarHBondContact O-ND1 3.38Å; R427-H429 PolarHBondContact O-N 3.04Å; R427-H429 VanDerWaalsContact O-N 3.13Å; R427-H429 PolarHBondContact O-ND1 3.42Å; H429-F501 HydrophobicContact CB-CZ 4.47Å
430	Y	82.9	Confident	86.9	Confident	50 Å²	50	50.7 Å²	50.7	20%	0.196	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	8.3	-179.5	-66.2	-81.9	0	0	0	113.4	D425 D428 E432 L433 G434 G435 A438 A439 A442 L595	D425-Y430 PolarHBondContact OD1-N 3.41Å; D425-Y430 PolarHBondContact OD2-N 3.14Å; D428-Y430 PolarHBondContact O-N 3.08Å; Y430-E432 VanDerWaalsContact C-N 3.29Å; Y430-E432 PolarHBondContact O-N 2.9Å; Y430-L433 HydrophobicContact CD1-CB 4.42Å; Y430-L433 HydrophobicContact CD1-CD1 3.81Å; Y430-L433 HydrophobicContact CE1-CD1 4.35Å; Y430-L433 CarbonylContact O-C 3.59Å; Y430-L433 WeakPolarHBondContact O-CA 3.41Å; Y430-L433 WeakPolarHBondContact O-CB 3.37Å; Y430-L433 PolarHBondContact O-N 2.83Å; Y430-G434 PolarHBondContact O-N 2.92Å; Y430-G435 PolarHBondContact O-N 3.12Å; Y430-A438 HydrophobicContact CD1-CB 4.04Å; Y430-A438 HydrophobicContact CG-CB 4.27Å; Y430-A439 HydrophobicContact CD2-CB 3.81Å; Y430-A439 HydrophobicContact CE2-CB 4.23Å; Y430-A439 HydrophobicContact CG-CB 4.32Å; Y430-A442 HydrophobicContact CE1-CB 4.01Å; Y430-L595 HydrophobicContact CD1-CD1 4.34Å; Y430-L595 HydrophobicContact CE1-CD1 4.24Å
431	R	85.7	Confident	86.7	Confident	155 Å²	155	51.2 Å²	51.2	59%	0.585	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-54.1	-43.9	-175.2	-176.4	177.1	66	-167.2	4	112.7	D425 D428 L433	D425-R431 PolarHBondContact OD2-N 3.11Å; D428-R431 HydrophobicContact CB-CB 3.84Å; D428-R431 WeakPolarHBondContact O-CB 3.44Å; D428-R431 PolarHBondContact O-N 3.27Å; D428-R431 IonicContact OD2-CZ 3.06Å; D428-R431 IonicContact OD2-NE 3.1Å; D428-R431 IonicContact OD2-NH1 3.56Å; D428-R431 PolarHBondContact OD2-NH1 3.04Å; R431-L433 VanDerWaalsContact C-N 3.27Å; R431-L433 PolarHBondContact O-N 3.01Å
432	E	82.4	Confident	86.7	Confident	143 Å²	143	49.9 Å²	49.9	67%	0.668	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-73.7	-19	178.2	-61.5	-172.9	-179.5	0	0	113.3	Y430	Y430-E432 VanDerWaalsContact C-N 3.29Å; Y430-E432 PolarHBondContact O-N 2.9Å
433	L	84.2	Confident	86.8	Confident	11 Å²	11	49.4 Å²	49.4	6%	0.058	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-96.4	-7.6	-179.7	-64.3	173.1	0	0	0	113.4	Y430 R431 A438 H593 R594 L595 P744	Y430-L433 HydrophobicContact CD1-CB 4.42Å; Y430-L433 HydrophobicContact CD1-CD1 3.81Å; Y430-L433 HydrophobicContact CE1-CD1 4.35Å; Y430-L433 CarbonylContact O-C 3.59Å; Y430-L433 WeakPolarHBondContact O-CA 3.41Å; Y430-L433 WeakPolarHBondContact O-CB 3.37Å; Y430-L433 PolarHBondContact O-N 2.83Å; R431-L433 VanDerWaalsContact C-N 3.27Å; R431-L433 PolarHBondContact O-N 3.01Å; L433-A438 HydrophobicContact CB-CB 3.97Å; L433-H593 CarbonylContact O-C 3.59Å; L433-H593 WeakPolarHBondContact O-CA 3.26Å; L433-H593 VanDerWaalsContact O-CB 3.32Å; L433-H593 WeakPolarHBondContact O-CB 3.41Å; L433-R594 HydrophobicContact CD2-CB 4.19Å; L433-R594 PolarHBondContact O-N 2.93Å; L433-L595 HydrophobicContact CD1-CD2 4.07Å; L433-L595 HydrophobicContact CD2-CD2 4.37Å; L433-P744 HydrophobicContact CD2-CG 3.92Å
434	G	86.8	Confident	87.1	Confident	32 Å²	32	50.2 Å²	50.2	33%	0.33	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.3	13.8	-179.7	0	0	0	0	0	115.7	Y430 A437	Y430-G434 PolarHBondContact O-N 2.92Å; G434-A437 PolarHBondContact O-N 3.32Å
435	G	90.6	Very high	87.4	Confident	13 Å²	13	50.6 Å²	50.6	13%	0.134	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	-135.8	174.6	0	0	0	0	0	113.5	D425 Y430 A437 A438 A439	D425-G435 WeakPolarHBondContact OD2-CA 3.36Å; Y430-G435 PolarHBondContact O-N 3.12Å; G435-A437 PolarHBondContact O-N 3.16Å; G435-A437 VanDerWaalsContact O-N 3.09Å; G435-A438 WeakPolarHBondContact O-CA 3.22Å; G435-A438 WeakPolarHBondContact O-CB 3.35Å; G435-A438 PolarHBondContact O-N 2.72Å; G435-A439 PolarHBondContact O-N 2.8Å
436	D	88.6	Confident	87.8	Confident	72 Å²	72	49.9 Å²	49.9	39%	0.385	25%	0.251	S	S	.	.	H	α-helix	trans	-54.3	-30.8	179	-78.7	-26.3	0	0	0	113.6	R409 D425 A438 H440	R409-D436 IonicContact NH1-OD2 2.58Å; D425-D436 PolarHBondContact N-OD1 3.19Å; D436-A438 VanDerWaalsContact C-N 3.34Å; D436-H440 VanDerWaalsContact O-CB 3.3Å; D436-H440 WeakPolarHBondContact O-CB 3.36Å; D436-H440 PolarHBondContact O-N 3.3Å
437	A	90.6	Very high	88.6	Confident	30 Å²	30	47.9 Å²	47.9	25%	0.248	24%	0.239	C	C	.	.	H	α-helix	trans	-67.5	-36.9	177	0	0	0	0	0	111.9	G434 G435 A441 R592 H593	G434-A437 PolarHBondContact O-N 3.32Å; G435-A437 PolarHBondContact O-N 3.16Å; G435-A437 VanDerWaalsContact O-N 3.09Å; A437-A441 PolarHBondContact O-N 3.44Å; A437-R592 HydrophobicContact CB-CB 3.94Å; A437-H593 HydrophobicContact CB-CB 4.38Å; A437-H593 PolarHBondContact O-CD2 2.88Å
438	A	91.7	Very high	89.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-73.7	-45.2	174.9	0	0	0	0	0	111.1	Y430 L433 G435 D436 H440 A441 A442 H593 L595	Y430-A438 HydrophobicContact CD1-CB 4.04Å; Y430-A438 HydrophobicContact CG-CB 4.27Å; L433-A438 HydrophobicContact CB-CB 3.97Å; G435-A438 WeakPolarHBondContact O-CA 3.22Å; G435-A438 WeakPolarHBondContact O-CB 3.35Å; G435-A438 PolarHBondContact O-N 2.72Å; D436-A438 VanDerWaalsContact C-N 3.34Å; A438-H440 PolarHBondContact O-N 3.03Å; A438-A441 PolarHBondContact O-N 2.83Å; A438-A442 WeakPolarHBondContact O-CB 3.32Å; A438-A442 PolarHBondContact O-N 2.87Å; A438-H593 HydrophobicContact CB-CB 3.78Å; A438-L595 HydrophobicContact CB-CD1 3.98Å; A438-L595 HydrophobicContact CB-CG 4.39Å
439	A	91.8	Very high	90.1	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.033	20%	0.198	C	C	.	.	H	α-helix	trans	-59.1	-35.6	176.7	0	0	0	0	0	112.6	D425 Y430 G435 P443	D425-A439 HydrophobicContact CB-CB 4.1Å; Y430-A439 HydrophobicContact CD2-CB 3.81Å; Y430-A439 HydrophobicContact CE2-CB 4.23Å; Y430-A439 HydrophobicContact CG-CB 4.32Å; G435-A439 PolarHBondContact O-N 2.8Å; A439-P443 WeakPolarHBondContact O-CD 3.39Å
440	H	91.7	Very high	90.9	Very high	38 Å²	38	33.4 Å²	33.4	18%	0.176	18%	0.178	C	C	.	.	H	α-helix	trans	-71	-34.5	173.3	176.9	-88.8	0	0	0	112.9	D436 A438 R475 R846	D436-H440 VanDerWaalsContact O-CB 3.3Å; D436-H440 WeakPolarHBondContact O-CB 3.36Å; D436-H440 PolarHBondContact O-N 3.3Å; A438-H440 PolarHBondContact O-N 3.03Å; H440-R475 PolarHBondContact CE1-NH1 3.48Å; H440-R475 PolarHBondContact CE1-NH2 3.34Å; H440-R475 PolarHBondContact ND1-NH1 2.99Å; H440-R475 PolarHBondContact NE2-NE 3.02Å; H440-R475 PolarHBondContact NE2-NH2 2.98Å; H440-R475 WeakPolarHBondContact O-CD 3.41Å; H440-R475 PolarHBondContact O-NH1 3.34Å; H440-R846 PolarHBondContact CD2-NH1 3.13Å; H440-R846 PolarHBondContact CE1-NH1 3.19Å; H440-R846 PolarHBondContact ND1-NH1 3.07Å; H440-R846 VanDerWaalsContact ND1-NH1 3.18Å; H440-R846 PolarHBondContact NE2-NH1 3.41Å
441	A	92.3	Very high	91.4	Very high	11 Å²	11	35.6 Å²	35.6	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-77.1	-35.9	-179.6	0	0	0	0	0	112.8	A437 A438 T444 N445 H593	A437-A441 PolarHBondContact O-N 3.44Å; A438-A441 PolarHBondContact O-N 2.83Å; A441-T444 PolarHBondContact O-N 3.11Å; A441-T444 VanDerWaalsContact O-N 3.09Å; A441-N445 PolarHBondContact O-N 3.34Å; A441-H593 WeakPolarHBondContact CB-NE2 3.38Å
442	A	92.6	Very high	91.8	Very high	4 Å²	4	28.3 Å²	28.3	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-53.3	-47.9	-173.7	0	0	0	0	0	113.8	Y430 A438 T444 N445 D446 L595	Y430-A442 HydrophobicContact CE1-CB 4.01Å; A438-A442 WeakPolarHBondContact O-CB 3.32Å; A438-A442 PolarHBondContact O-N 2.87Å; A442-T444 VanDerWaalsContact C-N 3.27Å; A442-T444 PolarHBondContact O-N 2.77Å; A442-N445 PolarHBondContact O-N 3.49Å; A442-D446 PolarHBondContact O-N 3.4Å; A442-L595 HydrophobicContact CB-CD1 3.93Å
443	P	94.8	Very high	92.3	Very high	15 Å²	15	21.8 Å²	21.8	10%	0.097	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-33	178.7	-26.9	34.5	0	0	0	114.3	A439 L447 V468 T477	A439-P443 WeakPolarHBondContact O-CD 3.39Å; P443-L447 WeakPolarHBondContact O-CB 3.49Å; P443-L447 PolarHBondContact O-N 3.07Å; P443-V468 HydrophobicContact CB-CG1 4.36Å; P443-V468 HydrophobicContact CB-CG2 3.82Å; P443-T477 HydrophobicContact CB-CG2 4.34Å; P443-T477 WeakPolarHBondContact CB-OG1 3.37Å; P443-T477 VanDerWaalsContact CG-OG1 3.32Å; P443-T477 WeakPolarHBondContact CG-OG1 3.29Å
444	T	94	Very high	92.7	Very high	31 Å²	31	22.7 Å²	22.7	19%	0.19	14%	0.14	C	C	.	.	H	α-helix	trans	-73	-36.7	176.6	-60.9	0	0	0	0	111.2	A441 A442 N448 R475 K989	A441-T444 PolarHBondContact O-N 3.11Å; A441-T444 VanDerWaalsContact O-N 3.09Å; A442-T444 VanDerWaalsContact C-N 3.27Å; A442-T444 PolarHBondContact O-N 2.77Å; T444-N448 PolarHBondContact O-N 3Å; T444-N448 VanDerWaalsContact O-N 3.11Å; T444-N448 PolarHBondContact O-ND2 3.22Å; T444-N448 VanDerWaalsContact O-ND2 3.14Å; T444-R475 PolarHBondContact OG1-NH1 3.38Å; T444-R475 VanDerWaalsContact OG1-NH1 3.15Å; T444-K989 PolarHBondContact OG1-NZ 2.98Å
445	N	93.9	Very high	92.8	Very high	29 Å²	29	25 Å²	25	16%	0.155	16%	0.156	C	C	.	.	H	α-helix	trans	-68.1	-42.2	174.7	-72.2	2.7	0	0	0	111.3	A441 A442 N448 G449 L561 L595	A441-N445 PolarHBondContact O-N 3.34Å; A442-N445 PolarHBondContact O-N 3.49Å; N445-N448 WeakPolarHBondContact O-CB 3.3Å; N445-N448 PolarHBondContact O-N 3.16Å; N445-G449 PolarHBondContact O-N 3.41Å; N445-L561 HydrophobicContact CB-CB 4.3Å; N445-L561 WeakPolarHBondContact CB-O 3.21Å; N445-L595 PolarHBondContact ND2-O 3.44Å
446	D	94.9	Very high	92.9	Very high	11 Å²	11	26.3 Å²	26.3	6%	0.059	16%	0.161	C	C	.	.	H	α-helix	trans	-58.9	-49.3	174.8	-177.1	60.7	0	0	0	111.2	A442 N448 G449 V450 Q479 L560	A442-D446 PolarHBondContact O-N 3.4Å; D446-N448 VanDerWaalsContact C-N 3.27Å; D446-N448 PolarHBondContact O-N 2.9Å; D446-G449 CarbonylContact O-C 3.49Å; D446-G449 WeakPolarHBondContact O-CA 3.39Å; D446-G449 PolarHBondContact O-N 2.83Å; D446-V450 WeakPolarHBondContact O-CG2 3.46Å; D446-V450 PolarHBondContact O-N 3.33Å; D446-Q479 PolarHBondContact OD2-NE2 3.36Å; D446-L560 PolarHBondContact OD1-N 3.23Å
447	L	95.4	Very high	92.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.8	-37.7	174.9	179.6	61.3	0	0	0	112.7	P443 V450 R451 T466 V468 K989 V991	P443-L447 WeakPolarHBondContact O-CB 3.49Å; P443-L447 PolarHBondContact O-N 3.07Å; L447-V450 PolarHBondContact O-N 3.5Å; L447-R451 VanDerWaalsContact O-CG 3.28Å; L447-R451 WeakPolarHBondContact O-CG 3.31Å; L447-R451 PolarHBondContact O-N 2.83Å; L447-T466 HydrophobicContact CD1-CG2 4.23Å; L447-T466 VanDerWaalsContact CD1-O 3.29Å; L447-T466 WeakPolarHBondContact CD1-O 3.33Å; L447-V468 HydrophobicContact CB-CG2 4.37Å; L447-V468 HydrophobicContact CD2-CG2 4.22Å; L447-K989 HydrophobicContact CD2-CB 3.74Å; L447-K989 WeakPolarHBondContact CD2-O 3.21Å; L447-V991 HydrophobicContact CD1-CG2 3.93Å
448	N	94	Very high	93.1	Very high	43 Å²	43	23.7 Å²	23.7	23%	0.23	14%	0.144	C	C	.	.	H	α-helix	trans	-67.8	-36.7	175.3	-69.1	-29.7	0	0	0	111.9	T444 N445 D446 R451 A452	T444-N448 PolarHBondContact O-N 3Å; T444-N448 VanDerWaalsContact O-N 3.11Å; T444-N448 PolarHBondContact O-ND2 3.22Å; T444-N448 VanDerWaalsContact O-ND2 3.14Å; N445-N448 WeakPolarHBondContact O-CB 3.3Å; N445-N448 PolarHBondContact O-N 3.16Å; D446-N448 VanDerWaalsContact C-N 3.27Å; D446-N448 PolarHBondContact O-N 2.9Å; N448-R451 PolarHBondContact O-N 3.09Å; N448-R451 PolarHBondContact OD1-NH1 2.98Å; N448-R451 VanDerWaalsContact OD1-NH1 3.09Å; N448-A452 WeakPolarHBondContact O-CB 3.28Å; N448-A452 PolarHBondContact O-N 3.35Å
449	G	94.4	Very high	93	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-62.3	-47.5	170.6	0	0	0	0	0	112.2	N445 D446 R451 A452 Y453 T563	N445-G449 PolarHBondContact O-N 3.41Å; D446-G449 CarbonylContact O-C 3.49Å; D446-G449 WeakPolarHBondContact O-CA 3.39Å; D446-G449 PolarHBondContact O-N 2.83Å; G449-R451 VanDerWaalsContact C-N 3.31Å; G449-R451 PolarHBondContact O-N 2.88Å; G449-A452 WeakPolarHBondContact O-CB 3.38Å; G449-A452 PolarHBondContact O-N 2.85Å; G449-Y453 WeakPolarHBondContact O-CD2 3.26Å; G449-Y453 PolarHBondContact O-N 3.37Å; G449-T563 WeakPolarHBondContact CA-OG1 3.25Å
450	V	95.1	Very high	93	Very high	9 Å²	9	31.5 Å²	31.5	6%	0.055	19%	0.186	C	C	.	.	H	α-helix	trans	-57.2	-43.8	175.3	173.6	0	0	0	0	111.1	D446 L447 A452 G454 L560 V991	D446-V450 WeakPolarHBondContact O-CG2 3.46Å; D446-V450 PolarHBondContact O-N 3.33Å; L447-V450 PolarHBondContact O-N 3.5Å; V450-A452 VanDerWaalsContact C-N 3.35Å; V450-A452 PolarHBondContact O-N 3.41Å; V450-G454 PolarHBondContact O-N 3.37Å; V450-L560 HydrophobicContact CG2-CD1 4Å; V450-V991 HydrophobicContact CG1-CG2 4.05Å
451	R	94.6	Very high	93.2	Very high	95 Å²	95	30 Å²	30	36%	0.358	18%	0.179	S	C	.	.	H	α-helix	trans	-60.6	-42.5	174.5	-72.8	169.4	179.6	170	-8.8	112.1	L447 N448 G449 A455 H990 V991	L447-R451 VanDerWaalsContact O-CG 3.28Å; L447-R451 WeakPolarHBondContact O-CG 3.31Å; L447-R451 PolarHBondContact O-N 2.83Å; N448-R451 PolarHBondContact O-N 3.09Å; N448-R451 PolarHBondContact OD1-NH1 2.98Å; N448-R451 VanDerWaalsContact OD1-NH1 3.09Å; G449-R451 VanDerWaalsContact C-N 3.31Å; G449-R451 PolarHBondContact O-N 2.88Å; R451-A455 WeakPolarHBondContact O-CB 3.27Å; R451-A455 PolarHBondContact O-N 2.96Å; R451-H990 PolarHBondContact NE-O 2.86Å; R451-H990 VanDerWaalsContact NE-O 3.15Å; R451-H990 PolarHBondContact NH2-O 3.4Å; R451-V991 HydrophobicContact CG-CB 4.38Å; R451-V991 HydrophobicContact CG-CG1 4.32Å; R451-V991 HydrophobicContact CG-CG2 3.94Å
452	A	93.6	Very high	93.3	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.017	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-50.3	-178.9	0	0	0	0	0	111.5	N448 G449 V450 G454 A455 V456 L522 F564	N448-A452 WeakPolarHBondContact O-CB 3.28Å; N448-A452 PolarHBondContact O-N 3.35Å; G449-A452 WeakPolarHBondContact O-CB 3.38Å; G449-A452 PolarHBondContact O-N 2.85Å; V450-A452 VanDerWaalsContact C-N 3.35Å; V450-A452 PolarHBondContact O-N 3.41Å; A452-G454 VanDerWaalsContact C-N 3.35Å; A452-G454 PolarHBondContact O-N 3.11Å; A452-A455 PolarHBondContact O-N 2.79Å; A452-V456 WeakPolarHBondContact O-CG2 3.15Å; A452-V456 PolarHBondContact O-N 3.46Å; A452-L522 HydrophobicContact CB-CD2 3.87Å; A452-F564 HydrophobicContact CB-CE2 4.2Å; A452-F564 HydrophobicContact CB-CZ 3.67Å
453	Y	93.6	Very high	93.4	Very high	6 Å²	6	31.3 Å²	31.3	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-39.2	176.5	-84	-88.2	0	0	0	112.3	G449 A455 V456 D457 L461 L515 T518 L522 S541 I557 L560 T563	G449-Y453 WeakPolarHBondContact O-CD2 3.26Å; G449-Y453 PolarHBondContact O-N 3.37Å; Y453-A455 VanDerWaalsContact C-N 3.31Å; Y453-A455 PolarHBondContact O-N 2.9Å; Y453-V456 PolarHBondContact O-N 3.38Å; Y453-D457 PolarHBondContact O-N 3.22Å; Y453-D457 VanDerWaalsContact O-N 3.13Å; Y453-L461 HydrophobicContact CD1-CD2 3.98Å; Y453-L461 HydrophobicContact CE1-CD2 4.18Å; Y453-L515 HydrophobicContact CE1-CD2 3.64Å; Y453-T518 HydrophobicContact CD1-CG2 3.98Å; Y453-T518 HydrophobicContact CE1-CG2 3.91Å; Y453-L522 HydrophobicContact CD1-CD1 4.04Å; Y453-L522 HydrophobicContact CD2-CD1 3.97Å; Y453-L522 HydrophobicContact CE1-CD1 3.85Å; Y453-L522 HydrophobicContact CE2-CD1 3.79Å; Y453-L522 HydrophobicContact CG-CD1 4.11Å; Y453-S541 PolarHBondContact OH-OG 3.25Å; Y453-I557 HydrophobicContact CE1-CD1 4.25Å; Y453-L560 HydrophobicContact CD2-CD1 3.7Å; Y453-L560 HydrophobicContact CD2-CD2 3.87Å; Y453-L560 HydrophobicContact CD2-CG 4.38Å; Y453-L560 HydrophobicContact CE2-CD1 4.26Å; Y453-L560 HydrophobicContact CE2-CD2 3.54Å; Y453-L560 HydrophobicContact CE2-CG 4.46Å; Y453-L560 HydrophobicContact CG-CD1 4.29Å; Y453-T563 HydrophobicContact CD2-CG2 4.3Å; Y453-T563 HydrophobicContact CE2-CG2 3.8Å
454	G	91.5	Very high	93.3	Very high	30 Å²	30	31.4 Å²	31.4	31%	0.309	18%	0.182	S	C	.	.	H	α-helix	trans	-63.2	-33.5	175.3	0	0	0	0	0	113.5	V450 A452	V450-G454 PolarHBondContact O-N 3.37Å; A452-G454 VanDerWaalsContact C-N 3.35Å; A452-G454 PolarHBondContact O-N 3.11Å
455	A	90.1	Very high	93.3	Very high	82 Å²	82	30 Å²	30	68%	0.678	17%	0.174	S	C	*	.	H	α-helix	trans	-73.8	-25.9	176.5	0	0	0	0	0	113.6	R451 A452 Y453	R451-A455 WeakPolarHBondContact O-CB 3.27Å; R451-A455 PolarHBondContact O-N 2.96Å; A452-A455 PolarHBondContact O-N 2.79Å; Y453-A455 VanDerWaalsContact C-N 3.31Å; Y453-A455 PolarHBondContact O-N 2.9Å
456	V	91.4	Very high	93.4	Very high	40 Å²	40	28.9 Å²	28.9	24%	0.242	17%	0.168	C	C	.	.	H	α-helix	trans	-80.7	-34.5	175.8	-177.6	0	0	0	0	111.7	A452 Y453 V458 T518 P521 L522	A452-V456 WeakPolarHBondContact O-CG2 3.15Å; A452-V456 PolarHBondContact O-N 3.46Å; Y453-V456 PolarHBondContact O-N 3.38Å; V456-V458 HydrophobicContact CG1-CG2 3.85Å; V456-V458 PolarHBondContact O-N 3.17Å; V456-T518 HydrophobicContact CG1-CG2 4.29Å; V456-P521 HydrophobicContact CG1-CB 3.98Å; V456-P521 HydrophobicContact CG1-CG 3.91Å; V456-P521 HydrophobicContact CG2-CB 3.71Å; V456-L522 HydrophobicContact CG2-CD2 3.51Å; V456-L522 HydrophobicContact CG2-CG 3.87Å
457	D	89.7	Confident	93.5	Very high	29 Å²	29	28.4 Å²	28.4	16%	0.155	17%	0.166	C	C	.	.			trans	56.1	54.1	169.3	-168.9	40.9	0	0	0	114.9	R359 R363 R372 Y453	R359-D457 IonicContact NE-OD1 2.84Å; R359-D457 IonicContact NH2-OD1 2.72Å; R363-D457 PolarHBondContact NH1-O 3.23Å; R363-D457 VanDerWaalsContact NH1-O 3.12Å; R363-D457 IonicContact NH1-OD2 2.79Å; R372-D457 IonicContact CZ-OD2 2.9Å; R372-D457 IonicContact NH1-OD2 3.76Å; R372-D457 PolarHBondContact NH1-OD2 3.5Å; R372-D457 IonicContact NH2-OD1 3.54Å; R372-D457 PolarHBondContact NH2-OD1 3.05Å; R372-D457 IonicContact NH2-OD2 3.66Å; R372-D457 PolarHBondContact NH2-OD2 3.09Å; Y453-D457 PolarHBondContact O-N 3.22Å; Y453-D457 VanDerWaalsContact O-N 3.13Å
458	V	93.2	Very high	93.7	Very high	17 Å²	17	28.4 Å²	28.4	10%	0.103	17%	0.166	C	C	.	.			trans	-73.5	129.8	175.4	178.9	0	0	0	0	110.9	V456 L461 L514 K517 T518	V456-V458 HydrophobicContact CG1-CG2 3.85Å; V456-V458 PolarHBondContact O-N 3.17Å; V458-L461 HydrophobicContact CB-CB 4.25Å; V458-L461 HydrophobicContact CG1-CB 4.36Å; V458-L461 PolarHBondContact O-N 2.82Å; V458-L514 HydrophobicContact CG1-CD2 4.29Å; V458-K517 HydrophobicContact CG1-CB 4.07Å; V458-K517 HydrophobicContact CG1-CD 3.88Å; V458-K517 HydrophobicContact CG2-CB 3.98Å; V458-T518 HydrophobicContact CB-CG2 4.35Å; V458-T518 HydrophobicContact CG2-CG2 3.49Å; V458-T518 VanDerWaalsContact CG2-CG2 3.49Å
459	E	91.4	Very high	93.8	Very high	145 Å²	145	26.4 Å²	26.4	68%	0.678	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	131.3	178.4	-168.4	173	158.3	0	0	111.6	R363 L461 L514	R363-E459 IonicContact NH2-OE2 3.57Å; R363-E459 PolarHBondContact NH2-OE2 3.25Å; E459-L461 VanDerWaalsContact C-N 3.31Å; E459-L514 VanDerWaalsContact O-CD2 3.3Å; E459-L514 WeakPolarHBondContact O-CD2 3.47Å
460	G	91.7	Very high	93.9	Very high	24 Å²	24	27.8 Å²	27.8	25%	0.247	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	-2.5	-176.5	0	0	0	0	0	115	Y462 L514	G460-Y462 VanDerWaalsContact C-CE2 3.47Å; G460-Y462 WeakPolarHBondContact O-CE2 3.37Å; G460-L514 WeakPolarHBondContact O-CD1 3.47Å
461	L	94.3	Very high	93.9	Very high	6 Å²	6	28.2 Å²	28.2	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	116	174.8	-175.2	68.2	0	0	0	111	R359 Y453 V458 E459 Y511 L514 L515 T518 I557	R359-L461 PolarHBondContact NH2-O 2.69Å; R359-L461 VanDerWaalsContact NH2-O 3.07Å; Y453-L461 HydrophobicContact CD1-CD2 3.98Å; Y453-L461 HydrophobicContact CE1-CD2 4.18Å; V458-L461 HydrophobicContact CB-CB 4.25Å; V458-L461 HydrophobicContact CG1-CB 4.36Å; V458-L461 PolarHBondContact O-N 2.82Å; E459-L461 VanDerWaalsContact C-N 3.31Å; L461-Y511 HydrophobicContact CD1-CD1 4.49Å; L461-Y511 HydrophobicContact CD1-CE1 4.31Å; L461-L514 HydrophobicContact CB-CB 4.38Å; L461-L514 HydrophobicContact CB-CD1 4.43Å; L461-L514 HydrophobicContact CD1-CB 4.45Å; L461-L514 HydrophobicContact CD1-CD1 4.49Å; L461-L515 HydrophobicContact CD1-CD2 4.31Å; L461-L515 HydrophobicContact CD2-CD2 3.7Å; L461-T518 HydrophobicContact CD2-CG2 3.94Å; L461-I557 HydrophobicContact CD1-CB 4.12Å; L461-I557 HydrophobicContact CD1-CG2 3.91Å; L461-I557 HydrophobicContact CD2-CG2 4.45Å; L461-I557 HydrophobicContact CG-CG2 4.15Å
462	Y	94.4	Very high	93.8	Very high	28 Å²	28	25 Å²	25	11%	0.11	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149	-170.8	-57	-90.7	0	0	0	112	Q356 E360 G460 R554 H555 Y556 I557	Q356-Y462 HydrophobicContact CB-CD1 4.01Å; Q356-Y462 HydrophobicContact CB-CE1 4.15Å; Q356-Y462 HydrophobicContact CG-CD1 4.01Å; Q356-Y462 VanDerWaalsContact OE1-CD1 3.26Å; E360-Y462 HydrophobicContact CG-CE1 4.01Å; E360-Y462 WeakPolarHBondContact CG-OH 3.47Å; E360-Y462 WeakPolarHBondContact OE1-CE1 3.46Å; E360-Y462 VanDerWaalsContact OE1-CZ 3.25Å; E360-Y462 PolarHBondContact OE1-OH 3.08Å; G460-Y462 VanDerWaalsContact C-CE2 3.47Å; G460-Y462 WeakPolarHBondContact O-CE2 3.37Å; Y462-R554 HydrophobicContact CD2-CB 3.7Å; Y462-R554 HydrophobicContact CD2-CG 4.17Å; Y462-R554 HydrophobicContact CE2-CB 3.81Å; Y462-R554 HydrophobicContact CE2-CG 3.84Å; Y462-R554 HydrophobicContact CG-CB 4.31Å; Y462-H555 PolarHBondContact N-O 2.97Å; Y462-Y556 CarbonylContact O-C 3.41Å; Y462-Y556 WeakPolarHBondContact O-CA 3.09Å; Y462-I557 PolarHBondContact O-N 3.18Å
463	T	94.5	Very high	93.7	Very high	14 Å²	14	25.5 Å²	25.5	9%	0.086	16%	0.156	C	C	.	.			trans	-124.8	154.6	177.2	53.9	0	0	0	0	108.9	Q356 R359 I557 L560	Q356-T463 PolarHBondContact NE2-O 2.89Å; Q356-T463 VanDerWaalsContact NE2-O 3.07Å; R359-T463 PolarHBondContact NH1-OG1 3.45Å; R359-T463 VanDerWaalsContact NH1-OG1 3.13Å; T463-I557 HydrophobicContact CG2-CG2 3.95Å; T463-L560 HydrophobicContact CG2-CD1 4.36Å
464	L	93.1	Very high	93.7	Very high	18 Å²	18	28 Å²	28	9%	0.094	17%	0.166	C	C	.	.			trans	-76.7	145.3	177.6	-55.2	179.4	0	0	0	111.4	T466 I482 Y556 L558	L464-T466 PolarHBondContact O-N 2.83Å; L464-T466 PolarHBondContact O-OG1 2.86Å; L464-T466 VanDerWaalsContact O-OG1 3.13Å; L464-I482 HydrophobicContact CD1-CD1 4.43Å; L464-I482 HydrophobicContact CD1-CG1 4.45Å; L464-I482 HydrophobicContact CD2-CD1 4.04Å; L464-I482 HydrophobicContact CD2-CG1 3.51Å; L464-Y556 HydrophobicContact CD2-CD1 3.91Å; L464-Y556 HydrophobicContact CD2-CE1 4.27Å; L464-L558 HydrophobicContact CD1-CB 4.47Å
465	G	94.5	Very high	93.8	Very high	2 Å²	2	27.4 Å²	27.4	2%	0.021	15%	0.154	C	C	.	.			trans	-60.4	119.1	164.2	0	0	0	0	0	108.2	F383 Q479 S480	F383-G465 WeakPolarHBondContact CE1-O 3.45Å; F383-G465 WeakPolarHBondContact CZ-O 3.31Å; G465-Q479 CarbonylContact O-C 3.57Å; G465-Q479 WeakPolarHBondContact O-CA 3.3Å; G465-S480 PolarHBondContact N-OG 2.91Å; G465-S480 PolarHBondContact O-N 2.96Å
466	T	96.4	Very high	94.1	Very high	4 Å²	4	23.5 Å²	23.5	3%	0.025	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.9	-173.6	-57	0	0	0	0	110.4	L447 L464 A478 Q479	L447-T466 HydrophobicContact CD1-CG2 4.23Å; L447-T466 VanDerWaalsContact CD1-O 3.29Å; L447-T466 WeakPolarHBondContact CD1-O 3.33Å; L464-T466 PolarHBondContact O-N 2.83Å; L464-T466 PolarHBondContact O-OG1 2.86Å; L464-T466 VanDerWaalsContact O-OG1 3.13Å; T466-A478 WeakPolarHBondContact CA-O 3.3Å; T466-Q479 HydrophobicContact CG2-CG 4.08Å
467	V	97.6	Very high	94.4	Very high	2 Å²	2	22 Å²	22	1%	0.012	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135	176.8	176.4	0	0	0	0	108.7	F383 A384 A387 V469 A478 V988 K989 H990	F383-V467 HydrophobicContact CD1-CG2 3.77Å; F383-V467 HydrophobicContact CE1-CG2 3.72Å; A384-V467 HydrophobicContact CB-CG2 4.36Å; A387-V467 HydrophobicContact CB-CB 3.84Å; A387-V467 HydrophobicContact CB-CG1 4.02Å; A387-V467 HydrophobicContact CB-CG2 4.03Å; V467-V469 HydrophobicContact CG1-CG2 3.93Å; V467-A478 HydrophobicContact CB-CB 4.36Å; V467-A478 PolarHBondContact N-O 2.99Å; V467-A478 PolarHBondContact O-N 3.45Å; V467-V988 HydrophobicContact CG1-CG1 3.66Å; V467-K989 WeakPolarHBondContact CA-O 3.39Å; V467-H990 HydrophobicContact CG1-CB 4.47Å; V467-H990 HydrophobicContact CG2-CB 4.02Å
468	V	97.8	Very high	94.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.7	177.1	-179.4	0	0	0	0	108.8	P443 L447 R475 K989	P443-V468 HydrophobicContact CB-CG1 4.36Å; P443-V468 HydrophobicContact CB-CG2 3.82Å; L447-V468 HydrophobicContact CB-CG2 4.37Å; L447-V468 HydrophobicContact CD2-CG2 4.22Å; V468-R475 HydrophobicContact CG1-CG 3.87Å; V468-K989 HydrophobicContact CB-CB 4.32Å; V468-K989 PolarHBondContact N-O 2.65Å; V468-K989 PolarHBondContact O-N 3.43Å
469	V	97.5	Very high	94.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123.3	-176.3	-174.5	0	0	0	0	109.7	A391 V467 R475 V476 P986 V988	A391-V469 HydrophobicContact CB-CB 3.81Å; A391-V469 HydrophobicContact CB-CG1 3.94Å; A391-V469 HydrophobicContact CB-CG2 3.86Å; V467-V469 HydrophobicContact CG1-CG2 3.93Å; V469-R475 WeakPolarHBondContact O-CA 3.43Å; V469-V476 PolarHBondContact N-O 2.67Å; V469-V476 PolarHBondContact O-N 3.35Å; V469-P986 HydrophobicContact CG1-CB 3.58Å; V469-V988 HydrophobicContact CG1-CG2 4.49Å; V469-V988 HydrophobicContact CG2-CG1 4.4Å
470	D	96.4	Very high	95	Very high	30 Å²	30	14.7 Å²	14.7	16%	0.16	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.5	168.9	-66.3	-37.7	0	0	0	109	Y474 R475 P986 V987 K989	D470-Y474 CarbonylContact C-O 3.48Å; D470-Y474 WeakPolarHBondContact CA-O 3.22Å; D470-R475 VanDerWaalsContact CG-NH2 3.32Å; D470-R475 WeakPolarHBondContact OD1-CB 3.43Å; D470-R475 IonicContact OD1-CZ 3.37Å; D470-R475 VanDerWaalsContact OD1-CZ 3.29Å; D470-R475 IonicContact OD1-NE 3.42Å; D470-R475 PolarHBondContact OD1-NE 3.1Å; D470-R475 IonicContact OD1-NH2 3.47Å; D470-R475 PolarHBondContact OD1-NH2 3.38Å; D470-R475 IonicContact OD2-CZ 3.48Å; D470-R475 IonicContact OD2-NE 3.46Å; D470-R475 IonicContact OD2-NH2 3.4Å; D470-R475 PolarHBondContact OD2-NH2 3.06Å; D470-P986 WeakPolarHBondContact O-CA 3.5Å; D470-V987 HydrophobicContact CB-CB 4.29Å; D470-V987 PolarHBondContact N-O 3.49Å; D470-V987 PolarHBondContact O-N 2.95Å; D470-K989 IonicContact OD2-NZ 2.76Å
471	Y	95.6	Very high	95	Very high	18 Å²	18	15.4 Å²	15.4	7%	0.071	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	126.9	-176.5	-175.3	-117.7	0	0	0	111.8	M392 I395 G473 Y474 I984 P986	M392-Y471 HydrophobicContact CB-CE1 4.27Å; M392-Y471 HydrophobicContact CE-CE2 4.32Å; M392-Y471 HydrophobicContact CG-CD1 4.28Å; M392-Y471 HydrophobicContact CG-CD2 4.35Å; M392-Y471 HydrophobicContact CG-CE1 4.2Å; M392-Y471 HydrophobicContact CG-CE2 4.23Å; M392-Y471 HydrophobicContact CG-CG 4.38Å; I395-Y471 HydrophobicContact CB-CD1 3.75Å; I395-Y471 HydrophobicContact CB-CE1 4.18Å; I395-Y471 HydrophobicContact CG1-CD1 4.12Å; I395-Y471 HydrophobicContact CG2-CD1 3.71Å; I395-Y471 HydrophobicContact CG2-CE1 4.02Å; Y471-G473 PolarHBondContact O-N 3.32Å; Y471-G473 VanDerWaalsContact O-N 3.11Å; Y471-Y474 PolarHBondContact N-O 3.43Å; Y471-Y474 PolarHBondContact O-N 3.25Å; Y471-I984 WeakPolarHBondContact CE2-O 3.46Å; Y471-P986 HydrophobicContact CD2-CB 4.08Å
472	R	92.5	Very high	94.8	Very high	28 Å²	28	15.6 Å²	15.6	11%	0.106	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	37.9	177.8	-63.6	175	61.2	-167.3	-3	114.7	I395 D396 Y474 L857 I984	I395-R472 HydrophobicContact CG2-CB 4.3Å; D396-R472 IonicContact OD1-NH1 2.85Å; D396-R472 PolarHBondContact OD1-NH1 2.92Å; R472-Y474 VanDerWaalsContact C-N 3.34Å; R472-Y474 WeakPolarHBondContact O-CD2 3.42Å; R472-L857 HydrophobicContact CG-CD2 4.47Å; R472-I984 HydrophobicContact CG-CG2 4.42Å
473	G	90.8	Very high	94.5	Very high	12 Å²	12	15.8 Å²	15.8	12%	0.124	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	-2.9	-179.7	0	0	0	0	0	115.2	Y471 R846 Q850	Y471-G473 PolarHBondContact O-N 3.32Å; Y471-G473 VanDerWaalsContact O-N 3.11Å; G473-R846 WeakPolarHBondContact CA-O 3.47Å; G473-R846 WeakPolarHBondContact O-CG 3.49Å; G473-Q850 WeakPolarHBondContact O-CG 3.34Å; G473-Q850 PolarHBondContact O-NE2 3.22Å
474	Y	92.9	Very high	93.9	Very high	60 Å²	60	15.7 Å²	15.7	24%	0.235	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	142.8	176.3	-62.1	-85.3	0	0	0	111.1	I395 F424 D470 Y471 R472 Q850 G851	I395-Y474 HydrophobicContact CD1-CD1 4.45Å; I395-Y474 HydrophobicContact CD1-CD2 4.04Å; I395-Y474 HydrophobicContact CD1-CG 3.77Å; I395-Y474 HydrophobicContact CG2-CD2 4.04Å; F424-Y474 AromaticContact CE2-CD1 3.78Å; F424-Y474 HydrophobicContact CE2-CD1 3.78Å; F424-Y474 HydrophobicContact CE2-CE1 4.01Å; F424-Y474 AromaticContact CZ-CD1 3.76Å; F424-Y474 HydrophobicContact CZ-CD1 3.76Å; F424-Y474 AromaticContact CZ-CE1 3.83Å; F424-Y474 HydrophobicContact CZ-CE1 3.83Å; D470-Y474 CarbonylContact C-O 3.48Å; D470-Y474 WeakPolarHBondContact CA-O 3.22Å; Y471-Y474 PolarHBondContact N-O 3.43Å; Y471-Y474 PolarHBondContact O-N 3.25Å; R472-Y474 VanDerWaalsContact C-N 3.34Å; R472-Y474 WeakPolarHBondContact O-CD2 3.42Å; Y474-Q850 HydrophobicContact CE1-CG 4.3Å; Y474-G851 PolarHBondContact OH-N 2.84Å
475	R	94.9	Very high	93.3	Very high	17 Å²	17	18.6 Å²	18.6	6%	0.064	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.8	166	173.6	159.3	-71.1	179.5	-0.3	108.2	G423 H440 T444 V468 V469 D470	G423-R475 PolarHBondContact N-O 3.31Å; H440-R475 PolarHBondContact CE1-NH1 3.48Å; H440-R475 PolarHBondContact CE1-NH2 3.34Å; H440-R475 PolarHBondContact ND1-NH1 2.99Å; H440-R475 PolarHBondContact NE2-NE 3.02Å; H440-R475 PolarHBondContact NE2-NH2 2.98Å; H440-R475 WeakPolarHBondContact O-CD 3.41Å; H440-R475 PolarHBondContact O-NH1 3.34Å; T444-R475 PolarHBondContact OG1-NH1 3.38Å; T444-R475 VanDerWaalsContact OG1-NH1 3.15Å; V468-R475 HydrophobicContact CG1-CG 3.87Å; V469-R475 WeakPolarHBondContact O-CA 3.43Å; D470-R475 VanDerWaalsContact CG-NH2 3.32Å; D470-R475 WeakPolarHBondContact OD1-CB 3.43Å; D470-R475 IonicContact OD1-CZ 3.37Å; D470-R475 VanDerWaalsContact OD1-CZ 3.29Å; D470-R475 IonicContact OD1-NE 3.42Å; D470-R475 PolarHBondContact OD1-NE 3.1Å; D470-R475 IonicContact OD1-NH2 3.47Å; D470-R475 PolarHBondContact OD1-NH2 3.38Å; D470-R475 IonicContact OD2-CZ 3.48Å; D470-R475 IonicContact OD2-NE 3.46Å; D470-R475 IonicContact OD2-NH2 3.4Å; D470-R475 PolarHBondContact OD2-NH2 3.06Å
476	V	96.1	Very high	92.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.5	178.1	-171.4	0	0	0	0	108.5	A391 I395 F420 S421 L422 V469	A391-V476 HydrophobicContact CB-CB 4.03Å; A391-V476 HydrophobicContact CB-CG1 3.97Å; A391-V476 HydrophobicContact CB-CG2 4.36Å; I395-V476 HydrophobicContact CD1-CG2 3.79Å; I395-V476 HydrophobicContact CG1-CG2 3.83Å; F420-V476 HydrophobicContact CB-CG1 4.12Å; F420-V476 HydrophobicContact CD1-CG1 3.92Å; S421-V476 WeakPolarHBondContact O-CA 3.39Å; L422-V476 HydrophobicContact CD2-CG2 3.99Å; V469-V476 PolarHBondContact N-O 2.67Å; V469-V476 PolarHBondContact O-N 3.35Å
477	T	96.5	Very high	91.5	Very high	9 Å²	9	29.6 Å²	29.6	6%	0.055	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126	171.1	-49.2	0	0	0	0	107.6	F420 S421 P443 Q479	F420-T477 VanDerWaalsContact CA-O 3.29Å; F420-T477 WeakPolarHBondContact CA-O 3.25Å; S421-T477 PolarHBondContact N-O 2.91Å; S421-T477 PolarHBondContact O-N 3.35Å; P443-T477 HydrophobicContact CB-CG2 4.34Å; P443-T477 WeakPolarHBondContact CB-OG1 3.37Å; P443-T477 VanDerWaalsContact CG-OG1 3.32Å; P443-T477 WeakPolarHBondContact CG-OG1 3.29Å; T477-Q479 HydrophobicContact CG2-CG 4.16Å
478	A	97.1	Very high	89.7	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.8	178.1	0	0	0	0	0	109	A387 I418 F419 F420 T466 V467	A387-A478 HydrophobicContact CB-CB 3.7Å; I418-A478 HydrophobicContact CG2-CB 3.96Å; F419-A478 CarbonylContact O-C 3.58Å; F419-A478 WeakPolarHBondContact O-CA 3.45Å; F420-A478 HydrophobicContact CD1-CB 3.66Å; F420-A478 HydrophobicContact CE1-CB 3.49Å; F420-A478 VanDerWaalsContact CE1-CB 3.49Å; F420-A478 HydrophobicContact CZ-CB 4.38Å; T466-A478 WeakPolarHBondContact CA-O 3.3Å; V467-A478 HydrophobicContact CB-CB 4.36Å; V467-A478 PolarHBondContact N-O 2.99Å; V467-A478 PolarHBondContact O-N 3.45Å
479	Q	96.1	Very high	87.7	Confident	33 Å²	33	50.9 Å²	50.9	15%	0.154	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	144.6	-175.3	-76.8	173.5	-35.2	0	0	112.4	I418 F419 D446 G465 T466 T477	I418-Q479 WeakPolarHBondContact CG2-O 3.49Å; F419-Q479 PolarHBondContact N-O 2.63Å; F419-Q479 PolarHBondContact O-N 3Å; D446-Q479 PolarHBondContact OD2-NE2 3.36Å; G465-Q479 CarbonylContact O-C 3.57Å; G465-Q479 WeakPolarHBondContact O-CA 3.3Å; T466-Q479 HydrophobicContact CG2-CG 4.08Å; T477-Q479 HydrophobicContact CG2-CG 4.16Å
480	S	94.9	Very high	85.5	Confident	4 Å²	4	54.6 Å²	54.6	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	152.2	167.7	67.1	0	0	0	0	110.5	G465	G465-S480 PolarHBondContact N-OG 2.91Å; G465-S480 PolarHBondContact O-N 2.96Å
481	I	91.7	Very high	83.3	Confident	39 Å²	39	62.2 Å²	62.2	20%	0.2	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-95.9	134	-174.5	-58.1	174.1	0	0	0	109.8	N352 I414 F419 I485 L486	N352-I481 VanDerWaalsContact CB-O 3.25Å; N352-I481 WeakPolarHBondContact CB-O 3.3Å; I414-I481 HydrophobicContact CD1-CD1 4.19Å; I414-I481 HydrophobicContact CG1-CD1 4.09Å; I414-I481 HydrophobicContact CG2-CD1 4.39Å; F419-I481 HydrophobicContact CB-CD1 4.46Å; F419-I481 HydrophobicContact CB-CG1 4Å; I481-I485 HydrophobicContact CG2-CG2 3.8Å; I481-L486 HydrophobicContact CG2-CD1 4.42Å
482	I	90.2	Very high	81.4	Confident	10 Å²	10	63.6 Å²	63.6	5%	0.051	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-73.9	129.2	173	-62	174.4	0	0	0	109.3	L464 G484 I485 I548 Y556 L558	L464-I482 HydrophobicContact CD1-CD1 4.43Å; L464-I482 HydrophobicContact CD1-CG1 4.45Å; L464-I482 HydrophobicContact CD2-CD1 4.04Å; L464-I482 HydrophobicContact CD2-CG1 3.51Å; I482-G484 PolarHBondContact O-N 2.64Å; I482-I485 HydrophobicContact CB-CB 4.28Å; I482-I485 HydrophobicContact CB-CG2 4.48Å; I482-I485 WeakPolarHBondContact O-CB 3.49Å; I482-I485 WeakPolarHBondContact O-CG2 3.42Å; I482-I485 PolarHBondContact O-N 3.47Å; I482-I548 HydrophobicContact CD1-CB 4.4Å; I482-I548 HydrophobicContact CD1-CD1 4.42Å; I482-I548 HydrophobicContact CD1-CG2 4.37Å; I482-Y556 HydrophobicContact CD1-CD2 4.36Å; I482-Y556 HydrophobicContact CD1-CG 4.08Å; I482-Y556 HydrophobicContact CG1-CD1 4.43Å; I482-Y556 HydrophobicContact CG1-CD2 4.31Å; I482-Y556 HydrophobicContact CG1-CG 4.19Å; I482-Y556 HydrophobicContact CG2-CD2 3.9Å; I482-Y556 HydrophobicContact CG2-CE2 3.97Å; I482-L558 HydrophobicContact CD1-CD2 4Å
483	P	87.8	Confident	80.4	Confident	32 Å²	32	66.3 Å²	66.3	21%	0.208	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	128	175.9	-26.1	35.2	0	0	0	112	N352 N551	N352-P483 VanDerWaalsContact ND2-CD 3.35Å; N352-P483 WeakPolarHBondContact ND2-CD 3.4Å; P483-N551 HydrophobicContact CB-CB 4.31Å; P483-N551 PolarHBondContact O-N 3.09Å
484	G	80.9	Confident	79.9	Confident	11 Å²	11	66.8 Å²	66.8	11%	0.113	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-16.2	179.6	0	0	0	0	0	116.1	I482 L486 E487 N551	I482-G484 PolarHBondContact O-N 2.64Å; G484-L486 PolarHBondContact O-N 3.21Å; G484-L486 VanDerWaalsContact O-N 3.08Å; G484-E487 PolarHBondContact O-N 3.42Å; G484-N551 WeakPolarHBondContact CA-ND2 3.38Å
485	I	81.5	Confident	79.8	Confident	80 Å²	80	65.8 Å²	65.8	41%	0.41	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.6	-171.4	-159.8	62.1	0	0	0	114.5	I481 I482 I548	I481-I485 HydrophobicContact CG2-CG2 3.8Å; I482-I485 HydrophobicContact CB-CB 4.28Å; I482-I485 HydrophobicContact CB-CG2 4.48Å; I482-I485 WeakPolarHBondContact O-CB 3.49Å; I482-I485 WeakPolarHBondContact O-CG2 3.42Å; I482-I485 PolarHBondContact O-N 3.47Å; I485-I548 HydrophobicContact CD1-CD1 4.49Å
486	L	76.1	Confident	79.6	Confident	119 Å²	119	65 Å²	65	62%	0.623	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-6.1	179.6	-62	176	0	0	0	113	I414 I481 G484	I414-L486 HydrophobicContact CD1-CD1 3.85Å; I481-L486 HydrophobicContact CG2-CD1 4.42Å; G484-L486 PolarHBondContact O-N 3.21Å; G484-L486 VanDerWaalsContact O-N 3.08Å
487	E	76.4	Confident	79.3	Confident	118 Å²	118	65 Å²	65	55%	0.551	32%	0.317	S	S	*	.			trans	-83.3	124.1	-177.4	-64.6	178.8	178.6	0	0	110.5	G484 E489 Q490 N551	G484-E487 PolarHBondContact O-N 3.42Å; E487-E489 PolarHBondContact O-N 2.79Å; E487-E489 VanDerWaalsContact O-N 3.16Å; E487-Q490 PolarHBondContact O-N 3.48Å; E487-N551 PolarHBondContact OE2-ND2 2.86Å
488	R	60.1	Low	78.8	Confident	252 Å²	252	64.7 Å²	64.7	95%	0.951	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.7	-173.2	-68.2	-176.2	179	-176.1	-0.4	114.9	Q490	R488-Q490 VanDerWaalsContact C-N 3.32Å
489	E	54.8	Low	77.9	Confident	196 Å²	196	68.5 Å²	68.5	92%	0.916	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-9.4	-176.1	-67.4	-174.8	167.8	0	0	112.9	E487	E487-E489 PolarHBondContact O-N 2.79Å; E487-E489 VanDerWaalsContact O-N 3.16Å
490	Q	52.5	Low	76.9	Confident	78 Å²	78	70.5 Å²	70.5	36%	0.364	35%	0.347	S	S	.	.			trans	-112.6	94	179.1	-96.8	176.4	-3.3	0	0	110.6	E487 R488 Q492 N551	E487-Q490 PolarHBondContact O-N 3.48Å; R488-Q490 VanDerWaalsContact C-N 3.32Å; Q490-Q492 HydrophobicContact CB-CG 4.07Å; Q490-Q492 HydrophobicContact CG-CG 4.3Å; Q490-Q492 PolarHBondContact O-N 3.08Å; Q490-N551 PolarHBondContact NE2-OD1 2.83Å; Q490-N551 PolarHBondContact OE1-ND2 3.49Å; Q490-N551 PolarHBondContact OE1-OD1 3.42Å
491	E	50.6	Low	75.8	Confident	191 Å²	191	74.5 Å²	74.5	89%	0.893	36%	0.364	S	S	*	.			trans	-67.9	71.7	154.2	-70.2	-179.9	169.3	0	0	107.8	S493	E491-S493 PolarHBondContact O-N 2.97Å
492	Q	55.5	Low	74.8	Confident	46 Å²	46	73.1 Å²	73.1	22%	0.215	36%	0.359	C	S	.	.			trans	-69	86	171.4	-82.1	-179.2	7.5	0	0	108.1	Q490 V494 I549 N551	Q490-Q492 HydrophobicContact CB-CG 4.07Å; Q490-Q492 HydrophobicContact CG-CG 4.3Å; Q490-Q492 PolarHBondContact O-N 3.08Å; Q492-V494 PolarHBondContact O-N 2.9Å; Q492-I549 VanDerWaalsContact CD-O 3.3Å; Q492-I549 PolarHBondContact NE2-O 2.96Å; Q492-I549 PolarHBondContact OE1-O 3.37Å; Q492-N551 PolarHBondContact NE2-OD1 3.17Å
493	S	70.3	Confident	74.2	Confident	86 Å²	86	78.7 Å²	78.7	60%	0.601	38%	0.383	S	S	*	.			trans	-58.6	126.2	173.2	56.5	0	0	0	0	108.7	E491 I495	E491-S493 PolarHBondContact O-N 2.97Å; S493-I495 WeakPolarHBondContact O-CG2 3.4Å; S493-I495 PolarHBondContact O-N 3.16Å; S493-I495 VanDerWaalsContact O-N 3.12Å
494	V	81.9	Confident	74	Confident	21 Å²	21	79.9 Å²	79.9	13%	0.127	39%	0.39	C	S	.	.			trans	-45.4	122.9	163.3	172.3	0	0	0	0	108.1	Q492 Y496 I499 V506 K546 I548	Q492-V494 PolarHBondContact O-N 2.9Å; V494-Y496 VanDerWaalsContact CG1-O 3.24Å; V494-Y496 WeakPolarHBondContact CG1-O 3.36Å; V494-I499 HydrophobicContact CB-CG2 3.48Å; V494-I499 VanDerWaalsContact CB-CG2 3.48Å; V494-I499 HydrophobicContact CG1-CG2 4.15Å; V494-I499 HydrophobicContact CG2-CG2 3.58Å; V494-V506 WeakPolarHBondContact O-CG2 3.49Å; V494-K546 HydrophobicContact CG1-CB 3.93Å; V494-K546 HydrophobicContact CG1-CG 3.96Å; V494-K546 HydrophobicContact CG2-CB 4.23Å; V494-K546 HydrophobicContact CG2-CD 3.97Å; V494-K546 HydrophobicContact CG2-CG 4.16Å; V494-I548 HydrophobicContact CG2-CD1 4.49Å; V494-I548 HydrophobicContact CG2-CG1 4.31Å
495	I	89.4	Confident	74.3	Confident	40 Å²	40	79.6 Å²	79.6	21%	0.205	39%	0.386	C	S	.	.			trans	-106.5	-6	-174.3	62.5	170.7	0	0	0	113.5	S493 V506 S507 H508 Y511 G547 I549	S493-I495 WeakPolarHBondContact O-CG2 3.4Å; S493-I495 PolarHBondContact O-N 3.16Å; S493-I495 VanDerWaalsContact O-N 3.12Å; I495-V506 VanDerWaalsContact C-CG2 3.48Å; I495-S507 CarbonylContact O-C 3.58Å; I495-H508 HydrophobicContact CD1-CB 4.36Å; I495-H508 HydrophobicContact CG1-CB 4.46Å; I495-H508 WeakPolarHBondContact O-CB 3.49Å; I495-Y511 HydrophobicContact CD1-CD2 4.31Å; I495-Y511 HydrophobicContact CD1-CE2 3.88Å; I495-Y511 HydrophobicContact CG1-CD2 4.29Å; I495-Y511 HydrophobicContact CG1-CE2 3.87Å; I495-G547 PolarHBondContact N-O 3.44Å; I495-I549 HydrophobicContact CD1-CD1 3.31Å; I495-I549 HydrophobicContact CD1-CG1 3.55Å
496	Y	91.8	Very high	74.7	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	134.5	174.3	175.5	-85.5	0	0	0	109.7	V494 V506 Y511 L512 L515 L539 C540 S541 K546 G547	V494-Y496 VanDerWaalsContact CG1-O 3.24Å; V494-Y496 WeakPolarHBondContact CG1-O 3.36Å; Y496-V506 CarbonylContact C-O 3.57Å; Y496-V506 WeakPolarHBondContact CA-O 3.23Å; Y496-Y511 HydrophobicContact CD1-CD1 4.46Å; Y496-Y511 HydrophobicContact CD2-CG 4.21Å; Y496-Y511 HydrophobicContact CG-CD1 4.27Å; Y496-Y511 HydrophobicContact CG-CD2 4.47Å; Y496-Y511 AromaticContact CG-CG 3.93Å; Y496-Y511 HydrophobicContact CG-CG 3.93Å; Y496-L512 HydrophobicContact CE2-CD2 4.11Å; Y496-L515 HydrophobicContact CD1-CD1 4.17Å; Y496-L515 HydrophobicContact CE1-CD1 3.48Å; Y496-L515 VanDerWaalsContact CE1-CD1 3.48Å; Y496-L515 HydrophobicContact CE2-CD1 3.95Å; Y496-L515 WeakPolarHBondContact OH-CD1 3.36Å; Y496-L539 HydrophobicContact CD2-CD2 4.26Å; Y496-L539 HydrophobicContact CE1-CD2 4.35Å; Y496-L539 HydrophobicContact CE2-CD2 3.69Å; Y496-C540 PolarHBondContact OH-N 3.46Å; Y496-S541 PolarHBondContact OH-N 3.43Å; Y496-K546 CarbonylContact O-C 3.54Å; Y496-K546 WeakPolarHBondContact O-CA 3.49Å; Y496-G547 PolarHBondContact O-N 3.23Å
497	G	89.9	Confident	75.4	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.7	-149.1	-176	0	0	0	0	0	112.9	V505 V506 C545	G497-V505 WeakPolarHBondContact O-CA 3.23Å; G497-V506 PolarHBondContact N-O 3.28Å; G497-V506 WeakPolarHBondContact O-CG2 3.37Å; G497-V506 PolarHBondContact O-N 2.95Å; G497-C545 VanDerWaalsContact CA-O 3.3Å; G497-C545 WeakPolarHBondContact CA-O 3.23Å
498	S	85.9	Confident	76.1	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.014	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.5	-169.6	179.1	0	0	0	0	114.7	D500 F501 G502 T504 V543 K546	S498-D500 PolarHBondContact OG-N 3.04Å; S498-D500 VanDerWaalsContact OG-N 3.12Å; S498-F501 PolarHBondContact OG-N 2.95Å; S498-F501 VanDerWaalsContact OG-N 3.12Å; S498-G502 PolarHBondContact OG-N 3.11Å; S498-T504 WeakPolarHBondContact CA-O 3.28Å; S498-T504 PolarHBondContact OG-O 3.4Å; S498-V543 WeakPolarHBondContact CB-O 3.29Å; S498-V543 PolarHBondContact N-O 3.07Å; S498-K546 VanDerWaalsContact O-CE 3.3Å; S498-K546 WeakPolarHBondContact O-CE 3.39Å
499	I	77.1	Confident	77.7	Confident	80 Å²	80	63.1 Å²	63.1	41%	0.41	34%	0.337	S	S	.	.	S	Bend	trans	-85.9	-31	167.6	52.2	171.6	0	0	0	113.3	V494 T504	V494-I499 HydrophobicContact CB-CG2 3.48Å; V494-I499 VanDerWaalsContact CB-CG2 3.48Å; V494-I499 HydrophobicContact CG1-CG2 4.15Å; V494-I499 HydrophobicContact CG2-CG2 3.58Å; I499-T504 HydrophobicContact CD1-CG2 4.04Å; I499-T504 HydrophobicContact CG1-CG2 4.13Å; I499-T504 PolarHBondContact N-O 3.27Å
500	D	75.6	Confident	79.5	Confident	76 Å²	76	57.7 Å²	57.7	41%	0.406	31%	0.311	S	S	.	.	S	Bend	trans	-126.3	45.4	-169.5	-60.3	-43.7	0	0	0	112.4	S498 G502 K503 T504	S498-D500 PolarHBondContact OG-N 3.04Å; S498-D500 VanDerWaalsContact OG-N 3.12Å; D500-G502 PolarHBondContact O-N 3.27Å; D500-K503 HydrophobicContact CB-CB 4.02Å; D500-K503 HydrophobicContact CB-CD 4.27Å; D500-K503 HydrophobicContact CB-CG 4.44Å; D500-K503 WeakPolarHBondContact O-CG 3.35Å; D500-K503 PolarHBondContact O-N 2.92Å; D500-T504 PolarHBondContact OD2-OG1 3.45Å
501	F	71.7	Confident	81.5	Confident	88 Å²	88	54 Å²	54	39%	0.386	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	47.6	177.5	-58.1	-85.3	0	0	0	115.3	H429 S498	H429-F501 HydrophobicContact CB-CZ 4.47Å; S498-F501 PolarHBondContact OG-N 2.95Å; S498-F501 VanDerWaalsContact OG-N 3.12Å
502	G	70.8	Confident	83.6	Confident	9 Å²	9	46.3 Å²	46.3	9%	0.093	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.2	-7.5	175	0	0	0	0	0	115.5	S498 D500 V505	S498-G502 PolarHBondContact OG-N 3.11Å; D500-G502 PolarHBondContact O-N 3.27Å; G502-V505 WeakPolarHBondContact O-CG2 3.28Å
503	K	76.9	Confident	85.4	Confident	127 Å²	127	48.3 Å²	48.3	55%	0.552	27%	0.268	S	S	*	.	S	Bend	trans	-70.5	-55.1	176.1	-61.5	179.4	-177.3	178.7	0	111.7	D500 E532	D500-K503 HydrophobicContact CB-CB 4.02Å; D500-K503 HydrophobicContact CB-CD 4.27Å; D500-K503 HydrophobicContact CB-CG 4.44Å; D500-K503 WeakPolarHBondContact O-CG 3.35Å; D500-K503 PolarHBondContact O-N 2.92Å; K503-E532 WeakPolarHBondContact O-CB 3.35Å; K503-E532 PolarHBondContact O-N 3.12Å
504	T	84.1	Confident	86.6	Confident	57 Å²	57	44.4 Å²	44.4	35%	0.35	24%	0.24	S	C	.	.	S	Bend	trans	-107.8	96.1	177.7	-50.5	0	0	0	0	108.7	S498 I499 D500	S498-T504 WeakPolarHBondContact CA-O 3.28Å; S498-T504 PolarHBondContact OG-O 3.4Å; I499-T504 HydrophobicContact CD1-CG2 4.04Å; I499-T504 HydrophobicContact CG1-CG2 4.13Å; I499-T504 PolarHBondContact N-O 3.27Å; D500-T504 PolarHBondContact OD2-OG1 3.45Å
505	V	87.1	Confident	87.2	Confident	6 Å²	6	43.4 Å²	43.4	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.8	176.4	-170	0	0	0	0	109.3	G497 G502 V529 N531 V537 L539 V543	G497-V505 WeakPolarHBondContact O-CA 3.23Å; G502-V505 WeakPolarHBondContact O-CG2 3.28Å; V505-V529 HydrophobicContact CB-CG2 4.48Å; V505-V529 HydrophobicContact CG1-CG2 3.92Å; V505-V529 HydrophobicContact CG2-CG2 4.46Å; V505-N531 HydrophobicContact CB-CB 4.43Å; V505-V537 HydrophobicContact CG1-CB 4.3Å; V505-V537 HydrophobicContact CG1-CG1 4.02Å; V505-L539 HydrophobicContact CG1-CD1 3.97Å; V505-L539 HydrophobicContact CG1-CD2 4.3Å; V505-L539 HydrophobicContact CG1-CG 4.47Å; V505-V543 HydrophobicContact CG2-CG1 3.96Å
506	V	89.4	Confident	87.4	Confident	52 Å²	52	45.2 Å²	45.2	32%	0.315	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.8	176.8	-68.6	0	0	0	0	110.4	V494 I495 Y496 G497	V494-V506 WeakPolarHBondContact O-CG2 3.49Å; I495-V506 VanDerWaalsContact C-CG2 3.48Å; Y496-V506 CarbonylContact C-O 3.57Å; Y496-V506 WeakPolarHBondContact CA-O 3.23Å; G497-V506 PolarHBondContact N-O 3.28Å; G497-V506 WeakPolarHBondContact O-CG2 3.37Å; G497-V506 PolarHBondContact O-N 2.95Å
507	S	90.8	Very high	87.5	Confident	43 Å²	43	50.3 Å²	50.3	30%	0.301	27%	0.266	S	S	.	.			trans	-139.9	152.5	176.3	-172.4	0	0	0	0	110.3	I495 V537 E538	I495-S507 CarbonylContact O-C 3.58Å; S507-V537 VanDerWaalsContact CB-CG1 3.49Å; S507-E538 WeakPolarHBondContact CB-O 3.36Å; S507-E538 PolarHBondContact OG-O 2.97Å
508	H	92.4	Very high	87.7	Confident	74 Å²	74	50.4 Å²	50.4	34%	0.343	27%	0.267	S	S	.	.			trans	-136.4	130.8	-175.9	-174.1	-89.1	0	0	0	109.6	I495 K510 Y511 L512	I495-H508 HydrophobicContact CD1-CB 4.36Å; I495-H508 HydrophobicContact CG1-CB 4.46Å; I495-H508 WeakPolarHBondContact O-CB 3.49Å; H508-K510 VanDerWaalsContact C-N 3.25Å; H508-K510 PolarHBondContact ND1-N 3.5Å; H508-K510 PolarHBondContact O-N 3.47Å; H508-K510 VanDerWaalsContact O-N 3.14Å; H508-Y511 HydrophobicContact CB-CD2 4.14Å; H508-Y511 PolarHBondContact O-N 2.96Å; H508-L512 PolarHBondContact O-N 3.1Å; H508-L512 VanDerWaalsContact O-N 3.14Å
509	G	92.5	Very high	87.9	Confident	54 Å²	54	50.3 Å²	50.3	56%	0.557	27%	0.266	S	S	*	.	H	α-helix	trans	-55.8	-36.7	-172.7	0	0	0	0	0	113.9	L512 E513	G509-L512 PolarHBondContact O-N 2.96Å; G509-E513 PolarHBondContact O-N 3.1Å; G509-E513 VanDerWaalsContact O-N 3.08Å
510	K	92.7	Very high	88.6	Confident	81 Å²	81	54.8 Å²	54.8	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-66.9	-36.5	177.2	-166.3	66	-172.5	170.1	0	113.1	H508 E513 L514	H508-K510 VanDerWaalsContact C-N 3.25Å; H508-K510 PolarHBondContact ND1-N 3.5Å; H508-K510 PolarHBondContact O-N 3.47Å; H508-K510 VanDerWaalsContact O-N 3.14Å; K510-E513 WeakPolarHBondContact CD-OE2 3.44Å; K510-E513 IonicContact NZ-OE1 2.71Å; K510-E513 PolarHBondContact NZ-OE1 3.03Å; K510-E513 IonicContact NZ-OE2 3.7Å; K510-E513 PolarHBondContact NZ-OE2 3.12Å; K510-E513 PolarHBondContact O-N 2.93Å; K510-L514 HydrophobicContact CG-CD1 4.28Å; K510-L514 VanDerWaalsContact O-CG 3.29Å; K510-L514 WeakPolarHBondContact O-CG 3.4Å; K510-L514 PolarHBondContact O-N 3.05Å
511	Y	94.3	Very high	89.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69.6	-38.1	175.8	-87	-82.7	0	0	0	111.3	L461 I495 Y496 H508 E513 L514 L515 G547 I548 H555 Y556	L461-Y511 HydrophobicContact CD1-CD1 4.49Å; L461-Y511 HydrophobicContact CD1-CE1 4.31Å; I495-Y511 HydrophobicContact CD1-CD2 4.31Å; I495-Y511 HydrophobicContact CD1-CE2 3.88Å; I495-Y511 HydrophobicContact CG1-CD2 4.29Å; I495-Y511 HydrophobicContact CG1-CE2 3.87Å; Y496-Y511 HydrophobicContact CD1-CD1 4.46Å; Y496-Y511 HydrophobicContact CD2-CG 4.21Å; Y496-Y511 HydrophobicContact CG-CD1 4.27Å; Y496-Y511 HydrophobicContact CG-CD2 4.47Å; Y496-Y511 AromaticContact CG-CG 3.93Å; Y496-Y511 HydrophobicContact CG-CG 3.93Å; H508-Y511 HydrophobicContact CB-CD2 4.14Å; H508-Y511 PolarHBondContact O-N 2.96Å; Y511-E513 VanDerWaalsContact C-N 3.34Å; Y511-E513 PolarHBondContact O-N 3.45Å; Y511-L514 PolarHBondContact O-N 2.66Å; Y511-L515 HydrophobicContact CD1-CD1 4.36Å; Y511-L515 VanDerWaalsContact O-CB 3.23Å; Y511-L515 WeakPolarHBondContact O-CB 3.47Å; Y511-L515 VanDerWaalsContact O-CG 3.23Å; Y511-L515 WeakPolarHBondContact O-CG 3.26Å; Y511-L515 PolarHBondContact O-N 2.95Å; Y511-G547 VanDerWaalsContact CZ-CA 3.45Å; Y511-G547 WeakPolarHBondContact OH-CA 3.44Å; Y511-I548 PolarHBondContact OH-N 2.93Å; Y511-I548 PolarHBondContact OH-O 3.01Å; Y511-H555 HydrophobicContact CE1-CB 4.31Å; Y511-H555 HydrophobicContact CE2-CB 4.43Å; Y511-H555 AromaticContact CE2-CD2 3.86Å; Y511-Y556 PolarHBondContact OH-N 2.93Å; Y511-Y556 PolarHBondContact OH-O 3.16Å
512	L	94.5	Very high	90.4	Very high	31 Å²	31	50.3 Å²	50.3	16%	0.162	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-44.8	173.9	-65.6	175.3	0	0	0	111.4	Y496 H508 G509 L514 D516 E538	Y496-L512 HydrophobicContact CE2-CD2 4.11Å; H508-L512 PolarHBondContact O-N 3.1Å; H508-L512 VanDerWaalsContact O-N 3.14Å; G509-L512 PolarHBondContact O-N 2.96Å; L512-L514 PolarHBondContact O-N 3.23Å; L512-D516 VanDerWaalsContact O-CB 3.24Å; L512-D516 WeakPolarHBondContact O-CB 3.27Å; L512-D516 PolarHBondContact O-N 3.4Å; L512-E538 HydrophobicContact CD1-CG 4.5Å; L512-E538 HydrophobicContact CD2-CG 4.28Å
513	E	94.9	Very high	91.6	Very high	88 Å²	88	52.7 Å²	52.7	41%	0.411	27%	0.269	S	S	.	.	H	α-helix	trans	-61.2	-44.1	176.1	-169.5	-152.2	140.6	0	0	112.5	G509 K510 Y511 K517	G509-E513 PolarHBondContact O-N 3.1Å; G509-E513 VanDerWaalsContact O-N 3.08Å; K510-E513 WeakPolarHBondContact CD-OE2 3.44Å; K510-E513 IonicContact NZ-OE1 2.71Å; K510-E513 PolarHBondContact NZ-OE1 3.03Å; K510-E513 IonicContact NZ-OE2 3.7Å; K510-E513 PolarHBondContact NZ-OE2 3.12Å; K510-E513 PolarHBondContact O-N 2.93Å; Y511-E513 VanDerWaalsContact C-N 3.34Å; Y511-E513 PolarHBondContact O-N 3.45Å; E513-K517 IonicContact OE1-NZ 3.85Å; E513-K517 PolarHBondContact OE1-NZ 3.33Å
514	L	94.4	Very high	92.3	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-71.4	-41.7	-178.6	-69.7	173.5	0	0	0	112.3	V458 E459 G460 L461 K510 Y511 L512 K517 H555	V458-L514 HydrophobicContact CG1-CD2 4.29Å; E459-L514 VanDerWaalsContact O-CD2 3.3Å; E459-L514 WeakPolarHBondContact O-CD2 3.47Å; G460-L514 WeakPolarHBondContact O-CD1 3.47Å; L461-L514 HydrophobicContact CB-CB 4.38Å; L461-L514 HydrophobicContact CB-CD1 4.43Å; L461-L514 HydrophobicContact CD1-CB 4.45Å; L461-L514 HydrophobicContact CD1-CD1 4.49Å; K510-L514 HydrophobicContact CG-CD1 4.28Å; K510-L514 VanDerWaalsContact O-CG 3.29Å; K510-L514 WeakPolarHBondContact O-CG 3.4Å; K510-L514 PolarHBondContact O-N 3.05Å; Y511-L514 PolarHBondContact O-N 2.66Å; L512-L514 PolarHBondContact O-N 3.23Å; L514-K517 WeakPolarHBondContact O-CB 3.47Å; L514-K517 PolarHBondContact O-N 3.43Å; L514-H555 HydrophobicContact CD1-CB 4.12Å
515	L	94.3	Very high	92.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-79.8	-23.5	-178.2	-64.7	172.7	0	0	0	112.9	Y453 L461 Y496 Y511 K517 T518 S519 C540 I557	Y453-L515 HydrophobicContact CE1-CD2 3.64Å; L461-L515 HydrophobicContact CD1-CD2 4.31Å; L461-L515 HydrophobicContact CD2-CD2 3.7Å; Y496-L515 HydrophobicContact CD1-CD1 4.17Å; Y496-L515 HydrophobicContact CE1-CD1 3.48Å; Y496-L515 VanDerWaalsContact CE1-CD1 3.48Å; Y496-L515 HydrophobicContact CE2-CD1 3.95Å; Y496-L515 WeakPolarHBondContact OH-CD1 3.36Å; Y511-L515 HydrophobicContact CD1-CD1 4.36Å; Y511-L515 VanDerWaalsContact O-CB 3.23Å; Y511-L515 WeakPolarHBondContact O-CB 3.47Å; Y511-L515 VanDerWaalsContact O-CG 3.23Å; Y511-L515 WeakPolarHBondContact O-CG 3.26Å; Y511-L515 PolarHBondContact O-N 2.95Å; L515-K517 PolarHBondContact O-N 3.3Å; L515-T518 PolarHBondContact O-N 2.83Å; L515-T518 PolarHBondContact O-OG1 2.73Å; L515-S519 PolarHBondContact O-N 3Å; L515-S519 VanDerWaalsContact O-N 3.11Å; L515-C540 HydrophobicContact CB-CB 3.58Å; L515-I557 HydrophobicContact CD1-CD1 4.21Å; L515-I557 HydrophobicContact CD2-CD1 3.64Å
516	D	93.4	Very high	92.9	Very high	78 Å²	78	48.3 Å²	48.3	42%	0.417	25%	0.246	S	C	.	.	H	α-helix	trans	-61.4	-35.2	170.4	-174.7	56	0	0	0	111.2	L512 T518 S519	L512-D516 VanDerWaalsContact O-CB 3.24Å; L512-D516 WeakPolarHBondContact O-CB 3.27Å; L512-D516 PolarHBondContact O-N 3.4Å; D516-T518 PolarHBondContact O-N 3.28Å; D516-S519 WeakPolarHBondContact O-CB 3.16Å; D516-S519 PolarHBondContact O-N 3.21Å; D516-S519 VanDerWaalsContact O-N 3.12Å
517	K	94.6	Very high	93.1	Very high	108 Å²	108	46.5 Å²	46.5	47%	0.47	23%	0.234	S	C	.	.	H	α-helix	trans	-63.7	-27.3	173.7	-60.9	173.8	-170.6	172.2	0	112.7	V458 E513 L514 L515 P521	V458-K517 HydrophobicContact CG1-CB 4.07Å; V458-K517 HydrophobicContact CG1-CD 3.88Å; V458-K517 HydrophobicContact CG2-CB 3.98Å; E513-K517 IonicContact OE1-NZ 3.85Å; E513-K517 PolarHBondContact OE1-NZ 3.33Å; L514-K517 WeakPolarHBondContact O-CB 3.47Å; L514-K517 PolarHBondContact O-N 3.43Å; L515-K517 PolarHBondContact O-N 3.3Å; K517-P521 WeakPolarHBondContact O-CD 3.47Å
518	T	93.7	Very high	93.2	Very high	1 Å²	1	48 Å²	48	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-87	-15.8	176.2	69.4	0	0	0	0	113.3	Y453 V456 V458 L461 L515 D516 R520 P521 L522	Y453-T518 HydrophobicContact CD1-CG2 3.98Å; Y453-T518 HydrophobicContact CE1-CG2 3.91Å; V456-T518 HydrophobicContact CG1-CG2 4.29Å; V458-T518 HydrophobicContact CB-CG2 4.35Å; V458-T518 HydrophobicContact CG2-CG2 3.49Å; V458-T518 VanDerWaalsContact CG2-CG2 3.49Å; L461-T518 HydrophobicContact CD2-CG2 3.94Å; L515-T518 PolarHBondContact O-N 2.83Å; L515-T518 PolarHBondContact O-OG1 2.73Å; D516-T518 PolarHBondContact O-N 3.28Å; T518-R520 PolarHBondContact O-N 2.91Å; T518-P521 WeakPolarHBondContact O-CD 3.46Å; T518-L522 WeakPolarHBondContact O-CB 3.43Å; T518-L522 WeakPolarHBondContact O-CG 2.98Å; T518-L522 PolarHBondContact O-N 3.41Å
519	S	91.5	Very high	93.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56	-51.4	-175.1	175.3	0	0	0	0	113.6	L515 D516 K523 V524 R736	L515-S519 PolarHBondContact O-N 3Å; L515-S519 VanDerWaalsContact O-N 3.11Å; D516-S519 WeakPolarHBondContact O-CB 3.16Å; D516-S519 PolarHBondContact O-N 3.21Å; D516-S519 VanDerWaalsContact O-N 3.12Å; S519-K523 CarbonylContact O-C 3.59Å; S519-K523 WeakPolarHBondContact O-CA 3.44Å; S519-K523 PolarHBondContact O-N 2.85Å; S519-V524 WeakPolarHBondContact CA-O 3.47Å; S519-V524 WeakPolarHBondContact CB-O 3.31Å; S519-V524 PolarHBondContact O-N 2.85Å; S519-V524 PolarHBondContact OG-O 2.84Å; S519-R736 VanDerWaalsContact OG-CD 3.27Å; S519-R736 WeakPolarHBondContact OG-CD 3.49Å; S519-R736 PolarHBondContact OG-NH1 2.94Å
520	R	90.8	Very high	93	Very high	174 Å²	174	43.3 Å²	43.3	66%	0.657	20%	0.2	S	C	*	.	H	α-helix	trans	-72.2	-43.6	-177.6	-71.3	-177.4	-178.2	179.2	3.4	113.8	T518 K523	T518-R520 PolarHBondContact O-N 2.91Å; R520-K523 WeakPolarHBondContact O-CD 3.48Å; R520-K523 WeakPolarHBondContact O-CE 3.45Å; R520-K523 PolarHBondContact O-NZ 2.86Å
521	P	92.4	Very high	92.7	Very high	63 Å²	63	40.1 Å²	40.1	41%	0.409	19%	0.187	S	C	.	.	H	α-helix	trans	-62.5	-46.9	175.3	-26.6	36.3	0	0	0	112.9	V456 K517 T518 K523	V456-P521 HydrophobicContact CG1-CB 3.98Å; V456-P521 HydrophobicContact CG1-CG 3.91Å; V456-P521 HydrophobicContact CG2-CB 3.71Å; K517-P521 WeakPolarHBondContact O-CD 3.47Å; T518-P521 WeakPolarHBondContact O-CD 3.46Å; P521-K523 VanDerWaalsContact C-N 3.28Å; P521-K523 PolarHBondContact O-N 2.96Å
522	L	93.4	Very high	92.1	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-81.6	-5.8	-177.6	-60	-175.6	0	0	0	113.9	A452 Y453 V456 T518 V524 T563	A452-L522 HydrophobicContact CB-CD2 3.87Å; Y453-L522 HydrophobicContact CD1-CD1 4.04Å; Y453-L522 HydrophobicContact CD2-CD1 3.97Å; Y453-L522 HydrophobicContact CE1-CD1 3.85Å; Y453-L522 HydrophobicContact CE2-CD1 3.79Å; Y453-L522 HydrophobicContact CG-CD1 4.11Å; V456-L522 HydrophobicContact CG2-CD2 3.51Å; V456-L522 HydrophobicContact CG2-CG 3.87Å; T518-L522 WeakPolarHBondContact O-CB 3.43Å; T518-L522 WeakPolarHBondContact O-CG 2.98Å; T518-L522 PolarHBondContact O-N 3.41Å; L522-V524 HydrophobicContact CB-CB 4.48Å; L522-V524 HydrophobicContact CB-CG2 3.81Å; L522-V524 PolarHBondContact O-N 2.79Å; L522-T563 HydrophobicContact CD1-CG2 4.49Å
523	K	94.5	Very high	91.6	Very high	60 Å²	60	52.7 Å²	52.7	26%	0.261	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	35.3	-173	-49.1	-62.2	171.6	-155.4	0	112.6	S519 R520 P521 I603 V607 R736 F737	S519-K523 CarbonylContact O-C 3.59Å; S519-K523 WeakPolarHBondContact O-CA 3.44Å; S519-K523 PolarHBondContact O-N 2.85Å; R520-K523 WeakPolarHBondContact O-CD 3.48Å; R520-K523 WeakPolarHBondContact O-CE 3.45Å; R520-K523 PolarHBondContact O-NZ 2.86Å; P521-K523 VanDerWaalsContact C-N 3.28Å; P521-K523 PolarHBondContact O-N 2.96Å; K523-I603 HydrophobicContact CB-CG2 3.85Å; K523-I603 HydrophobicContact CG-CG2 3.99Å; K523-V607 HydrophobicContact CD-CG2 4.4Å; K523-V607 HydrophobicContact CG-CG2 4.42Å; K523-R736 CarbonylContact O-C 3.58Å; K523-R736 WeakPolarHBondContact O-CA 3.36Å; K523-F737 PolarHBondContact O-N 3.07Å
524	V	92.9	Very high	91.1	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.024	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-100.4	128.7	179.4	175.9	0	0	0	0	109.5	S519 L522 C540 F737 P739	S519-V524 WeakPolarHBondContact CA-O 3.47Å; S519-V524 WeakPolarHBondContact CB-O 3.31Å; S519-V524 PolarHBondContact O-N 2.85Å; S519-V524 PolarHBondContact OG-O 2.84Å; L522-V524 HydrophobicContact CB-CB 4.48Å; L522-V524 HydrophobicContact CB-CG2 3.81Å; L522-V524 PolarHBondContact O-N 2.79Å; V524-C540 WeakPolarHBondContact CG1-O 3.49Å; V524-F737 CarbonylContact C-O 3.56Å; V524-F737 WeakPolarHBondContact CA-O 3.3Å; V524-P739 HydrophobicContact CG1-CG 4.12Å
525	Q	91.7	Very high	90.7	Very high	28 Å²	28	58.4 Å²	58.4	13%	0.131	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-91.9	136.7	-176.1	-165.9	-167.4	-13.6	0	0	112	H527 I728 R736 F737 N738	Q525-H527 PolarHBondContact O-ND1 3.48Å; Q525-I728 HydrophobicContact CG-CD1 3.91Å; Q525-R736 HydrophobicContact CB-CB 3.91Å; Q525-R736 HydrophobicContact CG-CB 4.44Å; Q525-F737 PolarHBondContact N-O 2.99Å; Q525-N738 HydrophobicContact CB-CB 4.4Å
526	Q	91.9	Very high	90.6	Very high	65 Å²	65	61.5 Å²	61.5	30%	0.304	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-65.4	133.3	164.1	-179.1	174.2	5.2	0	0	111	E538 L539	Q526-E538 HydrophobicContact CG-CG 4.18Å; Q526-E538 PolarHBondContact NE2-OE1 3.42Å; Q526-L539 CarbonylContact C-O 3.59Å; Q526-L539 VanDerWaalsContact CA-O 3.31Å; Q526-L539 WeakPolarHBondContact CA-O 3.41Å
527	H	92.6	Very high	90.4	Very high	14 Å²	14	58.6 Å²	58.6	7%	0.065	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	168.1	-174.2	64.1	-82.8	0	0	0	111.5	Q525 L539 S541 N738 D740	Q525-H527 PolarHBondContact O-ND1 3.48Å; H527-L539 PolarHBondContact N-O 3.46Å; H527-L539 PolarHBondContact O-N 3.46Å; H527-S541 PolarHBondContact CE1-O 2.85Å; H527-N738 WeakPolarHBondContact CB-ND2 3.43Å; H527-N738 PolarHBondContact CE1-OD1 3.26Å; H527-N738 VanDerWaalsContact CG-CG 3.48Å; H527-N738 VanDerWaalsContact CG-ND2 3.32Å; H527-N738 PolarHBondContact ND1-OD1 2.99Å; H527-D740 IonicContact CE1-OD2 2.8Å; H527-D740 PolarHBondContact CE1-OD2 2.78Å; H527-D740 IonicContact NE2-OD2 2.92Å; H527-D740 PolarHBondContact NE2-OD2 2.59Å
528	K	93.1	Very high	90.4	Very high	75 Å²	75	57.2 Å²	57.2	33%	0.326	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	142.9	178.1	-62.7	178.3	-176.5	177.1	0	110.7	V537 F748 P749 D751 T752	K528-V537 CarbonylContact C-O 3.49Å; K528-V537 VanDerWaalsContact CA-O 3.32Å; K528-V537 WeakPolarHBondContact CA-O 3.33Å; K528-F748 VanDerWaalsContact O-CD1 3.26Å; K528-F748 WeakPolarHBondContact O-CD1 3.4Å; K528-P749 HydrophobicContact CB-CG 3.94Å; K528-D751 IonicContact NZ-OD2 3.07Å; K528-D751 PolarHBondContact NZ-OD2 2.76Å; K528-T752 HydrophobicContact CD-CG2 4.35Å
529	V	91.7	Very high	90.3	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.8	174.6	-61	0	0	0	0	110.4	V505 S536 V537 L539 V543 V746 R747 F748	V505-V529 HydrophobicContact CB-CG2 4.48Å; V505-V529 HydrophobicContact CG1-CG2 3.92Å; V505-V529 HydrophobicContact CG2-CG2 4.46Å; V529-S536 WeakPolarHBondContact O-CA 3.39Å; V529-V537 HydrophobicContact CG2-CB 4.38Å; V529-V537 PolarHBondContact N-O 3.39Å; V529-V537 PolarHBondContact O-N 2.88Å; V529-L539 HydrophobicContact CG1-CD1 4.43Å; V529-L539 HydrophobicContact CG2-CD1 3.72Å; V529-L539 HydrophobicContact CG2-CG 4.32Å; V529-V543 HydrophobicContact CB-CG2 4.29Å; V529-V543 HydrophobicContact CG1-CG2 3.78Å; V529-V543 HydrophobicContact CG2-CG2 4.01Å; V529-V746 HydrophobicContact CB-CG1 4.21Å; V529-V746 HydrophobicContact CG1-CG1 3.65Å; V529-R747 CarbonylContact C-O 3.57Å; V529-R747 WeakPolarHBondContact CA-O 3.4Å; V529-F748 HydrophobicContact CG1-CE1 4.23Å
530	L	89.6	Confident	90.3	Very high	27 Å²	27	57.2 Å²	57.2	14%	0.141	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	130	174.8	-65.1	170	0	0	0	110.1	E535 R747 F748 P749	L530-E535 WeakPolarHBondContact CA-O 3.49Å; L530-R747 HydrophobicContact CB-CB 4.1Å; L530-R747 HydrophobicContact CD1-CB 4.27Å; L530-R747 PolarHBondContact N-O 3.4Å; L530-F748 WeakPolarHBondContact CD1-O 3.16Å; L530-P749 HydrophobicContact CD2-CB 4.34Å; L530-P749 HydrophobicContact CD2-CG 3.85Å; L530-P749 HydrophobicContact CG-CG 4Å
531	N	86.4	Confident	90.3	Very high	15 Å²	15	49 Å²	49	8%	0.08	24%	0.24	C	C	.	.			trans	-78.4	179.7	169.6	71.1	11.3	0	0	0	111.5	V505 K533 E534 E535 R747	V505-N531 HydrophobicContact CB-CB 4.43Å; N531-K533 PolarHBondContact O-N 3.47Å; N531-K533 VanDerWaalsContact O-N 3.17Å; N531-K533 WeakPolarHBondContact OD1-CA 3.4Å; N531-K533 WeakPolarHBondContact OD1-CB 3.43Å; N531-K533 PolarHBondContact OD1-N 3.1Å; N531-E534 PolarHBondContact O-N 2.76Å; N531-E534 PolarHBondContact OD1-N 3.06Å; N531-E535 PolarHBondContact N-O 3.3Å; N531-E535 VanDerWaalsContact N-O 3.09Å; N531-E535 PolarHBondContact ND2-OE2 2.9Å; N531-E535 WeakPolarHBondContact OD1-CB 3.42Å; N531-E535 PolarHBondContact OD1-N 3.4Å; N531-R747 PolarHBondContact O-NH2 3.06Å; N531-R747 VanDerWaalsContact O-NH2 3.09Å
532	E	82.3	Confident	90.2	Very high	132 Å²	132	46 Å²	46	62%	0.617	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.1	177.7	-171.3	172.5	-172.5	0	0	113.2	K503 E534	K503-E532 WeakPolarHBondContact O-CB 3.35Å; K503-E532 PolarHBondContact O-N 3.12Å; E532-E534 VanDerWaalsContact C-N 3.32Å
533	K	83.8	Confident	90	Very high	163 Å²	163	45.8 Å²	45.8	71%	0.709	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	7.6	177.1	-59.5	179	-177.3	172.3	0	113.7	N531 E535	N531-K533 PolarHBondContact O-N 3.47Å; N531-K533 VanDerWaalsContact O-N 3.17Å; N531-K533 WeakPolarHBondContact OD1-CA 3.4Å; N531-K533 WeakPolarHBondContact OD1-CB 3.43Å; N531-K533 PolarHBondContact OD1-N 3.1Å; K533-E535 HydrophobicContact CB-CG 4.13Å; K533-E535 PolarHBondContact O-N 2.92Å
534	E	83.8	Confident	89.7	Confident	103 Å²	103	43.8 Å²	43.8	48%	0.481	21%	0.211	S	C	.	.			trans	61.6	22.3	-174.1	-51.5	-62.5	160.2	0	0	114.1	N531 E532 R747	N531-E534 PolarHBondContact O-N 2.76Å; N531-E534 PolarHBondContact OD1-N 3.06Å; E532-E534 VanDerWaalsContact C-N 3.32Å; E534-R747 IonicContact OE1-CZ 2.74Å; E534-R747 IonicContact OE1-NH1 2.72Å; E534-R747 PolarHBondContact OE1-NH1 3.29Å; E534-R747 IonicContact OE1-NH2 3.48Å; E534-R747 PolarHBondContact OE1-NH2 2.93Å; E534-R747 IonicContact OE2-CZ 3.08Å; E534-R747 IonicContact OE2-NH1 3.52Å; E534-R747 IonicContact OE2-NH2 2.63Å
535	E	86.8	Confident	89.6	Confident	108 Å²	108	43.6 Å²	43.6	51%	0.505	21%	0.21	S	C	.	.			trans	-85.1	134.9	174.1	-58	168	156.6	0	0	109.6	L530 N531 K533 V537	L530-E535 WeakPolarHBondContact CA-O 3.49Å; N531-E535 PolarHBondContact N-O 3.3Å; N531-E535 VanDerWaalsContact N-O 3.09Å; N531-E535 PolarHBondContact ND2-OE2 2.9Å; N531-E535 WeakPolarHBondContact OD1-CB 3.42Å; N531-E535 PolarHBondContact OD1-N 3.4Å; K533-E535 HydrophobicContact CB-CG 4.13Å; K533-E535 PolarHBondContact O-N 2.92Å; E535-V537 PolarHBondContact O-N 3.42Å
536	S	90.8	Very high	89.6	Confident	64 Å²	64	44.8 Å²	44.8	45%	0.448	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.3	177	-174.4	0	0	0	0	110.7	V529 P749	V529-S536 WeakPolarHBondContact O-CA 3.39Å; S536-P749 WeakPolarHBondContact OG-CG 3.29Å
537	V	91.3	Very high	89.6	Confident	18 Å²	18	41.7 Å²	41.7	11%	0.109	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	134	178.9	-176.5	0	0	0	0	109.2	V505 S507 K528 V529 E535	V505-V537 HydrophobicContact CG1-CB 4.3Å; V505-V537 HydrophobicContact CG1-CG1 4.02Å; S507-V537 VanDerWaalsContact CB-CG1 3.49Å; K528-V537 CarbonylContact C-O 3.49Å; K528-V537 VanDerWaalsContact CA-O 3.32Å; K528-V537 WeakPolarHBondContact CA-O 3.33Å; V529-V537 HydrophobicContact CG2-CB 4.38Å; V529-V537 PolarHBondContact N-O 3.39Å; V529-V537 PolarHBondContact O-N 2.88Å; E535-V537 PolarHBondContact O-N 3.42Å
538	E	93.3	Very high	89.6	Confident	79 Å²	79	41.7 Å²	41.7	37%	0.369	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.2	-179.5	-175.7	164.9	-135.3	0	0	111.6	S507 L512 Q526	S507-E538 WeakPolarHBondContact CB-O 3.36Å; S507-E538 PolarHBondContact OG-O 2.97Å; L512-E538 HydrophobicContact CD1-CG 4.5Å; L512-E538 HydrophobicContact CD2-CG 4.28Å; Q526-E538 HydrophobicContact CG-CG 4.18Å; Q526-E538 PolarHBondContact NE2-OE1 3.42Å
539	L	92.3	Very high	89.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.2	-178.3	-62	176.8	0	0	0	111.4	Y496 V505 Q526 H527 V529 V543	Y496-L539 HydrophobicContact CD2-CD2 4.26Å; Y496-L539 HydrophobicContact CE1-CD2 4.35Å; Y496-L539 HydrophobicContact CE2-CD2 3.69Å; V505-L539 HydrophobicContact CG1-CD1 3.97Å; V505-L539 HydrophobicContact CG1-CD2 4.3Å; V505-L539 HydrophobicContact CG1-CG 4.47Å; Q526-L539 CarbonylContact C-O 3.59Å; Q526-L539 VanDerWaalsContact CA-O 3.31Å; Q526-L539 WeakPolarHBondContact CA-O 3.41Å; H527-L539 PolarHBondContact N-O 3.46Å; H527-L539 PolarHBondContact O-N 3.46Å; V529-L539 HydrophobicContact CG1-CD1 4.43Å; V529-L539 HydrophobicContact CG2-CD1 3.72Å; V529-L539 HydrophobicContact CG2-CG 4.32Å; L539-V543 HydrophobicContact CD1-CB 4.27Å; L539-V543 HydrophobicContact CD1-CG2 3.49Å; L539-V543 VanDerWaalsContact CD1-CG2 3.49Å
540	C	90.3	Very high	89.4	Confident	1 Å²	1	41 Å²	41	1%	0.007	20%	0.201	C	C	.	.	S	Bend	trans	-116.7	10.3	175.1	-65	0	0	0	0	112.9	Y496 L515 V524	Y496-C540 PolarHBondContact OH-N 3.46Å; L515-C540 HydrophobicContact CB-CB 3.58Å; V524-C540 WeakPolarHBondContact CG1-O 3.49Å
541	S	91.1	Very high	89.4	Confident	1 Å²	1	43 Å²	43	1%	0.007	21%	0.211	C	C	.	.	S	Bend	trans	-151.5	179.8	176.1	-169.8	0	0	0	0	108.1	Y453 Y496 H527 C545	Y453-S541 PolarHBondContact OH-OG 3.25Å; Y496-S541 PolarHBondContact OH-N 3.43Å; H527-S541 PolarHBondContact CE1-O 2.85Å; S541-C545 PolarHBondContact OG-SG 3.29Å
542	S	90.8	Very high	89.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.221	C	C	.	.			trans	-60.3	145.7	177.6	-179.1	0	0	0	0	112.4	E544 C545 R562 D740	S542-E544 PolarHBondContact O-N 3.14Å; S542-E544 PolarHBondContact OG-N 3.49Å; S542-C545 VanDerWaalsContact O-CB 3.31Å; S542-C545 WeakPolarHBondContact O-CB 3.48Å; S542-C545 PolarHBondContact O-N 3.35Å; S542-R562 WeakPolarHBondContact OG-CB 3.44Å; S542-D740 WeakPolarHBondContact CA-OD1 3.38Å; S542-D740 VanDerWaalsContact CA-OD2 3.25Å; S542-D740 WeakPolarHBondContact CA-OD2 3.48Å; S542-D740 WeakPolarHBondContact CB-OD1 3.48Å; S542-D740 PolarHBondContact OG-OD1 3.5Å
543	V	89.9	Confident	89.8	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.012	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-34	170.6	169.4	0	0	0	0	112.6	S498 V505 V529 L539 C545 D740 V746	S498-V543 WeakPolarHBondContact CB-O 3.29Å; S498-V543 PolarHBondContact N-O 3.07Å; V505-V543 HydrophobicContact CG2-CG1 3.96Å; V529-V543 HydrophobicContact CB-CG2 4.29Å; V529-V543 HydrophobicContact CG1-CG2 3.78Å; V529-V543 HydrophobicContact CG2-CG2 4.01Å; L539-V543 HydrophobicContact CD1-CB 4.27Å; L539-V543 HydrophobicContact CD1-CG2 3.49Å; L539-V543 VanDerWaalsContact CD1-CG2 3.49Å; V543-C545 VanDerWaalsContact C-N 3.29Å; V543-C545 PolarHBondContact O-N 3.31Å; V543-D740 WeakPolarHBondContact CG2-OD2 3.45Å; V543-D740 PolarHBondContact N-OD1 3.08Å; V543-D740 PolarHBondContact N-OD2 3.29Å; V543-V746 HydrophobicContact CB-CG2 4.24Å; V543-V746 HydrophobicContact CG1-CG2 4.44Å; V543-V746 HydrophobicContact CG2-CG1 4.34Å; V543-V746 HydrophobicContact CG2-CG2 4.03Å
544	E	86.9	Confident	90.3	Very high	19 Å²	19	33.9 Å²	33.9	9%	0.089	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-16.9	-177.9	-66.5	178.1	-175.3	0	0	113.2	S542 L561 R562	S542-E544 PolarHBondContact O-N 3.14Å; S542-E544 PolarHBondContact OG-N 3.49Å; E544-L561 WeakPolarHBondContact OE2-CD1 3.37Å; E544-L561 WeakPolarHBondContact OE2-CG 3.47Å; E544-R562 IonicContact OE1-CZ 3.62Å; E544-R562 IonicContact OE1-NE 3.91Å; E544-R562 PolarHBondContact OE1-NE 3.45Å; E544-R562 IonicContact OE1-NH2 2.76Å; E544-R562 WeakPolarHBondContact OE2-CD 3.46Å; E544-R562 IonicContact OE2-NE 3.97Å; E544-R562 PolarHBondContact OE2-NE 3.48Å
545	C	91	Very high	90.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.			trans	-66.9	148	176	-63.8	0	0	0	0	110.6	G497 S541 S542 V543 I557 L558	G497-C545 VanDerWaalsContact CA-O 3.3Å; G497-C545 WeakPolarHBondContact CA-O 3.23Å; S541-C545 PolarHBondContact OG-SG 3.29Å; S542-C545 VanDerWaalsContact O-CB 3.31Å; S542-C545 WeakPolarHBondContact O-CB 3.48Å; S542-C545 PolarHBondContact O-N 3.35Å; V543-C545 VanDerWaalsContact C-N 3.29Å; V543-C545 PolarHBondContact O-N 3.31Å; C545-I557 HydrophobicContact CB-CD1 4.42Å; C545-L558 WeakPolarHBondContact CA-O 3.32Å
546	K	91.8	Very high	91.1	Very high	52 Å²	52	25.4 Å²	25.4	23%	0.226	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.9	177.8	-65.4	175.1	-173.3	149.2	0	110.8	V494 Y496 S498 I557 L558 D559	V494-K546 HydrophobicContact CG1-CB 3.93Å; V494-K546 HydrophobicContact CG1-CG 3.96Å; V494-K546 HydrophobicContact CG2-CB 4.23Å; V494-K546 HydrophobicContact CG2-CD 3.97Å; V494-K546 HydrophobicContact CG2-CG 4.16Å; Y496-K546 CarbonylContact O-C 3.54Å; Y496-K546 WeakPolarHBondContact O-CA 3.49Å; S498-K546 VanDerWaalsContact O-CE 3.3Å; S498-K546 WeakPolarHBondContact O-CE 3.39Å; K546-I557 WeakPolarHBondContact O-CA 3.44Å; K546-L558 HydrophobicContact CB-CD1 3.82Å; K546-L558 HydrophobicContact CB-CG 3.88Å; K546-L558 HydrophobicContact CD-CD1 4.2Å; K546-L558 PolarHBondContact N-O 3.49Å; K546-L558 WeakPolarHBondContact O-CG 3.3Å; K546-L558 PolarHBondContact O-N 3.05Å; K546-D559 VanDerWaalsContact CD-OD2 3.25Å; K546-D559 WeakPolarHBondContact CD-OD2 3.25Å; K546-D559 WeakPolarHBondContact CE-OD2 3.18Å; K546-D559 IonicContact NZ-OD2 3.86Å; K546-D559 PolarHBondContact NZ-OD2 3.26Å
547	G	93.2	Very high	91.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.7	168.1	0	0	0	0	0	111.4	I495 Y496 Y511 Y556	I495-G547 PolarHBondContact N-O 3.44Å; Y496-G547 PolarHBondContact O-N 3.23Å; Y511-G547 VanDerWaalsContact CZ-CA 3.45Å; Y511-G547 WeakPolarHBondContact OH-CA 3.44Å; G547-Y556 WeakPolarHBondContact CA-O 3.36Å
548	I	91.9	Very high	91.3	Very high	14 Å²	14	22.7 Å²	22.7	7%	0.072	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.9	177.2	-62.9	173.3	0	0	0	109.3	I482 I485 V494 Y511 Y556 L558	I482-I548 HydrophobicContact CD1-CB 4.4Å; I482-I548 HydrophobicContact CD1-CD1 4.42Å; I482-I548 HydrophobicContact CD1-CG2 4.37Å; I485-I548 HydrophobicContact CD1-CD1 4.49Å; V494-I548 HydrophobicContact CG2-CD1 4.49Å; V494-I548 HydrophobicContact CG2-CG1 4.31Å; Y511-I548 PolarHBondContact OH-N 2.93Å; Y511-I548 PolarHBondContact OH-O 3.01Å; I548-Y556 PolarHBondContact N-O 2.84Å; I548-Y556 VanDerWaalsContact N-O 3.07Å; I548-Y556 WeakPolarHBondContact O-CB 3.3Å; I548-Y556 PolarHBondContact O-N 3.48Å; I548-L558 HydrophobicContact CB-CD2 4.23Å; I548-L558 HydrophobicContact CD1-CD1 4.05Å; I548-L558 HydrophobicContact CD1-CD2 3.82Å; I548-L558 HydrophobicContact CG1-CD2 4.07Å
549	I	91.3	Very high	91.2	Very high	59 Å²	59	21.3 Å²	21.3	30%	0.303	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.3	170.9	-60.2	175.9	0	0	0	107.9	Q492 I495 R554	Q492-I549 VanDerWaalsContact CD-O 3.3Å; Q492-I549 PolarHBondContact NE2-O 2.96Å; Q492-I549 PolarHBondContact OE1-O 3.37Å; I495-I549 HydrophobicContact CD1-CD1 3.31Å; I495-I549 HydrophobicContact CD1-CG1 3.55Å; I549-R554 WeakPolarHBondContact CA-O 3.41Å
550	G	89.3	Confident	91.2	Very high	4 Å²	4	21.3 Å²	21.3	4%	0.041	12%	0.119	C	C	.	.			trans	-73.7	167.8	176.8	0	0	0	0	0	112.8	D552 G553 R554	G550-D552 WeakPolarHBondContact CA-OD1 3.39Å; G550-D552 PolarHBondContact O-N 3.38Å; G550-G553 PolarHBondContact O-N 3.42Å; G550-R554 PolarHBondContact N-O 2.97Å
551	N	88.4	Confident	91.1	Very high	68 Å²	68	21.8 Å²	21.8	36%	0.364	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.2	175.3	-80.1	-2.8	0	0	0	114.6	P483 G484 E487 Q490 Q492	P483-N551 HydrophobicContact CB-CB 4.31Å; P483-N551 PolarHBondContact O-N 3.09Å; G484-N551 WeakPolarHBondContact CA-ND2 3.38Å; E487-N551 PolarHBondContact OE2-ND2 2.86Å; Q490-N551 PolarHBondContact NE2-OD1 2.83Å; Q490-N551 PolarHBondContact OE1-ND2 3.49Å; Q490-N551 PolarHBondContact OE1-OD1 3.42Å; Q492-N551 PolarHBondContact NE2-OD1 3.17Å
552	D	88.9	Confident	91	Very high	55 Å²	55	21.8 Å²	21.8	29%	0.294	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.4	170.6	60.9	-5.6	0	0	0	113.1	G550 R554 Y556	G550-D552 WeakPolarHBondContact CA-OD1 3.39Å; G550-D552 PolarHBondContact O-N 3.38Å; D552-R554 VanDerWaalsContact C-N 3.3Å; D552-R554 PolarHBondContact OD1-N 3.24Å; D552-R554 VanDerWaalsContact OD1-N 3.12Å; D552-R554 VanDerWaalsContact OD2-CD 3.26Å; D552-R554 WeakPolarHBondContact OD2-CD 3.28Å; D552-R554 WeakPolarHBondContact OD2-CG 3.43Å; D552-R554 IonicContact OD2-CZ 3.62Å; D552-R554 IonicContact OD2-NE 3.84Å; D552-R554 IonicContact OD2-NH1 2.82Å; D552-R554 PolarHBondContact OD2-NH1 3.14Å; D552-Y556 PolarHBondContact OD2-OH 2.83Å
553	G	89.8	Confident	91.1	Very high	44 Å²	44	22 Å²	22	45%	0.454	12%	0.122	S	C	.	.	S	Bend	trans	80.6	3.9	-178.4	0	0	0	0	0	114.5	G550	G550-G553 PolarHBondContact O-N 3.42Å
554	R	93.1	Very high	91.2	Very high	20 Å²	20	22.8 Å²	22.8	8%	0.075	13%	0.126	C	C	.	.			trans	-78.7	145.6	178.9	-65.5	-174.5	-176	121.6	-7.8	111.1	E353 E360 Y462 I549 G550 D552 Y556	E353-R554 IonicContact OE1-CZ 3.04Å; E353-R554 IonicContact OE1-NH1 2.69Å; E353-R554 IonicContact OE1-NH2 3.95Å; E353-R554 PolarHBondContact OE1-NH2 2.96Å; E353-R554 IonicContact OE2-CZ 3.69Å; E353-R554 IonicContact OE2-NH1 3.68Å; E353-R554 PolarHBondContact OE2-NH1 3.06Å; E353-R554 IonicContact OE2-NH2 3.85Å; E353-R554 PolarHBondContact OE2-NH2 2.97Å; E360-R554 IonicContact OE1-CZ 2.97Å; E360-R554 IonicContact OE1-NE 2.91Å; E360-R554 PolarHBondContact OE1-NE 3.12Å; E360-R554 IonicContact OE1-NH2 2.86Å; E360-R554 PolarHBondContact OE1-NH2 3.31Å; E360-R554 IonicContact OE2-CZ 3.42Å; E360-R554 IonicContact OE2-NE 2.78Å; E360-R554 IonicContact OE2-NH2 3.23Å; E360-R554 PolarHBondContact OE2-NH2 3.33Å; Y462-R554 HydrophobicContact CD2-CB 3.7Å; Y462-R554 HydrophobicContact CD2-CG 4.17Å; Y462-R554 HydrophobicContact CE2-CB 3.81Å; Y462-R554 HydrophobicContact CE2-CG 3.84Å; Y462-R554 HydrophobicContact CG-CB 4.31Å; I549-R554 WeakPolarHBondContact CA-O 3.41Å; G550-R554 PolarHBondContact N-O 2.97Å; D552-R554 VanDerWaalsContact C-N 3.3Å; D552-R554 PolarHBondContact OD1-N 3.24Å; D552-R554 VanDerWaalsContact OD1-N 3.12Å; D552-R554 VanDerWaalsContact OD2-CD 3.26Å; D552-R554 WeakPolarHBondContact OD2-CD 3.28Å; D552-R554 WeakPolarHBondContact OD2-CG 3.43Å; D552-R554 IonicContact OD2-CZ 3.62Å; D552-R554 IonicContact OD2-NE 3.84Å; D552-R554 IonicContact OD2-NH1 2.82Å; D552-R554 PolarHBondContact OD2-NH1 3.14Å; R554-Y556 HydrophobicContact CB-CD2 4.41Å; R554-Y556 HydrophobicContact CB-CE2 3.69Å; R554-Y556 WeakPolarHBondContact O-CD2 3.34Å
555	H	94.4	Very high	91.5	Very high	34 Å²	34	22.1 Å²	22.1	16%	0.157	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	104.4	-179.6	-63.1	66.1	0	0	0	110	Y462 Y511 L514	Y462-H555 PolarHBondContact N-O 2.97Å; Y511-H555 HydrophobicContact CE1-CB 4.31Å; Y511-H555 HydrophobicContact CE2-CB 4.43Å; Y511-H555 AromaticContact CE2-CD2 3.86Å; L514-H555 HydrophobicContact CD1-CB 4.12Å
556	Y	94.2	Very high	91.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	137.9	-179.3	-66.5	-82.6	0	0	0	111.4	N352 Q356 Y462 L464 I482 Y511 G547 I548 D552 R554	N352-Y556 PolarHBondContact ND2-OH 3.13Å; Q356-Y556 HydrophobicContact CG-CE1 4.16Å; Y462-Y556 CarbonylContact O-C 3.41Å; Y462-Y556 WeakPolarHBondContact O-CA 3.09Å; L464-Y556 HydrophobicContact CD2-CD1 3.91Å; L464-Y556 HydrophobicContact CD2-CE1 4.27Å; I482-Y556 HydrophobicContact CD1-CD2 4.36Å; I482-Y556 HydrophobicContact CD1-CG 4.08Å; I482-Y556 HydrophobicContact CG1-CD1 4.43Å; I482-Y556 HydrophobicContact CG1-CD2 4.31Å; I482-Y556 HydrophobicContact CG1-CG 4.19Å; I482-Y556 HydrophobicContact CG2-CD2 3.9Å; I482-Y556 HydrophobicContact CG2-CE2 3.97Å; Y511-Y556 PolarHBondContact OH-N 2.93Å; Y511-Y556 PolarHBondContact OH-O 3.16Å; G547-Y556 WeakPolarHBondContact CA-O 3.36Å; I548-Y556 PolarHBondContact N-O 2.84Å; I548-Y556 VanDerWaalsContact N-O 3.07Å; I548-Y556 WeakPolarHBondContact O-CB 3.3Å; I548-Y556 PolarHBondContact O-N 3.48Å; D552-Y556 PolarHBondContact OD2-OH 2.83Å; R554-Y556 HydrophobicContact CB-CD2 4.41Å; R554-Y556 HydrophobicContact CB-CE2 3.69Å; R554-Y556 WeakPolarHBondContact O-CD2 3.34Å
557	I	94.1	Very high	91.7	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.6	165.3	-169.2	170.6	0	0	0	110.1	Y453 L461 Y462 T463 L515 C545 K546 L560	Y453-I557 HydrophobicContact CE1-CD1 4.25Å; L461-I557 HydrophobicContact CD1-CB 4.12Å; L461-I557 HydrophobicContact CD1-CG2 3.91Å; L461-I557 HydrophobicContact CD2-CG2 4.45Å; L461-I557 HydrophobicContact CG-CG2 4.15Å; Y462-I557 PolarHBondContact O-N 3.18Å; T463-I557 HydrophobicContact CG2-CG2 3.95Å; L515-I557 HydrophobicContact CD1-CD1 4.21Å; L515-I557 HydrophobicContact CD2-CD1 3.64Å; C545-I557 HydrophobicContact CB-CD1 4.42Å; K546-I557 WeakPolarHBondContact O-CA 3.44Å; I557-L560 HydrophobicContact CD1-CD2 3.78Å; I557-L560 HydrophobicContact CG1-CD2 3.74Å
558	L	92.3	Very high	91.7	Very high	24 Å²	24	20 Å²	20	13%	0.126	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	175.4	-175.4	50.9	132.2	0	0	0	110.8	L464 I482 C545 K546 I548	L464-L558 HydrophobicContact CD1-CB 4.47Å; I482-L558 HydrophobicContact CD1-CD2 4Å; C545-L558 WeakPolarHBondContact CA-O 3.32Å; K546-L558 HydrophobicContact CB-CD1 3.82Å; K546-L558 HydrophobicContact CB-CG 3.88Å; K546-L558 HydrophobicContact CD-CD1 4.2Å; K546-L558 PolarHBondContact N-O 3.49Å; K546-L558 WeakPolarHBondContact O-CG 3.3Å; K546-L558 PolarHBondContact O-N 3.05Å; I548-L558 HydrophobicContact CB-CD2 4.23Å; I548-L558 HydrophobicContact CD1-CD1 4.05Å; I548-L558 HydrophobicContact CD1-CD2 3.82Å; I548-L558 HydrophobicContact CG1-CD2 4.07Å
559	D	89.9	Confident	91.8	Very high	49 Å²	49	19.3 Å²	19.3	26%	0.262	11%	0.111	S	C	.	.			trans	56.2	52.8	-175.6	-65.8	-15.3	0	0	0	111.9	K546 L561	K546-D559 VanDerWaalsContact CD-OD2 3.25Å; K546-D559 WeakPolarHBondContact CD-OD2 3.25Å; K546-D559 WeakPolarHBondContact CE-OD2 3.18Å; K546-D559 IonicContact NZ-OD2 3.86Å; K546-D559 PolarHBondContact NZ-OD2 3.26Å; D559-L561 PolarHBondContact O-N 3.31Å; D559-L561 VanDerWaalsContact O-N 3.1Å
560	L	92.8	Very high	91.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.097	C	C	.	.			trans	-83.3	23.8	-173.3	-65.9	176.4	0	0	0	113.3	D446 V450 Y453 T463 I557 R562 T563	D446-L560 PolarHBondContact OD1-N 3.23Å; V450-L560 HydrophobicContact CG2-CD1 4Å; Y453-L560 HydrophobicContact CD2-CD1 3.7Å; Y453-L560 HydrophobicContact CD2-CD2 3.87Å; Y453-L560 HydrophobicContact CD2-CG 4.38Å; Y453-L560 HydrophobicContact CE2-CD1 4.26Å; Y453-L560 HydrophobicContact CE2-CD2 3.54Å; Y453-L560 HydrophobicContact CE2-CG 4.46Å; Y453-L560 HydrophobicContact CG-CD1 4.29Å; T463-L560 HydrophobicContact CG2-CD1 4.36Å; I557-L560 HydrophobicContact CD1-CD2 3.78Å; I557-L560 HydrophobicContact CG1-CD2 3.74Å; L560-R562 PolarHBondContact O-N 3.08Å; L560-R562 VanDerWaalsContact O-N 3.17Å; L560-T563 PolarHBondContact O-N 3.48Å; L560-T563 PolarHBondContact O-OG1 3.5Å
561	L	89.1	Confident	92	Very high	12 Å²	12	17.1 Å²	17.1	6%	0.063	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-21.1	-169.4	73.5	81.8	0	0	0	114.2	N445 E544 D559 L595	N445-L561 HydrophobicContact CB-CB 4.3Å; N445-L561 WeakPolarHBondContact CB-O 3.21Å; E544-L561 WeakPolarHBondContact OE2-CD1 3.37Å; E544-L561 WeakPolarHBondContact OE2-CG 3.47Å; D559-L561 PolarHBondContact O-N 3.31Å; D559-L561 VanDerWaalsContact O-N 3.1Å; L561-L595 HydrophobicContact CD1-CD2 3.72Å
562	R	89.2	Confident	91.9	Very high	1 Å²	1	17 Å²	17	0%	0.004	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	32.4	177.2	-93.5	174.4	-151.5	-76.7	5	112.8	S542 E544 L560 F564 P739	S542-R562 WeakPolarHBondContact OG-CB 3.44Å; E544-R562 IonicContact OE1-CZ 3.62Å; E544-R562 IonicContact OE1-NE 3.91Å; E544-R562 PolarHBondContact OE1-NE 3.45Å; E544-R562 IonicContact OE1-NH2 2.76Å; E544-R562 WeakPolarHBondContact OE2-CD 3.46Å; E544-R562 IonicContact OE2-NE 3.97Å; E544-R562 PolarHBondContact OE2-NE 3.48Å; L560-R562 PolarHBondContact O-N 3.08Å; L560-R562 VanDerWaalsContact O-N 3.17Å; R562-F564 PolarHBondContact O-N 3.38Å; R562-P739 VanDerWaalsContact O-CB 3.32Å; R562-P739 WeakPolarHBondContact O-CB 3.43Å
563	T	91.4	Very high	91.8	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.018	10%	0.101	C	C	.	.	S	Bend	trans	-55.9	-38.3	174.9	-60.9	0	0	0	0	112.1	G449 Y453 L522 L560	G449-T563 WeakPolarHBondContact CA-OG1 3.25Å; Y453-T563 HydrophobicContact CD2-CG2 4.3Å; Y453-T563 HydrophobicContact CE2-CG2 3.8Å; L522-T563 HydrophobicContact CD1-CG2 4.49Å; L560-T563 PolarHBondContact O-N 3.48Å; L560-T563 PolarHBondContact O-OG1 3.5Å
564	F	92.4	Very high	91.5	Very high	20 Å²	20	22.5 Å²	22.5	9%	0.088	12%	0.122	C	C	.	.	S	Bend	trans	-106.8	147.2	178	-57.9	-63.3	0	0	0	111.1	A452 R562 C597 L598 Q600 I603	A452-F564 HydrophobicContact CB-CE2 4.2Å; A452-F564 HydrophobicContact CB-CZ 3.67Å; R562-F564 PolarHBondContact O-N 3.38Å; F564-C597 HydrophobicContact CB-CB 4.47Å; F564-C597 PolarHBondContact O-SG 3.44Å; F564-L598 VanDerWaalsContact CB-O 3.28Å; F564-L598 WeakPolarHBondContact CB-O 3.29Å; F564-Q600 HydrophobicContact CE1-CB 3.82Å; F564-Q600 HydrophobicContact CE1-CG 3.91Å; F564-Q600 HydrophobicContact CE2-CB 4.03Å; F564-Q600 HydrophobicContact CZ-CB 3.54Å; F564-Q600 HydrophobicContact CZ-CG 3.83Å; F564-I603 HydrophobicContact CB-CD1 3.97Å; F564-I603 HydrophobicContact CD1-CD1 3.6Å; F564-I603 HydrophobicContact CE1-CD1 4.5Å; F564-I603 HydrophobicContact CG-CD1 4.09Å
565	P	92.6	Very high	91	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.026	16%	0.159	C	C	.	.			trans	-61.8	154.8	-174.5	26.5	-38.1	0	0	0	113.3	C597 L598 I603 F737 L763	P565-C597 WeakPolarHBondContact O-CA 3.49Å; P565-C597 WeakPolarHBondContact O-CB 3.5Å; P565-L598 HydrophobicContact CG-CD1 4.34Å; P565-L598 PolarHBondContact O-N 2.97Å; P565-I603 HydrophobicContact CG-CD1 4.03Å; P565-F737 HydrophobicContact CB-CB 4.22Å; P565-F737 HydrophobicContact CB-CD1 4.43Å; P565-F737 HydrophobicContact CG-CB 3.91Å; P565-F737 HydrophobicContact CG-CD1 4.03Å; P565-F737 HydrophobicContact CG-CG 3.93Å; P565-L763 HydrophobicContact CB-CD1 3.74Å; P565-L763 HydrophobicContact CG-CD1 4.13Å
566	P	92.9	Very high	90.6	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-65.5	148	-179.1	23.8	-29.6	0	0	0	112.6	L568 L571 A596 I741 L763	P566-L568 PolarHBondContact O-N 3Å; P566-L571 HydrophobicContact CB-CD2 3.69Å; P566-L571 HydrophobicContact CG-CD2 4.27Å; P566-A596 CarbonylContact C-O 3.57Å; P566-A596 WeakPolarHBondContact CA-O 3.46Å; P566-I741 WeakPolarHBondContact CG-O 3.48Å; P566-L763 HydrophobicContact CG-CD2 4Å; P566-L763 WeakPolarHBondContact O-CD1 3.39Å
567	D	93.9	Very high	90.3	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.011	20%	0.195	C	C	.	.			trans	-87.4	99.7	175.7	-176.1	-3.7	0	0	0	110.4	N569 F570 L571 A596 L598 R807 Y808	D567-N569 PolarHBondContact O-N 3.33Å; D567-N569 WeakPolarHBondContact OD1-CB 3.11Å; D567-N569 PolarHBondContact OD1-N 3.04Å; D567-N569 VanDerWaalsContact OD1-N 3.14Å; D567-N569 PolarHBondContact OD1-ND2 3.27Å; D567-F570 CarbonylContact O-C 3.55Å; D567-F570 PolarHBondContact O-N 2.82Å; D567-L571 WeakPolarHBondContact O-CB 3.49Å; D567-L571 PolarHBondContact O-N 2.9Å; D567-L571 VanDerWaalsContact O-N 3.1Å; D567-A596 HydrophobicContact CB-CB 4.31Å; D567-A596 PolarHBondContact N-O 2.76Å; D567-L598 HydrophobicContact CB-CD2 3.72Å; D567-L598 HydrophobicContact CB-CG 4.32Å; D567-R807 IonicContact OD2-NE 3.82Å; D567-Y808 PolarHBondContact OD1-OH 2.91Å; D567-Y808 VanDerWaalsContact OD1-OH 3.13Å; D567-Y808 WeakPolarHBondContact OD2-CE2 3.44Å; D567-Y808 PolarHBondContact OD2-OH 3.47Å
568	L	93.8	Very high	90.1	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.031	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.2	-177.3	-59.1	-179.3	0	0	0	114	P566 F570 L571 L578 F742 L763 K764 A767	P566-L568 PolarHBondContact O-N 3Å; L568-F570 PolarHBondContact O-N 3.06Å; L568-L571 PolarHBondContact O-N 2.89Å; L568-L578 HydrophobicContact CB-CD2 3.82Å; L568-L578 HydrophobicContact CD1-CD2 4.35Å; L568-F742 HydrophobicContact CD1-CD2 4.38Å; L568-F742 HydrophobicContact CD1-CE2 3.85Å; L568-F742 HydrophobicContact CD2-CD2 3.46Å; L568-F742 VanDerWaalsContact CD2-CD2 3.46Å; L568-F742 HydrophobicContact CD2-CE2 3.75Å; L568-F742 HydrophobicContact CD2-CG 4.19Å; L568-F742 HydrophobicContact CG-CD2 4.48Å; L568-F742 HydrophobicContact CG-CE2 4.43Å; L568-L763 HydrophobicContact CD1-CB 4.09Å; L568-L763 HydrophobicContact CD1-CD2 3.9Å; L568-L763 HydrophobicContact CD1-CG 3.71Å; L568-L763 HydrophobicContact CD2-CD2 3.95Å; L568-L763 HydrophobicContact CG-CD2 3.81Å; L568-L763 HydrophobicContact CG-CG 3.85Å; L568-K764 HydrophobicContact CD1-CG 3.76Å; L568-A767 HydrophobicContact CB-CB 4.25Å
569	N	94.7	Very high	89.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-22.6	173.5	-67.6	-54.7	0	0	0	111.5	D567 F587 P588 R589 A767 Y808	D567-N569 PolarHBondContact O-N 3.33Å; D567-N569 WeakPolarHBondContact OD1-CB 3.11Å; D567-N569 PolarHBondContact OD1-N 3.04Å; D567-N569 VanDerWaalsContact OD1-N 3.14Å; D567-N569 PolarHBondContact OD1-ND2 3.27Å; N569-F587 HydrophobicContact CB-CB 4.41Å; N569-F587 HydrophobicContact CB-CD1 3.58Å; N569-F587 HydrophobicContact CB-CE1 3.9Å; N569-F587 HydrophobicContact CB-CG 4.02Å; N569-F587 VanDerWaalsContact O-CD1 3.3Å; N569-F587 WeakPolarHBondContact O-CD1 3.44Å; N569-P588 CarbonylContact O-C 3.56Å; N569-P588 WeakPolarHBondContact O-CA 3.15Å; N569-R589 PolarHBondContact O-N 3.25Å; N569-A767 PolarHBondContact ND2-O 3.13Å; N569-Y808 HydrophobicContact CB-CE1 4.43Å; N569-Y808 WeakPolarHBondContact CB-OH 3.28Å; N569-Y808 PolarHBondContact ND2-OH 2.99Å
570	F	92.9	Very high	89.9	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.009	21%	0.213	C	C	.	.	S	Bend	trans	-119.2	7.5	179.2	-72.2	-84.6	0	0	0	114	D567 L568 F587 R589 H591 A596 R807 Y808 H927	D567-F570 CarbonylContact O-C 3.55Å; D567-F570 PolarHBondContact O-N 2.82Å; L568-F570 PolarHBondContact O-N 3.06Å; F570-F587 HydrophobicContact CE2-CE1 4.07Å; F570-F587 HydrophobicContact CZ-CE1 4.11Å; F570-R589 CarbonylContact C-O 3.5Å; F570-R589 WeakPolarHBondContact CA-O 3.42Å; F570-R589 HydrophobicContact CD1-CB 4.26Å; F570-R589 HydrophobicContact CE1-CB 4.32Å; F570-H591 HydrophobicContact CB-CB 4.15Å; F570-H591 HydrophobicContact CD1-CB 4.1Å; F570-H591 AromaticContact CD1-CD2 3.99Å; F570-A596 HydrophobicContact CB-CB 3.99Å; F570-R807 HydrophobicContact CD2-CG 4.19Å; F570-R807 HydrophobicContact CE2-CG 3.73Å; F570-R807 HydrophobicContact CZ-CB 4.35Å; F570-R807 HydrophobicContact CZ-CG 3.92Å; F570-Y808 HydrophobicContact CD2-CE2 4.06Å; F570-Y808 AromaticContact CD2-CZ 3.96Å; F570-Y808 HydrophobicContact CE2-CD1 4.03Å; F570-Y808 AromaticContact CE2-CD2 3.88Å; F570-Y808 HydrophobicContact CE2-CD2 3.88Å; F570-Y808 AromaticContact CE2-CE1 3.67Å; F570-Y808 HydrophobicContact CE2-CE1 3.67Å; F570-Y808 AromaticContact CE2-CE2 3.51Å; F570-Y808 HydrophobicContact CE2-CE2 3.51Å; F570-Y808 HydrophobicContact CE2-CG 4.14Å; F570-Y808 AromaticContact CE2-CZ 3.42Å; F570-Y808 VanDerWaalsContact CE2-CZ 3.42Å; F570-Y808 HydrophobicContact CZ-CD1 4.47Å; F570-Y808 HydrophobicContact CZ-CE1 4.45Å; F570-H927 AromaticContact CE1-CE1 3.58Å; F570-H927 AromaticContact CE1-ND1 3.79Å
571	L	90.8	Very high	89.5	Confident	14 Å²	14	38.4 Å²	38.4	7%	0.073	23%	0.231	C	C	.	.			trans	-124.2	87.1	177.2	-175.3	66.9	0	0	0	109	P566 D567 L568 V573 R594 F742	P566-L571 HydrophobicContact CB-CD2 3.69Å; P566-L571 HydrophobicContact CG-CD2 4.27Å; D567-L571 WeakPolarHBondContact O-CB 3.49Å; D567-L571 PolarHBondContact O-N 2.9Å; D567-L571 VanDerWaalsContact O-N 3.1Å; L568-L571 PolarHBondContact O-N 2.89Å; L571-V573 HydrophobicContact CD2-CG2 4.47Å; L571-V573 HydrophobicContact CG-CG2 4.19Å; L571-V573 PolarHBondContact O-N 2.93Å; L571-R594 HydrophobicContact CD1-CB 3.78Å; L571-R594 HydrophobicContact CD1-CG 3.97Å; L571-F742 HydrophobicContact CD2-CB 4.27Å
572	P	87.4	Confident	89.6	Confident	65 Å²	65	37.8 Å²	37.8	42%	0.422	23%	0.228	S	C	.	.			trans	-66.4	127.3	173.6	26.4	-31.4	0	0	0	109.8	P588	P572-P588 HydrophobicContact CB-CB 4.3Å; P572-P588 HydrophobicContact CB-CG 4.25Å
573	V	86.9	Confident	89.7	Confident	48 Å²	48	41.9 Å²	41.9	29%	0.291	25%	0.247	S	C	.	.			trans	-120.8	130.4	179.9	-179.3	0	0	0	0	108.9	L571 G575 E576 F742	L571-V573 HydrophobicContact CD2-CG2 4.47Å; L571-V573 HydrophobicContact CG-CG2 4.19Å; L571-V573 PolarHBondContact O-N 2.93Å; V573-G575 PolarHBondContact O-N 3.47Å; V573-E576 HydrophobicContact CB-CB 4.24Å; V573-E576 HydrophobicContact CB-CG 4.45Å; V573-E576 HydrophobicContact CG1-CB 4.36Å; V573-E576 HydrophobicContact CG1-CG 4.04Å; V573-E576 PolarHBondContact O-N 2.93Å; V573-F742 HydrophobicContact CB-CD1 4.32Å; V573-F742 HydrophobicContact CG1-CD1 3.76Å; V573-F742 HydrophobicContact CG1-CE1 4.07Å; V573-F742 HydrophobicContact CG2-CB 4.15Å; V573-F742 HydrophobicContact CG2-CD1 3.94Å; V573-F742 HydrophobicContact CG2-CG 4.1Å
574	D	82.4	Confident	89.5	Confident	167 Å²	167	50.8 Å²	50.8	89%	0.893	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	130.3	-178.7	-64.4	-33.6	0	0	0	111.3	E576	D574-E576 VanDerWaalsContact C-N 3.32Å; D574-E576 PolarHBondContact O-N 3.22Å
575	G	82.4	Confident	89.2	Confident	84 Å²	84	53 Å²	53	87%	0.866	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	0.8	178.8	0	0	0	0	0	115.6	V573	V573-G575 PolarHBondContact O-N 3.47Å
576	E	87	Confident	89.1	Confident	45 Å²	45	54.9 Å²	54.9	21%	0.21	31%	0.311	C	S	.	.			trans	-115.8	116.7	-179.2	-66.2	-77.3	-179.2	0	0	111.4	V573 D574 F742 K760 K764	V573-E576 HydrophobicContact CB-CB 4.24Å; V573-E576 HydrophobicContact CB-CG 4.45Å; V573-E576 HydrophobicContact CG1-CB 4.36Å; V573-E576 HydrophobicContact CG1-CG 4.04Å; V573-E576 PolarHBondContact O-N 2.93Å; D574-E576 VanDerWaalsContact C-N 3.32Å; D574-E576 PolarHBondContact O-N 3.22Å; E576-F742 HydrophobicContact CG-CE1 3.74Å; E576-F742 HydrophobicContact CG-CZ 4.16Å; E576-K760 WeakPolarHBondContact OE1-CD 3.24Å; E576-K760 IonicContact OE1-NZ 3.3Å; E576-K760 PolarHBondContact OE1-NZ 3.47Å; E576-K764 VanDerWaalsContact OE2-CE 3.26Å; E576-K764 WeakPolarHBondContact OE2-CE 3.1Å; E576-K764 IonicContact OE2-NZ 2.73Å; E576-K764 PolarHBondContact OE2-NZ 2.86Å
577	E	87.2	Confident	89.1	Confident	148 Å²	148	55.1 Å²	55.1	69%	0.692	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-95.4	141.2	175.7	-67.3	-173.6	-177	0	0	111.8	K764	E577-K764 WeakPolarHBondContact O-CE 3.17Å; E577-K764 PolarHBondContact O-NZ 3.04Å
578	L	89.5	Confident	89.1	Confident	15 Å²	15	57.7 Å²	57.7	8%	0.079	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-80.6	169.1	170.4	-67.9	-176.7	0	0	0	111.5	L568 Q583 F587 P588 K764	L568-L578 HydrophobicContact CB-CD2 3.82Å; L568-L578 HydrophobicContact CD1-CD2 4.35Å; L578-Q583 PolarHBondContact O-NE2 3.18Å; L578-F587 HydrophobicContact CD1-CB 3.89Å; L578-P588 HydrophobicContact CD1-CB 3.94Å; L578-P588 HydrophobicContact CD1-CG 4.37Å; L578-K764 HydrophobicContact CD2-CG 4.27Å
579	S	89.7	Confident	89	Confident	34 Å²	34	58.7 Å²	58.7	24%	0.238	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-52.2	150.5	174.8	74.2	0	0	0	0	112.7	E581 S582 Q583	S579-E581 PolarHBondContact O-N 3.19Å; S579-S582 PolarHBondContact O-N 3.3Å; S579-S582 VanDerWaalsContact O-N 3.08Å; S579-S582 WeakPolarHBondContact OG-CB 3.46Å; S579-S582 PolarHBondContact OG-N 3.02Å; S579-S582 VanDerWaalsContact OG-N 3.11Å; S579-S582 PolarHBondContact OG-OG 2.74Å; S579-Q583 WeakPolarHBondContact O-CG 3.42Å; S579-Q583 PolarHBondContact O-N 3.26Å
580	A	88.9	Confident	88.7	Confident	55 Å²	55	66.4 Å²	66.4	46%	0.455	37%	0.368	S	S	.	.	H	α-helix	trans	-59.1	-32.1	178.1	0	0	0	0	0	112	R584	A580-R584 WeakPolarHBondContact O-CB 3.33Å; A580-R584 VanDerWaalsContact O-CG 3.28Å; A580-R584 WeakPolarHBondContact O-CG 3.42Å; A580-R584 PolarHBondContact O-N 3.38Å; A580-R584 PolarHBondContact O-NE 3.26Å
581	E	85.4	Confident	88.6	Confident	81 Å²	81	67.1 Å²	67.1	38%	0.379	37%	0.372	S	S	.	.	H	α-helix	trans	-63.8	-49.1	173.3	-68.6	62.8	-135.7	0	0	111.7	S579 Q583 R584 Q585 T772	S579-E581 PolarHBondContact O-N 3.19Å; E581-Q583 VanDerWaalsContact C-N 3.34Å; E581-Q583 PolarHBondContact O-N 2.82Å; E581-R584 PolarHBondContact O-N 3.48Å; E581-R584 IonicContact OE1-CZ 3.23Å; E581-R584 IonicContact OE1-NH2 3.17Å; E581-R584 PolarHBondContact OE1-NH2 2.82Å; E581-Q585 PolarHBondContact O-N 2.97Å; E581-T772 HydrophobicContact CB-CG2 3.75Å; E581-T772 HydrophobicContact CG-CG2 4.18Å
582	S	89.9	Confident	88.6	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-61.9	-42.4	177.2	-65.9	0	0	0	0	111.4	S579 R584 Q585 G586 F587	S579-S582 PolarHBondContact O-N 3.3Å; S579-S582 VanDerWaalsContact O-N 3.08Å; S579-S582 WeakPolarHBondContact OG-CB 3.46Å; S579-S582 PolarHBondContact OG-N 3.02Å; S579-S582 VanDerWaalsContact OG-N 3.11Å; S579-S582 PolarHBondContact OG-OG 2.74Å; S582-R584 PolarHBondContact O-N 3.27Å; S582-Q585 CarbonylContact O-C 3.55Å; S582-Q585 PolarHBondContact O-N 3.18Å; S582-Q585 VanDerWaalsContact O-N 3.11Å; S582-G586 PolarHBondContact O-N 3.36Å; S582-F587 WeakPolarHBondContact O-CB 3.26Å; S582-F587 PolarHBondContact O-N 3.32Å
583	Q	91.1	Very high	88.8	Confident	87 Å²	87	68.8 Å²	68.8	41%	0.407	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-41.9	176.6	-67.8	-179.3	8.3	0	0	112.2	L578 S579 E581 Q585 G586 F587	L578-Q583 PolarHBondContact O-NE2 3.18Å; S579-Q583 WeakPolarHBondContact O-CG 3.42Å; S579-Q583 PolarHBondContact O-N 3.26Å; E581-Q583 VanDerWaalsContact C-N 3.34Å; E581-Q583 PolarHBondContact O-N 2.82Å; Q583-Q585 PolarHBondContact O-N 3.13Å; Q583-G586 WeakPolarHBondContact O-CA 3.49Å; Q583-G586 PolarHBondContact O-N 3.14Å; Q583-F587 WeakPolarHBondContact CA-O 3.3Å
584	R	87.8	Confident	88.9	Confident	190 Å²	190	73 Å²	73	72%	0.717	38%	0.379	S	S	*	.	H	α-helix	trans	-60.1	-27.3	174.7	-79.2	-175.4	-73.3	-175	-1.6	113.1	A580 E581 S582 G586	A580-R584 WeakPolarHBondContact O-CB 3.33Å; A580-R584 VanDerWaalsContact O-CG 3.28Å; A580-R584 WeakPolarHBondContact O-CG 3.42Å; A580-R584 PolarHBondContact O-N 3.38Å; A580-R584 PolarHBondContact O-NE 3.26Å; E581-R584 PolarHBondContact O-N 3.48Å; E581-R584 IonicContact OE1-CZ 3.23Å; E581-R584 IonicContact OE1-NH2 3.17Å; E581-R584 PolarHBondContact OE1-NH2 2.82Å; S582-R584 PolarHBondContact O-N 3.27Å; R584-G586 VanDerWaalsContact C-N 3.32Å
585	Q	85.8	Confident	89.3	Confident	65 Å²	65	65 Å²	65	30%	0.304	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	5.8	175.5	-60.8	-162.6	36.7	0	0	113.5	E581 S582 Q583 F587 R589 V771	E581-Q585 PolarHBondContact O-N 2.97Å; S582-Q585 CarbonylContact O-C 3.55Å; S582-Q585 PolarHBondContact O-N 3.18Å; S582-Q585 VanDerWaalsContact O-N 3.11Å; Q583-Q585 PolarHBondContact O-N 3.13Å; Q585-F587 HydrophobicContact CB-CD2 4Å; Q585-F587 HydrophobicContact CB-CE2 4.14Å; Q585-R589 PolarHBondContact O-NH2 2.96Å; Q585-V771 HydrophobicContact CB-CG1 4.25Å; Q585-V771 HydrophobicContact CG-CG1 4.19Å
586	G	89.8	Confident	89.8	Confident	44 Å²	44	61 Å²	61	45%	0.454	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	28.6	175.8	0	0	0	0	0	114	S582 Q583 R584 R589	S582-G586 PolarHBondContact O-N 3.36Å; Q583-G586 WeakPolarHBondContact O-CA 3.49Å; Q583-G586 PolarHBondContact O-N 3.14Å; R584-G586 VanDerWaalsContact C-N 3.32Å; G586-R589 WeakPolarHBondContact O-CG 3.44Å; G586-R589 PolarHBondContact O-NE 2.97Å
587	F	93.9	Very high	90.1	Very high	6 Å²	6	59.6 Å²	59.6	3%	0.026	29%	0.291	C	S	.	.			trans	-102	151.4	171.5	-64.3	-71.5	0	0	0	111.4	N569 F570 L578 S582 Q583 Q585 R589 V771 Y808 T811	N569-F587 HydrophobicContact CB-CB 4.41Å; N569-F587 HydrophobicContact CB-CD1 3.58Å; N569-F587 HydrophobicContact CB-CE1 3.9Å; N569-F587 HydrophobicContact CB-CG 4.02Å; N569-F587 VanDerWaalsContact O-CD1 3.3Å; N569-F587 WeakPolarHBondContact O-CD1 3.44Å; F570-F587 HydrophobicContact CE2-CE1 4.07Å; F570-F587 HydrophobicContact CZ-CE1 4.11Å; L578-F587 HydrophobicContact CD1-CB 3.89Å; S582-F587 WeakPolarHBondContact O-CB 3.26Å; S582-F587 PolarHBondContact O-N 3.32Å; Q583-F587 WeakPolarHBondContact CA-O 3.3Å; Q585-F587 HydrophobicContact CB-CD2 4Å; Q585-F587 HydrophobicContact CB-CE2 4.14Å; F587-R589 HydrophobicContact CD1-CB 4.31Å; F587-R589 HydrophobicContact CD1-CG 3.71Å; F587-R589 HydrophobicContact CE1-CG 4.04Å; F587-V771 HydrophobicContact CD2-CG1 4.3Å; F587-V771 HydrophobicContact CD2-CG2 4.15Å; F587-V771 HydrophobicContact CE2-CG1 3.91Å; F587-V771 HydrophobicContact CE2-CG2 3.7Å; F587-V771 HydrophobicContact CZ-CG2 4.26Å; F587-Y808 AromaticContact CE1-CE1 3.97Å; F587-Y808 HydrophobicContact CE1-CE1 3.97Å; F587-Y808 HydrophobicContact CE2-CE1 4.37Å; F587-Y808 AromaticContact CZ-CD1 3.95Å; F587-Y808 HydrophobicContact CZ-CD1 3.95Å; F587-Y808 AromaticContact CZ-CE1 3.57Å; F587-Y808 HydrophobicContact CZ-CE1 3.57Å; F587-T811 HydrophobicContact CE2-CG2 4.33Å; F587-T811 HydrophobicContact CZ-CG2 4.3Å
588	P	93.1	Very high	90.4	Very high	55 Å²	55	52.7 Å²	52.7	36%	0.357	26%	0.259	S	S	.	.	S	Bend	cis	-73.8	148.8	0.7	30.8	-35	0	0	0	112.5	N569 P572 L578	N569-P588 CarbonylContact O-C 3.56Å; N569-P588 WeakPolarHBondContact O-CA 3.15Å; P572-P588 HydrophobicContact CB-CB 4.3Å; P572-P588 HydrophobicContact CB-CG 4.25Å; L578-P588 HydrophobicContact CD1-CB 3.94Å; L578-P588 HydrophobicContact CD1-CG 4.37Å
589	R	92.6	Very high	90.6	Very high	27 Å²	27	54.1 Å²	54.1	10%	0.102	26%	0.263	C	S	.	.			trans	-108.8	143.4	177	-66.6	-179.9	-178.6	-179.2	-1.2	110	N569 F570 Q585 G586 F587 T811 H927	N569-R589 PolarHBondContact O-N 3.25Å; F570-R589 CarbonylContact C-O 3.5Å; F570-R589 WeakPolarHBondContact CA-O 3.42Å; F570-R589 HydrophobicContact CD1-CB 4.26Å; F570-R589 HydrophobicContact CE1-CB 4.32Å; Q585-R589 PolarHBondContact O-NH2 2.96Å; G586-R589 WeakPolarHBondContact O-CG 3.44Å; G586-R589 PolarHBondContact O-NE 2.97Å; F587-R589 HydrophobicContact CD1-CB 4.31Å; F587-R589 HydrophobicContact CD1-CG 3.71Å; F587-R589 HydrophobicContact CE1-CG 4.04Å; R589-T811 PolarHBondContact NH1-OG1 3.44Å; R589-T811 VanDerWaalsContact NH1-OG1 3.07Å; R589-H927 VanDerWaalsContact CD-CG 3.5Å
590	Q	89.3	Confident	90.8	Very high	163 Å²	163	55.3 Å²	55.3	76%	0.762	27%	0.265	S	S	*	.			trans	-74.7	131.1	173.2	-167.8	173.2	12.6	0	0	110.3	H927	Q590-H927 PolarHBondContact O-NE2 3.28Å
591	H	90.8	Very high	91.1	Very high	17 Å²	17	55.5 Å²	55.5	8%	0.079	26%	0.256	C	S	.	.			trans	-112.4	159.5	174.9	-167	-95.7	0	0	0	110.8	F570 H593 Y925	F570-H591 HydrophobicContact CB-CB 4.15Å; F570-H591 HydrophobicContact CD1-CB 4.1Å; F570-H591 AromaticContact CD1-CD2 3.99Å; H591-H593 AromaticContact CE1-CD2 3.57Å; H591-H593 AromaticContact CE1-CE1 3.67Å; H591-H593 AromaticContact CE1-NE2 3.29Å; H591-H593 PolarHBondContact CE1-NE2 3.08Å; H591-H593 VanDerWaalsContact CE1-NE2 3.29Å; H591-H593 AromaticContact ND1-CD2 3.74Å; H591-H593 AromaticContact ND1-CE1 3.76Å; H591-H593 AromaticContact ND1-CG 3.76Å; H591-H593 PolarHBondContact ND1-N 3.39Å; H591-H593 AromaticContact ND1-ND1 3.76Å; H591-H593 AromaticContact ND1-NE2 3.73Å; H591-H593 PolarHBondContact ND1-O 3.43Å; H591-H593 PolarHBondContact O-N 3.43Å; H591-H593 VanDerWaalsContact O-N 3.14Å; H591-Y925 AromaticContact CE1-CE2 3.82Å; H591-Y925 AromaticContact NE2-CE2 3.44Å; H591-Y925 WeakPolarHBondContact NE2-CE2 3.22Å; H591-Y925 AromaticContact NE2-CZ 3.58Å
592	R	89.9	Confident	91.7	Very high	100 Å²	100	51.7 Å²	51.7	38%	0.377	24%	0.238	S	C	.	.	S	Bend	trans	-61.7	-22.1	-178.3	-65.2	-174	179.7	-173	-8.6	114.4	A437 E921 S924 Y925	A437-R592 HydrophobicContact CB-CB 3.94Å; R592-E921 VanDerWaalsContact CZ-CD 3.48Å; R592-E921 IonicContact CZ-OE1 2.85Å; R592-E921 IonicContact CZ-OE2 2.86Å; R592-E921 VanDerWaalsContact NH1-CD 3.26Å; R592-E921 IonicContact NH1-OE1 3.08Å; R592-E921 PolarHBondContact NH1-OE1 3.46Å; R592-E921 IonicContact NH1-OE2 2.96Å; R592-E921 PolarHBondContact NH1-OE2 3.15Å; R592-E921 IonicContact NH2-OE1 3.11Å; R592-E921 PolarHBondContact NH2-OE1 3.44Å; R592-E921 VanDerWaalsContact NH2-OE1 3.08Å; R592-E921 IonicContact NH2-OE2 3.53Å; R592-E921 PolarHBondContact NH2-OE2 3.18Å; R592-S924 PolarHBondContact NH2-OG 3.35Å; R592-Y925 HydrophobicContact CG-CD2 4.42Å
593	H	91.4	Very high	92	Very high	13 Å²	13	52 Å²	52	6%	0.06	24%	0.24	C	C	.	.			trans	-144.3	158.7	178	66	68.6	0	0	0	110.5	L433 A437 A438 A441 H591 L595	L433-H593 CarbonylContact O-C 3.59Å; L433-H593 WeakPolarHBondContact O-CA 3.26Å; L433-H593 VanDerWaalsContact O-CB 3.32Å; L433-H593 WeakPolarHBondContact O-CB 3.41Å; A437-H593 HydrophobicContact CB-CB 4.38Å; A437-H593 PolarHBondContact O-CD2 2.88Å; A438-H593 HydrophobicContact CB-CB 3.78Å; A441-H593 WeakPolarHBondContact CB-NE2 3.38Å; H591-H593 AromaticContact CE1-CD2 3.57Å; H591-H593 AromaticContact CE1-CE1 3.67Å; H591-H593 AromaticContact CE1-NE2 3.29Å; H591-H593 PolarHBondContact CE1-NE2 3.08Å; H591-H593 VanDerWaalsContact CE1-NE2 3.29Å; H591-H593 AromaticContact ND1-CD2 3.74Å; H591-H593 AromaticContact ND1-CE1 3.76Å; H591-H593 AromaticContact ND1-CG 3.76Å; H591-H593 PolarHBondContact ND1-N 3.39Å; H591-H593 AromaticContact ND1-ND1 3.76Å; H591-H593 AromaticContact ND1-NE2 3.73Å; H591-H593 PolarHBondContact ND1-O 3.43Å; H591-H593 PolarHBondContact O-N 3.43Å; H591-H593 VanDerWaalsContact O-N 3.14Å; H593-L595 PolarHBondContact ND1-N 3.45Å
594	R	89.6	Confident	92.1	Very high	136 Å²	136	52 Å²	52	51%	0.513	24%	0.24	S	C	.	.	S	Bend	trans	-95.4	7.3	-178.7	-60.9	-176.3	179.5	-166.4	-2.7	114.3	L433 L571 A596	L433-R594 HydrophobicContact CD2-CB 4.19Å; L433-R594 PolarHBondContact O-N 2.93Å; L571-R594 HydrophobicContact CD1-CB 3.78Å; L571-R594 HydrophobicContact CD1-CG 3.97Å; R594-A596 VanDerWaalsContact C-N 3.28Å; R594-A596 PolarHBondContact O-N 3.4Å
595	L	90.6	Very high	92.5	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.			trans	-87.7	25.4	173.7	-61.5	-179.1	0	0	0	114.1	Y430 L433 A438 A442 N445 L561 H593 C597	Y430-L595 HydrophobicContact CD1-CD1 4.34Å; Y430-L595 HydrophobicContact CE1-CD1 4.24Å; L433-L595 HydrophobicContact CD1-CD2 4.07Å; L433-L595 HydrophobicContact CD2-CD2 4.37Å; A438-L595 HydrophobicContact CB-CD1 3.98Å; A438-L595 HydrophobicContact CB-CG 4.39Å; A442-L595 HydrophobicContact CB-CD1 3.93Å; N445-L595 PolarHBondContact ND2-O 3.44Å; L561-L595 HydrophobicContact CD1-CD2 3.72Å; H593-L595 PolarHBondContact ND1-N 3.45Å; L595-C597 PolarHBondContact O-N 3.12Å
596	A	92.2	Very high	93	Very high	1 Å²	1	41 Å²	41	1%	0.008	20%	0.201	C	C	.	.			trans	-77.2	114.7	175.4	0	0	0	0	0	109	P566 D567 F570 R594	P566-A596 CarbonylContact C-O 3.57Å; P566-A596 WeakPolarHBondContact CA-O 3.46Å; D567-A596 HydrophobicContact CB-CB 4.31Å; D567-A596 PolarHBondContact N-O 2.76Å; F570-A596 HydrophobicContact CB-CB 3.99Å; R594-A596 VanDerWaalsContact C-N 3.28Å; R594-A596 PolarHBondContact O-N 3.4Å
597	C	93.1	Very high	93.3	Very high	14 Å²	14	39.6 Å²	39.6	10%	0.095	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-112.1	154.5	175.4	-54.8	0	0	0	0	111.7	F564 P565 L595 R807	F564-C597 HydrophobicContact CB-CB 4.47Å; F564-C597 PolarHBondContact O-SG 3.44Å; P565-C597 WeakPolarHBondContact O-CA 3.49Å; P565-C597 WeakPolarHBondContact O-CB 3.5Å; L595-C597 PolarHBondContact O-N 3.12Å; C597-R807 PolarHBondContact O-NH2 3.08Å; C597-R807 VanDerWaalsContact O-NH2 3.08Å
598	L	94.3	Very high	93.3	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	21%	0.209	C	C	.	.			trans	-65.9	146.3	166.2	-60.9	-177.3	0	0	0	109.3	F564 P565 D567 L602 I603 L763 A766	F564-L598 VanDerWaalsContact CB-O 3.28Å; F564-L598 WeakPolarHBondContact CB-O 3.29Å; P565-L598 HydrophobicContact CG-CD1 4.34Å; P565-L598 PolarHBondContact O-N 2.97Å; D567-L598 HydrophobicContact CB-CD2 3.72Å; D567-L598 HydrophobicContact CB-CG 4.32Å; L598-L602 HydrophobicContact CB-CD2 4.03Å; L598-L602 HydrophobicContact CD1-CD2 4.17Å; L598-L602 HydrophobicContact CD2-CD2 3.63Å; L598-L602 HydrophobicContact CG-CD2 4.14Å; L598-I603 HydrophobicContact CB-CD1 4.49Å; L598-I603 HydrophobicContact CB-CG1 4.42Å; L598-L763 HydrophobicContact CD1-CD1 3.68Å; L598-A766 HydrophobicContact CD1-CB 4.03Å
599	R	94.3	Very high	93.4	Very high	45 Å²	45	45.8 Å²	45.8	17%	0.17	21%	0.207	C	C	.	.			trans	-81.4	154.6	178.8	-60.7	-171.1	58.8	94.5	7.7	111.4	E601 L602 I603 H800 N805	R599-E601 VanDerWaalsContact C-N 3.3Å; R599-E601 VanDerWaalsContact CB-OE2 3.23Å; R599-E601 WeakPolarHBondContact CB-OE2 3.19Å; R599-E601 IonicContact CZ-OE1 3.98Å; R599-E601 IonicContact CZ-OE2 3.81Å; R599-E601 IonicContact NE-OE1 3.05Å; R599-E601 IonicContact NE-OE2 3.57Å; R599-E601 PolarHBondContact NE-OE2 3.33Å; R599-E601 IonicContact NH2-OE1 2.72Å; R599-E601 PolarHBondContact NH2-OE1 3.3Å; R599-E601 IonicContact NH2-OE2 2.74Å; R599-E601 PolarHBondContact NH2-OE2 3.46Å; R599-E601 PolarHBondContact O-N 3.16Å; R599-L602 WeakPolarHBondContact O-CB 3.47Å; R599-L602 PolarHBondContact O-N 2.91Å; R599-I603 WeakPolarHBondContact O-CG1 3.4Å; R599-I603 PolarHBondContact O-N 2.83Å; R599-H800 VanDerWaalsContact CZ-CD2 3.46Å; R599-H800 PolarHBondContact NH1-CD2 2.95Å; R599-H800 PolarHBondContact NH1-CE1 3.02Å; R599-H800 PolarHBondContact NH1-NE2 2.89Å; R599-N805 HydrophobicContact CG-CB 4.37Å
600	Q	93.9	Very high	93.5	Very high	59 Å²	59	45.8 Å²	45.8	28%	0.276	21%	0.207	S	C	.	.	H	α-helix	trans	-54.8	-46.4	174.7	-174.5	178.2	-17.8	0	0	111.9	F564 L602 I603 E604	F564-Q600 HydrophobicContact CE1-CB 3.82Å; F564-Q600 HydrophobicContact CE1-CG 3.91Å; F564-Q600 HydrophobicContact CE2-CB 4.03Å; F564-Q600 HydrophobicContact CZ-CB 3.54Å; F564-Q600 HydrophobicContact CZ-CG 3.83Å; Q600-L602 PolarHBondContact O-N 3.17Å; Q600-I603 WeakPolarHBondContact O-CB 3.13Å; Q600-I603 PolarHBondContact O-N 3.39Å; Q600-E604 HydrophobicContact CG-CG 4.45Å; Q600-E604 WeakPolarHBondContact CG-OE1 3.2Å; Q600-E604 PolarHBondContact NE2-OE1 3.46Å; Q600-E604 WeakPolarHBondContact O-CG 3.42Å; Q600-E604 PolarHBondContact O-N 3.36Å
601	E	95.3	Very high	93.7	Very high	58 Å²	58	43 Å²	43	27%	0.271	19%	0.19	S	C	.	.	H	α-helix	trans	-63.7	-31.5	-176.3	-50.8	90	158.7	0	0	111.4	R599 A605 H800	R599-E601 VanDerWaalsContact C-N 3.3Å; R599-E601 VanDerWaalsContact CB-OE2 3.23Å; R599-E601 WeakPolarHBondContact CB-OE2 3.19Å; R599-E601 IonicContact CZ-OE1 3.98Å; R599-E601 IonicContact CZ-OE2 3.81Å; R599-E601 IonicContact NE-OE1 3.05Å; R599-E601 IonicContact NE-OE2 3.57Å; R599-E601 PolarHBondContact NE-OE2 3.33Å; R599-E601 IonicContact NH2-OE1 2.72Å; R599-E601 PolarHBondContact NH2-OE1 3.3Å; R599-E601 IonicContact NH2-OE2 2.74Å; R599-E601 PolarHBondContact NH2-OE2 3.46Å; R599-E601 PolarHBondContact O-N 3.16Å; E601-A605 VanDerWaalsContact O-CB 3.3Å; E601-A605 WeakPolarHBondContact O-CB 3.16Å; E601-A605 PolarHBondContact O-N 2.91Å; E601-H800 WeakPolarHBondContact CB-O 3.38Å; E601-H800 WeakPolarHBondContact CG-O 3.49Å
602	L	96.8	Very high	93.8	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-68.9	-43.2	173.7	-179.4	73.9	0	0	0	111.4	L598 R599 Q600 E604 A605 F606 F769 L770 Q774	L598-L602 HydrophobicContact CB-CD2 4.03Å; L598-L602 HydrophobicContact CD1-CD2 4.17Å; L598-L602 HydrophobicContact CD2-CD2 3.63Å; L598-L602 HydrophobicContact CG-CD2 4.14Å; R599-L602 WeakPolarHBondContact O-CB 3.47Å; R599-L602 PolarHBondContact O-N 2.91Å; Q600-L602 PolarHBondContact O-N 3.17Å; L602-E604 VanDerWaalsContact C-N 3.33Å; L602-A605 PolarHBondContact O-N 2.89Å; L602-F606 VanDerWaalsContact O-CB 3.25Å; L602-F606 WeakPolarHBondContact O-CB 3.22Å; L602-F606 PolarHBondContact O-N 2.95Å; L602-F769 HydrophobicContact CD1-CD1 4.14Å; L602-F769 HydrophobicContact CD1-CE1 4.44Å; L602-L770 HydrophobicContact CD1-CB 3.84Å; L602-L770 HydrophobicContact CD1-CD1 4.21Å; L602-L770 HydrophobicContact CD1-CG 4.12Å; L602-L770 HydrophobicContact CD2-CB 4.12Å; L602-L770 HydrophobicContact CD2-CD1 3.71Å; L602-L770 HydrophobicContact CD2-CG 4.39Å; L602-Q774 HydrophobicContact CD1-CG 3.76Å
603	I	95.6	Very high	93.8	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-45.1	-179	-66.2	163.5	0	0	0	109.1	K523 F564 P565 L598 R599 Q600 F606 V607 F737	K523-I603 HydrophobicContact CB-CG2 3.85Å; K523-I603 HydrophobicContact CG-CG2 3.99Å; F564-I603 HydrophobicContact CB-CD1 3.97Å; F564-I603 HydrophobicContact CD1-CD1 3.6Å; F564-I603 HydrophobicContact CE1-CD1 4.5Å; F564-I603 HydrophobicContact CG-CD1 4.09Å; P565-I603 HydrophobicContact CG-CD1 4.03Å; L598-I603 HydrophobicContact CB-CD1 4.49Å; L598-I603 HydrophobicContact CB-CG1 4.42Å; R599-I603 WeakPolarHBondContact O-CG1 3.4Å; R599-I603 PolarHBondContact O-N 2.83Å; Q600-I603 WeakPolarHBondContact O-CB 3.13Å; Q600-I603 PolarHBondContact O-N 3.39Å; I603-F606 PolarHBondContact O-N 3.19Å; I603-V607 HydrophobicContact CG2-CG2 4.48Å; I603-V607 WeakPolarHBondContact O-CB 3.34Å; I603-V607 VanDerWaalsContact O-CG2 3.24Å; I603-V607 WeakPolarHBondContact O-CG2 3.35Å; I603-V607 PolarHBondContact O-N 3.14Å; I603-F737 HydrophobicContact CG2-CD2 4Å; I603-F737 HydrophobicContact CG2-CE2 3.81Å
604	E	94.8	Very high	93.8	Very high	87 Å²	87	45.5 Å²	45.5	41%	0.407	21%	0.21	S	C	.	.	H	α-helix	trans	-58.5	-51.6	174.2	-70.8	172.3	-176.9	0	0	111.3	Q600 L602 F606 V607 E608	Q600-E604 HydrophobicContact CG-CG 4.45Å; Q600-E604 WeakPolarHBondContact CG-OE1 3.2Å; Q600-E604 PolarHBondContact NE2-OE1 3.46Å; Q600-E604 WeakPolarHBondContact O-CG 3.42Å; Q600-E604 PolarHBondContact O-N 3.36Å; L602-E604 VanDerWaalsContact C-N 3.33Å; E604-F606 VanDerWaalsContact C-N 3.31Å; E604-F606 PolarHBondContact O-N 3.42Å; E604-V607 PolarHBondContact O-N 2.97Å; E604-E608 WeakPolarHBondContact O-CB 3.36Å; E604-E608 PolarHBondContact O-N 3.02Å
605	A	96.1	Very high	93.8	Very high	22 Å²	22	43.6 Å²	43.6	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-35.2	178.6	0	0	0	0	0	113.2	E601 L602 H609 F769	E601-A605 VanDerWaalsContact O-CB 3.3Å; E601-A605 WeakPolarHBondContact O-CB 3.16Å; E601-A605 PolarHBondContact O-N 2.91Å; L602-A605 PolarHBondContact O-N 2.89Å; A605-H609 VanDerWaalsContact O-CB 3.31Å; A605-H609 WeakPolarHBondContact O-CB 3.35Å; A605-H609 PolarHBondContact O-N 3.23Å; A605-F769 HydrophobicContact CB-CE1 4.36Å
606	F	96.6	Very high	93.7	Very high	4 Å²	4	50 Å²	50	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-69.6	-44.7	176.2	176.1	-103	0	0	0	111.4	L602 I603 E604 E608 H609 R610 F737 L762 D765 A766 F769	L602-F606 VanDerWaalsContact O-CB 3.25Å; L602-F606 WeakPolarHBondContact O-CB 3.22Å; L602-F606 PolarHBondContact O-N 2.95Å; I603-F606 PolarHBondContact O-N 3.19Å; E604-F606 VanDerWaalsContact C-N 3.31Å; E604-F606 PolarHBondContact O-N 3.42Å; F606-E608 VanDerWaalsContact C-N 3.33Å; F606-H609 WeakPolarHBondContact O-CB 3.49Å; F606-H609 PolarHBondContact O-N 3.11Å; F606-R610 HydrophobicContact CD1-CG 4.26Å; F606-R610 HydrophobicContact CD2-CG 4.4Å; F606-R610 HydrophobicContact CE1-CG 3.88Å; F606-R610 HydrophobicContact CE2-CG 4.04Å; F606-R610 HydrophobicContact CZ-CG 3.78Å; F606-R610 VanDerWaalsContact O-CG 3.27Å; F606-R610 WeakPolarHBondContact O-CG 3.3Å; F606-R610 PolarHBondContact O-N 3Å; F606-F737 HydrophobicContact CD1-CE2 4.39Å; F606-F737 AromaticContact CD1-CZ 3.79Å; F606-F737 HydrophobicContact CD1-CZ 3.79Å; F606-F737 AromaticContact CE1-CZ 3.85Å; F606-F737 HydrophobicContact CE1-CZ 3.85Å; F606-L762 HydrophobicContact CE1-CD1 3.79Å; F606-L762 HydrophobicContact CE1-CG 4.44Å; F606-L762 HydrophobicContact CZ-CD1 4.08Å; F606-D765 HydrophobicContact CE2-CB 4.2Å; F606-D765 HydrophobicContact CZ-CB 3.96Å; F606-A766 HydrophobicContact CD1-CB 4.15Å; F606-A766 HydrophobicContact CD2-CB 4.24Å; F606-A766 HydrophobicContact CE1-CB 4.14Å; F606-A766 HydrophobicContact CE2-CB 4.24Å; F606-A766 HydrophobicContact CG-CB 4.18Å; F606-A766 HydrophobicContact CZ-CB 4.18Å; F606-F769 HydrophobicContact CB-CD1 3.87Å; F606-F769 HydrophobicContact CB-CE1 3.97Å; F606-F769 HydrophobicContact CD2-CB 3.74Å; F606-F769 AromaticContact CD2-CD1 3.74Å; F606-F769 HydrophobicContact CD2-CD1 3.74Å; F606-F769 HydrophobicContact CD2-CD2 4.4Å; F606-F769 HydrophobicContact CD2-CE1 4.4Å; F606-F769 AromaticContact CD2-CG 3.72Å; F606-F769 HydrophobicContact CD2-CG 3.72Å; F606-F769 HydrophobicContact CE2-CB 4.11Å; F606-F769 HydrophobicContact CE2-CG 4.47Å; F606-F769 HydrophobicContact CG-CD1 4.3Å
607	V	95.4	Very high	93.5	Very high	13 Å²	13	53.3 Å²	53.3	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-42.9	176.7	172.4	0	0	0	0	110.2	K523 I603 E604 R610 Y611 F733 I735	K523-V607 HydrophobicContact CD-CG2 4.4Å; K523-V607 HydrophobicContact CG-CG2 4.42Å; I603-V607 HydrophobicContact CG2-CG2 4.48Å; I603-V607 WeakPolarHBondContact O-CB 3.34Å; I603-V607 VanDerWaalsContact O-CG2 3.24Å; I603-V607 WeakPolarHBondContact O-CG2 3.35Å; I603-V607 PolarHBondContact O-N 3.14Å; E604-V607 PolarHBondContact O-N 2.97Å; V607-R610 PolarHBondContact O-N 3.43Å; V607-Y611 WeakPolarHBondContact O-CB 3.47Å; V607-Y611 PolarHBondContact O-N 2.99Å; V607-F733 HydrophobicContact CG1-CE1 3.78Å; V607-F733 HydrophobicContact CG1-CZ 3.99Å; V607-F733 WeakPolarHBondContact O-CZ 3.32Å; V607-I735 HydrophobicContact CG2-CB 4.16Å; V607-I735 HydrophobicContact CG2-CG2 3.96Å
608	E	94.6	Very high	93.1	Very high	125 Å²	125	53.2 Å²	53.2	58%	0.584	25%	0.253	S	S	*	.	H	α-helix	trans	-60.4	-45.3	174	-173.7	-179.4	-169	0	0	111.7	E604 F606 R610 Y611 L612	E604-E608 WeakPolarHBondContact O-CB 3.36Å; E604-E608 PolarHBondContact O-N 3.02Å; F606-E608 VanDerWaalsContact C-N 3.33Å; E608-R610 VanDerWaalsContact C-N 3.34Å; E608-R610 PolarHBondContact O-N 3.36Å; E608-Y611 WeakPolarHBondContact O-CB 3.48Å; E608-Y611 PolarHBondContact O-N 3.03Å; E608-Y611 VanDerWaalsContact O-N 3.15Å; E608-L612 WeakPolarHBondContact O-CG 3.45Å; E608-L612 PolarHBondContact O-N 3.48Å
609	H	94.5	Very high	92.7	Very high	67 Å²	67	55 Å²	55	31%	0.31	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-44.3	175.7	178.7	70.6	0	0	0	112.3	A605 F606 Y611 L612 L613 F769	A605-H609 VanDerWaalsContact O-CB 3.31Å; A605-H609 WeakPolarHBondContact O-CB 3.35Å; A605-H609 PolarHBondContact O-N 3.23Å; F606-H609 WeakPolarHBondContact O-CB 3.49Å; F606-H609 PolarHBondContact O-N 3.11Å; H609-Y611 VanDerWaalsContact C-N 3.31Å; H609-Y611 PolarHBondContact O-N 2.98Å; H609-L612 PolarHBondContact O-N 3.46Å; H609-L613 WeakPolarHBondContact O-CG 3.4Å; H609-L613 PolarHBondContact O-N 2.88Å; H609-F769 HydrophobicContact CB-CE2 3.77Å; H609-F769 HydrophobicContact CB-CZ 3.73Å; H609-F769 AromaticContact CD2-CD2 3.91Å; H609-F769 AromaticContact CD2-CE2 3.61Å; H609-F769 AromaticContact CG-CE2 3.49Å; H609-F769 VanDerWaalsContact CG-CE2 3.49Å; H609-F769 AromaticContact CG-CZ 3.99Å; H609-F769 AromaticContact ND1-CE2 3.94Å
610	R	94.2	Very high	92.3	Very high	27 Å²	27	56.5 Å²	56.5	10%	0.102	28%	0.279	C	S	.	.	H	α-helix	trans	-67.3	-33	176.8	-66	-70.5	-87.2	-128.6	-3.1	111.9	F606 V607 E608 L613 F614 V725 F733 I735 D765	F606-R610 HydrophobicContact CD1-CG 4.26Å; F606-R610 HydrophobicContact CD2-CG 4.4Å; F606-R610 HydrophobicContact CE1-CG 3.88Å; F606-R610 HydrophobicContact CE2-CG 4.04Å; F606-R610 HydrophobicContact CZ-CG 3.78Å; F606-R610 VanDerWaalsContact O-CG 3.27Å; F606-R610 WeakPolarHBondContact O-CG 3.3Å; F606-R610 PolarHBondContact O-N 3Å; V607-R610 PolarHBondContact O-N 3.43Å; E608-R610 VanDerWaalsContact C-N 3.34Å; E608-R610 PolarHBondContact O-N 3.36Å; R610-L613 PolarHBondContact O-N 2.84Å; R610-F614 WeakPolarHBondContact O-CB 3.37Å; R610-F614 PolarHBondContact O-N 2.7Å; R610-V725 PolarHBondContact NE-O 2.7Å; R610-V725 PolarHBondContact NH2-O 3Å; R610-F733 HydrophobicContact CB-CE2 4.05Å; R610-F733 HydrophobicContact CB-CZ 4.14Å; R610-I735 HydrophobicContact CB-CD1 3.44Å; R610-I735 VanDerWaalsContact CB-CD1 3.44Å; R610-I735 HydrophobicContact CG-CD1 3.85Å; R610-D765 IonicContact CZ-OD2 3.04Å; R610-D765 IonicContact NH1-OD2 3.72Å; R610-D765 PolarHBondContact NH1-OD2 3.1Å; R610-D765 IonicContact NH2-OD2 2.64Å; R610-D765 PolarHBondContact NH2-OD2 3.27Å
611	Y	93.6	Very high	91.8	Very high	105 Å²	105	56.1 Å²	56.1	41%	0.412	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-44.3	173.6	179.3	-108.7	0	0	0	111.6	V607 E608 H609 L613 F614 M615 F733	V607-Y611 WeakPolarHBondContact O-CB 3.47Å; V607-Y611 PolarHBondContact O-N 2.99Å; E608-Y611 WeakPolarHBondContact O-CB 3.48Å; E608-Y611 PolarHBondContact O-N 3.03Å; E608-Y611 VanDerWaalsContact O-N 3.15Å; H609-Y611 VanDerWaalsContact C-N 3.31Å; H609-Y611 PolarHBondContact O-N 2.98Å; Y611-L613 VanDerWaalsContact C-N 3.32Å; Y611-L613 PolarHBondContact O-N 3.39Å; Y611-F614 HydrophobicContact CD2-CD1 4.44Å; Y611-F614 HydrophobicContact CE2-CD1 4.48Å; Y611-F614 WeakPolarHBondContact O-CB 3.37Å; Y611-F614 PolarHBondContact O-N 3.17Å; Y611-M615 HydrophobicContact CD1-CG 4.43Å; Y611-M615 HydrophobicContact CE1-CG 4.01Å; Y611-M615 HydrophobicContact CE2-CG 4.18Å; Y611-M615 HydrophobicContact CE2-SD 4.39Å; Y611-M615 WeakPolarHBondContact O-CG 3.49Å; Y611-M615 PolarHBondContact O-N 3.3Å; Y611-F733 HydrophobicContact CD2-CB 4.3Å; Y611-F733 AromaticContact CD2-CD1 3.67Å; Y611-F733 HydrophobicContact CD2-CD1 3.67Å; Y611-F733 HydrophobicContact CD2-CD2 4.3Å; Y611-F733 HydrophobicContact CD2-CE1 4.01Å; Y611-F733 AromaticContact CD2-CG 3.83Å; Y611-F733 HydrophobicContact CD2-CG 3.83Å; Y611-F733 HydrophobicContact CD2-CZ 4.46Å; Y611-F733 HydrophobicContact CG-CD1 4.44Å; Y611-F733 HydrophobicContact CG-CE1 4.34Å
612	L	92.3	Very high	91.2	Very high	104 Å²	104	57 Å²	57	55%	0.545	28%	0.283	S	S	.	.	H	α-helix	trans	-62.1	-39.8	174.8	-67.7	173.8	0	0	0	111.9	E608 H609 M615 K616	E608-L612 WeakPolarHBondContact O-CG 3.45Å; E608-L612 PolarHBondContact O-N 3.48Å; H609-L612 PolarHBondContact O-N 3.46Å; L612-M615 PolarHBondContact O-N 3.3Å; L612-K616 WeakPolarHBondContact O-CB 3.48Å; L612-K616 PolarHBondContact O-N 3.24Å
613	L	90.4	Very high	90.4	Very high	57 Å²	57	63.2 Å²	63.2	30%	0.298	31%	0.314	S	S	.	.	H	α-helix	trans	-64.1	-43.2	173.4	-71.6	174.9	0	0	0	112.1	H609 R610 Y611 K616 M617 V725	H609-L613 WeakPolarHBondContact O-CG 3.4Å; H609-L613 PolarHBondContact O-N 2.88Å; R610-L613 PolarHBondContact O-N 2.84Å; Y611-L613 VanDerWaalsContact C-N 3.32Å; Y611-L613 PolarHBondContact O-N 3.39Å; L613-K616 PolarHBondContact O-N 3.43Å; L613-M617 WeakPolarHBondContact O-CB 3.29Å; L613-M617 VanDerWaalsContact O-CG 3.31Å; L613-M617 WeakPolarHBondContact O-CG 3.32Å; L613-M617 PolarHBondContact O-N 3.38Å; L613-V725 HydrophobicContact CB-CG1 4.27Å
614	F	91.6	Very high	89.6	Confident	21 Å²	21	68.3 Å²	68.3	9%	0.092	34%	0.337	C	S	.	.	H	α-helix	trans	-56.8	-50.9	175.2	168.5	-98.3	0	0	0	110.8	R610 Y611 K616 M617 A618 V718 A721 V725 F733	R610-F614 WeakPolarHBondContact O-CB 3.37Å; R610-F614 PolarHBondContact O-N 2.7Å; Y611-F614 HydrophobicContact CD2-CD1 4.44Å; Y611-F614 HydrophobicContact CE2-CD1 4.48Å; Y611-F614 WeakPolarHBondContact O-CB 3.37Å; Y611-F614 PolarHBondContact O-N 3.17Å; F614-K616 VanDerWaalsContact C-N 3.33Å; F614-K616 PolarHBondContact O-N 2.69Å; F614-M617 PolarHBondContact O-N 2.91Å; F614-A618 VanDerWaalsContact O-CB 3.31Å; F614-A618 WeakPolarHBondContact O-CB 3.4Å; F614-A618 PolarHBondContact O-N 3.42Å; F614-V718 HydrophobicContact CE2-CG1 4.5Å; F614-V718 HydrophobicContact CZ-CG1 4.36Å; F614-A721 HydrophobicContact CD2-CB 3.62Å; F614-A721 HydrophobicContact CE2-CB 3.63Å; F614-V725 HydrophobicContact CB-CG1 3.87Å; F614-V725 HydrophobicContact CB-CG2 4.18Å; F614-V725 HydrophobicContact CD2-CG2 4.25Å; F614-F733 HydrophobicContact CB-CD2 3.89Å; F614-F733 HydrophobicContact CB-CE2 4.32Å; F614-F733 HydrophobicContact CD1-CB 4.16Å; F614-F733 HydrophobicContact CD1-CD2 4.39Å; F614-F733 HydrophobicContact CD2-CD2 4.42Å; F614-F733 HydrophobicContact CE1-CB 4.22Å; F614-F733 HydrophobicContact CG-CB 4.4Å; F614-F733 AromaticContact CG-CD2 3.98Å; F614-F733 HydrophobicContact CG-CD2 3.98Å; F614-F733 HydrophobicContact CZ-CB 4.5Å
615	M	89.7	Confident	88.5	Confident	95 Å²	95	67.3 Å²	67.3	47%	0.468	33%	0.333	S	S	.	.	H	α-helix	trans	-59.2	-43.9	177.9	-73.1	-62.3	-67.5	0	0	111.8	Y611 L612 A619	Y611-M615 HydrophobicContact CD1-CG 4.43Å; Y611-M615 HydrophobicContact CE1-CG 4.01Å; Y611-M615 HydrophobicContact CE2-CG 4.18Å; Y611-M615 HydrophobicContact CE2-SD 4.39Å; Y611-M615 WeakPolarHBondContact O-CG 3.49Å; Y611-M615 PolarHBondContact O-N 3.3Å; L612-M615 PolarHBondContact O-N 3.3Å; M615-A619 VanDerWaalsContact O-CB 3.24Å; M615-A619 WeakPolarHBondContact O-CB 3.07Å; M615-A619 PolarHBondContact O-N 3.15Å
616	K	88.9	Confident	87.5	Confident	136 Å²	136	73.4 Å²	73.4	59%	0.591	36%	0.355	S	S	*	.	H	α-helix	trans	-63.8	-45.6	177.8	-174.6	178.2	-179.8	179.9	0	112	L612 L613 F614 A619 I620	L612-K616 WeakPolarHBondContact O-CB 3.48Å; L612-K616 PolarHBondContact O-N 3.24Å; L613-K616 PolarHBondContact O-N 3.43Å; F614-K616 VanDerWaalsContact C-N 3.33Å; F614-K616 PolarHBondContact O-N 2.69Å; K616-A619 PolarHBondContact O-N 3.36Å; K616-I620 HydrophobicContact CG-CD1 3.92Å; K616-I620 VanDerWaalsContact O-CG1 3.25Å; K616-I620 WeakPolarHBondContact O-CG1 3.45Å; K616-I620 PolarHBondContact O-N 3.22Å
617	M	87.1	Confident	86.3	Confident	69 Å²	69	75.8 Å²	75.8	34%	0.34	38%	0.376	S	S	.	.	H	α-helix	trans	-66.2	-44.2	179.5	-72.7	-178.7	176	0	0	111.7	L613 F614 A619 I620 Q621 A721 A724 V725	L613-M617 WeakPolarHBondContact O-CB 3.29Å; L613-M617 VanDerWaalsContact O-CG 3.31Å; L613-M617 WeakPolarHBondContact O-CG 3.32Å; L613-M617 PolarHBondContact O-N 3.38Å; F614-M617 PolarHBondContact O-N 2.91Å; M617-A619 PolarHBondContact O-N 3.35Å; M617-I620 PolarHBondContact O-N 2.77Å; M617-Q621 WeakPolarHBondContact O-CB 3.39Å; M617-Q621 WeakPolarHBondContact O-CG 3.49Å; M617-Q621 PolarHBondContact O-N 3.25Å; M617-A721 HydrophobicContact CB-CB 4.43Å; M617-A724 HydrophobicContact CE-CB 4.28Å; M617-A724 HydrophobicContact SD-CB 3.53Å; M617-A724 VanDerWaalsContact SD-CB 3.53Å; M617-V725 HydrophobicContact SD-CG1 4.45Å
618	A	86.1	Confident	84.9	Confident	13 Å²	13	80.3 Å²	80.3	11%	0.107	40%	0.399	C	S	.	.	H	α-helix	trans	-60.3	-45.4	175.1	0	0	0	0	0	111	F614 Q621 L622 V717 A721	F614-A618 VanDerWaalsContact O-CB 3.31Å; F614-A618 WeakPolarHBondContact O-CB 3.4Å; F614-A618 PolarHBondContact O-N 3.42Å; A618-Q621 PolarHBondContact O-N 2.9Å; A618-L622 WeakPolarHBondContact O-CB 3.49Å; A618-L622 VanDerWaalsContact O-CG 3.24Å; A618-L622 WeakPolarHBondContact O-CG 3.48Å; A618-L622 PolarHBondContact O-N 3.44Å; A618-V717 HydrophobicContact CB-CG1 4.49Å; A618-A721 HydrophobicContact CB-CB 4.35Å
619	A	86.2	Confident	83.5	Confident	42 Å²	42	80.9 Å²	80.9	35%	0.347	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-45.9	177	0	0	0	0	0	112.4	M615 K616 M617 L622 M623	M615-A619 VanDerWaalsContact O-CB 3.24Å; M615-A619 WeakPolarHBondContact O-CB 3.07Å; M615-A619 PolarHBondContact O-N 3.15Å; K616-A619 PolarHBondContact O-N 3.36Å; M617-A619 PolarHBondContact O-N 3.35Å; A619-L622 PolarHBondContact O-N 3.25Å; A619-M623 WeakPolarHBondContact O-CB 3.32Å; A619-M623 VanDerWaalsContact O-CG 3.28Å; A619-M623 WeakPolarHBondContact O-CG 3.47Å; A619-M623 PolarHBondContact O-N 3.27Å
620	I	85.4	Confident	81.6	Confident	76 Å²	76	82.9 Å²	82.9	39%	0.39	41%	0.413	S	S	.	.	H	α-helix	trans	-62.8	-45.6	178.8	-70.5	167.3	0	0	0	111	K616 M617 M623 Q624	K616-I620 HydrophobicContact CG-CD1 3.92Å; K616-I620 VanDerWaalsContact O-CG1 3.25Å; K616-I620 WeakPolarHBondContact O-CG1 3.45Å; K616-I620 PolarHBondContact O-N 3.22Å; M617-I620 PolarHBondContact O-N 2.77Å; I620-M623 PolarHBondContact O-N 3.45Å; I620-Q624 HydrophobicContact CG2-CG 4.41Å; I620-Q624 WeakPolarHBondContact O-CG 3.32Å; I620-Q624 PolarHBondContact O-N 2.86Å
621	Q	82.3	Confident	79.5	Confident	51 Å²	51	84.8 Å²	84.8	24%	0.238	43%	0.43	C	S	.	.	H	α-helix	trans	-66.4	-38.3	179.7	-71.8	-179.5	9	0	0	111.7	M617 A618 Q624 Q625 V717	M617-Q621 WeakPolarHBondContact O-CB 3.39Å; M617-Q621 WeakPolarHBondContact O-CG 3.49Å; M617-Q621 PolarHBondContact O-N 3.25Å; A618-Q621 PolarHBondContact O-N 2.9Å; Q621-Q624 PolarHBondContact O-N 3.29Å; Q621-Q625 WeakPolarHBondContact O-CB 3.34Å; Q621-Q625 VanDerWaalsContact O-CG 3.31Å; Q621-Q625 WeakPolarHBondContact O-CG 3.3Å; Q621-Q625 PolarHBondContact O-N 2.86Å; Q621-V717 HydrophobicContact CB-CB 4.47Å; Q621-V717 HydrophobicContact CB-CG1 3.7Å; Q621-V717 HydrophobicContact CB-CG2 4.08Å; Q621-V717 PolarHBondContact OE1-O 3.43Å
622	L	82.3	Confident	77.3	Confident	77 Å²	77	83.9 Å²	83.9	40%	0.403	44%	0.44	S	S	.	.	H	α-helix	trans	-65.3	-38.2	172.7	-72.1	171.4	0	0	0	112.3	A618 A619 Q625 K626 V717	A618-L622 WeakPolarHBondContact O-CB 3.49Å; A618-L622 VanDerWaalsContact O-CG 3.24Å; A618-L622 WeakPolarHBondContact O-CG 3.48Å; A618-L622 PolarHBondContact O-N 3.44Å; A619-L622 PolarHBondContact O-N 3.25Å; L622-Q625 PolarHBondContact O-N 3.07Å; L622-K626 WeakPolarHBondContact O-CG 3.32Å; L622-K626 PolarHBondContact O-N 2.87Å; L622-V717 HydrophobicContact CD2-CG1 4.43Å; L622-V717 HydrophobicContact CD2-CG2 4.5Å; L622-V717 HydrophobicContact CG-CG1 4.17Å
623	M	80.9	Confident	75.1	Confident	131 Å²	131	87.4 Å²	87.4	65%	0.645	45%	0.45	S	S	*	.	H	α-helix	trans	-66.1	-43.6	174.4	-74.6	179.2	-177.8	0	0	111.9	A619 I620 Q625 K626 A627	A619-M623 WeakPolarHBondContact O-CB 3.32Å; A619-M623 VanDerWaalsContact O-CG 3.28Å; A619-M623 WeakPolarHBondContact O-CG 3.47Å; A619-M623 PolarHBondContact O-N 3.27Å; I620-M623 PolarHBondContact O-N 3.45Å; M623-Q625 VanDerWaalsContact C-N 3.3Å; M623-Q625 PolarHBondContact O-N 2.84Å; M623-K626 PolarHBondContact O-N 2.61Å; M623-A627 WeakPolarHBondContact O-CB 3.34Å; M623-A627 PolarHBondContact O-N 3.14Å
624	Q	79.1	Confident	72.7	Confident	113 Å²	113	89.8 Å²	89.8	53%	0.528	47%	0.467	S	S	.	.	H	α-helix	trans	-62.9	-37.5	175.1	-73.7	174.5	-7	0	0	111.8	I620 Q621 A627 N628	I620-Q624 HydrophobicContact CG2-CG 4.41Å; I620-Q624 WeakPolarHBondContact O-CG 3.32Å; I620-Q624 PolarHBondContact O-N 2.86Å; Q621-Q624 PolarHBondContact O-N 3.29Å; Q624-A627 PolarHBondContact O-N 3.16Å; Q624-N628 WeakPolarHBondContact O-CB 3.43Å; Q624-N628 VanDerWaalsContact O-CG 3.29Å; Q624-N628 PolarHBondContact O-N 3.35Å
625	Q	72.2	Confident	69.8	Low	65 Å²	65	95.3 Å²	95.3	30%	0.304	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-40.5	174	-76.5	-175.3	-6.4	0	0	112.4	Q621 L622 M623 N628 K629 K713	Q621-Q625 WeakPolarHBondContact O-CB 3.34Å; Q621-Q625 VanDerWaalsContact O-CG 3.31Å; Q621-Q625 WeakPolarHBondContact O-CG 3.3Å; Q621-Q625 PolarHBondContact O-N 2.86Å; L622-Q625 PolarHBondContact O-N 3.07Å; M623-Q625 VanDerWaalsContact C-N 3.3Å; M623-Q625 PolarHBondContact O-N 2.84Å; Q625-N628 PolarHBondContact O-N 2.9Å; Q625-K629 WeakPolarHBondContact O-CB 3.24Å; Q625-K629 PolarHBondContact O-N 2.97Å; Q625-K713 PolarHBondContact NE2-O 3.32Å
626	K	73.8	Confident	67.1	Low	150 Å²	150	97.6 Å²	97.6	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-46.2	172.6	-76.8	-178.3	179.2	-179.1	0	111.2	L622 M623 N628 K629 D630	L622-K626 WeakPolarHBondContact O-CG 3.32Å; L622-K626 PolarHBondContact O-N 2.87Å; M623-K626 PolarHBondContact O-N 2.61Å; K626-N628 VanDerWaalsContact C-N 3.34Å; K626-N628 PolarHBondContact O-N 3.47Å; K626-K629 WeakPolarHBondContact O-CB 3.44Å; K626-K629 PolarHBondContact O-N 2.96Å; K626-D630 PolarHBondContact O-N 3.26Å
627	A	71.7	Confident	64.6	Low	55 Å²	55	96.1 Å²	96.1	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-60.8	-39.4	176.3	0	0	0	0	0	112.9	M623 Q624 K629 D630 S631	M623-A627 WeakPolarHBondContact O-CB 3.34Å; M623-A627 PolarHBondContact O-N 3.14Å; Q624-A627 PolarHBondContact O-N 3.16Å; A627-K629 VanDerWaalsContact C-N 3.32Å; A627-D630 PolarHBondContact O-N 2.87Å; A627-S631 PolarHBondContact O-N 3.29Å; A627-S631 PolarHBondContact O-OG 2.88Å
628	N	67.3	Low	61.8	Low	108 Å²	108	97.5 Å²	97.5	58%	0.578	54%	0.544	S	S	*	.	H	α-helix	trans	-71.6	-24.9	174.7	-74.7	-12.1	0	0	0	113.3	Q624 Q625 K626 S631 S632	Q624-N628 WeakPolarHBondContact O-CB 3.43Å; Q624-N628 VanDerWaalsContact O-CG 3.29Å; Q624-N628 PolarHBondContact O-N 3.35Å; Q625-N628 PolarHBondContact O-N 2.9Å; K626-N628 VanDerWaalsContact C-N 3.34Å; K626-N628 PolarHBondContact O-N 3.47Å; N628-S631 WeakPolarHBondContact CA-OG 3.36Å; N628-S631 PolarHBondContact O-OG 3.39Å; N628-S632 WeakPolarHBondContact O-CB 3.43Å; N628-S632 PolarHBondContact O-N 3.47Å; N628-S632 PolarHBondContact O-OG 3.04Å
629	K	63.2	Low	59.2	Low	136 Å²	136	104.2 Å²	104.2	59%	0.591	58%	0.576	S	S	*	*	H	α-helix	trans	-79.1	-30	174.6	-151.7	172.1	-172.3	173.9	0	111.6	Q625 K626 A627 S632	Q625-K629 WeakPolarHBondContact O-CB 3.24Å; Q625-K629 PolarHBondContact O-N 2.97Å; K626-K629 WeakPolarHBondContact O-CB 3.44Å; K626-K629 PolarHBondContact O-N 2.96Å; A627-K629 VanDerWaalsContact C-N 3.32Å; K629-S632 WeakPolarHBondContact CA-OG 3.45Å; K629-S632 PolarHBondContact O-OG 3.21Å
630	D	56.3	Low	56.3	Low	110 Å²	110	107.8 Å²	107.8	59%	0.588	59%	0.594	S	S	*	*	H	α-helix	trans	-79.1	-32.5	173.7	-68	-24.9	0	0	0	111.8	K626 A627 T634	K626-D630 PolarHBondContact O-N 3.26Å; A627-D630 PolarHBondContact O-N 2.87Å; D630-T634 PolarHBondContact O-OG1 3.32Å
631	S	49.8	Very low	53.4	Low	66 Å²	66	112.4 Å²	112.4	46%	0.462	61%	0.614	S	S	.	*	H	α-helix	trans	-74.9	-24.9	173	66.9	0	0	0	0	114.2	A627 N628 K633 T634	A627-S631 PolarHBondContact O-N 3.29Å; A627-S631 PolarHBondContact O-OG 2.88Å; N628-S631 WeakPolarHBondContact CA-OG 3.36Å; N628-S631 PolarHBondContact O-OG 3.39Å; S631-K633 VanDerWaalsContact C-N 3.33Å; S631-T634 PolarHBondContact O-OG1 3.33Å
632	S	45.9	Very low	50.6	Low	87 Å²	87	115.3 Å²	115.3	61%	0.608	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-3.1	175.7	50.5	0	0	0	0	114.4	N628 K629	N628-S632 WeakPolarHBondContact O-CB 3.43Å; N628-S632 PolarHBondContact O-N 3.47Å; N628-S632 PolarHBondContact O-OG 3.04Å; K629-S632 WeakPolarHBondContact CA-OG 3.45Å; K629-S632 PolarHBondContact O-OG 3.21Å
633	K	46.5	Very low	47.8	Very low	177 Å²	177	117.2 Å²	117.2	77%	0.77	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-3.2	172.9	-85.4	-175.3	175.9	-179.4	0	114.2	S631	S631-K633 VanDerWaalsContact C-N 3.33Å
634	T	39.6	Very low	45.3	Very low	107 Å²	107	114.7 Å²	114.7	66%	0.656	66%	0.655	S	S	*	*	S	Bend	trans	-108	7.1	-174.8	16.9	0	0	0	0	116.3	D630 S631	D630-T634 PolarHBondContact O-OG1 3.32Å; S631-T634 PolarHBondContact O-OG1 3.33Å
635	D	32.1	Very low	42.7	Very low	137 Å²	137	115.7 Å²	115.7	73%	0.733	67%	0.669	S	S	*	*			trans	-109.9	79.8	174.6	-81.8	-30.4	0	0	0	113
636	V	32.9	Very low	40.5	Very low	143 Å²	143	120.1 Å²	120.1	87%	0.867	70%	0.695	S	S	*	*			trans	-136.8	109.1	135.5	-178.6	0	0	0	0	107.6
637	P	36.3	Very low	38.2	Very low	105 Å²	105	116.6 Å²	116.6	68%	0.682	70%	0.701	S	S	*	*			trans	-112.5	127.4	158	14.1	5.7	0	0	0	110.7
638	A	28.3	Very low	36	Very low	98 Å²	98	117.7 Å²	117.7	81%	0.81	72%	0.717	S	S	*	*			trans	-67.1	139.2	160.2	0	0	0	0	0	109.7
639	I	31.2	Very low	34	Very low	155 Å²	155	119.1 Å²	119.1	80%	0.795	73%	0.729	S	S	*	*			trans	-66.3	129.7	178.4	-60.1	163.3	0	0	0	110.3
640	T	25.3	Very low	32.2	Very low	116 Å²	116	119.3 Å²	119.3	71%	0.712	74%	0.737	S	S	*	*				179.7	131.8	110.2	19.7	0	0	0	0	113.3
641	E	24.1	Very low	30.7	Very low	173 Å²	173	118 Å²	118	81%	0.808	74%	0.737	S	S	*	*			trans	70.1	132.8	151.9	-62.5	-174.3	175.5	0	0	118.5
642	T	23.3	Very low	29.4	Very low	113 Å²	113	120.3 Å²	120.3	69%	0.693	75%	0.748	S	S	*	*			cis	-171	151.7	6.9	9.6	0	0	0	0	108.3
643	S	24.8	Very low	28.4	Very low	116 Å²	116	124.1 Å²	124.1	81%	0.811	76%	0.756	S	S	*	*			trans	60.4	141.9	149.5	60.4	0	0	0	0	120
644	A	26.8	Very low	27.2	Very low	78 Å²	78	120.7 Å²	120.7	65%	0.645	75%	0.75	S	S	*	*			cis	-176.3	149.5	-6.3	0	0	0	0	0	106.5
645	T	25.8	Very low	26.4	Very low	135 Å²	135	121.3 Å²	121.3	83%	0.828	75%	0.754	S	S	*	*			trans	51.1	142.4	142.5	55.5	0	0	0	0	120.6
646	D	26.4	Very low	26	Very low	158 Å²	158	119.2 Å²	119.2	85%	0.845	76%	0.756	S	S	*	*			cis	176.6	155.5	-0.6	-172.4	15.9	0	0	0	106.8
647	G	24.9	Very low	25.6	Very low	76 Å²	76	116.5 Å²	116.5	78%	0.784	75%	0.748	S	S	*	*			trans	64.2	147.9	160.3	0	0	0	0	0	119.2
648	G	24.4	Very low	24.9	Very low	77 Å²	77	120.1 Å²	120.1	79%	0.794	76%	0.756	S	S	*	*			cis	169.8	152	10.1	0	0	0	0	0	108.7
649	V	26.7	Very low	24.7	Very low	138 Å²	138	119.9 Å²	119.9	84%	0.836	75%	0.754	S	S	*	*			trans	-47.1	141	178.3	179.7	0	0	0	0	114
650	D	24.6	Very low	24.3	Very low	141 Å²	141	117.9 Å²	117.9	75%	0.754	75%	0.754	S	S	*	*				176.1	145	107.3	-136.4	-9.2	0	0	0	116.1
651	S	24.4	Very low	24.3	Very low	83 Å²	83	116.3 Å²	116.3	58%	0.58	75%	0.752	S	S	*	*			trans	64.4	137.2	137.8	72.1	0	0	0	0	124.9
652	T	23.3	Very low	24.3	Very low	113 Å²	113	115.2 Å²	115.2	69%	0.693	75%	0.752	S	S	*	*			trans	86.7	108.9	135.1	37.6	0	0	0	0	122.4
653	Q	24.6	Very low	24.2	Very low	168 Å²	168	114.1 Å²	114.1	79%	0.785	75%	0.749	S	S	*	*				83.1	129.9	110.5	-123.4	176	42.3	0	0	120.5
654	T	22.1	Very low	24.1	Very low	104 Å²	104	115 Å²	115	64%	0.638	75%	0.75	S	S	*	*			trans	80.8	115.9	138.5	20.3	0	0	0	0	121.7
655	T	22.3	Very low	24	Very low	121 Å²	121	118.5 Å²	118.5	74%	0.742	76%	0.758	S	S	*	*				63.3	115.5	128.5	51.9	0	0	0	0	121.5
656	A	23	Very low	24.2	Very low	93 Å²	93	117 Å²	117	77%	0.769	75%	0.75	S	S	*	*				69.7	121.6	115.9	0	0	0	0	0	120.3
657	A	24.4	Very low	24.1	Very low	85 Å²	85	114.6 Å²	114.6	70%	0.702	74%	0.741	S	S	*	*				93.6	127.5	127.6	0	0	0	0	0	119.8
658	Q	23.2	Very low	24	Very low	182 Å²	182	117.3 Å²	117.3	85%	0.85	74%	0.738	S	S	*	*			trans	83.9	112.4	139.2	-77.8	173	-16.9	0	0	119.3
659	A	23.5	Very low	24	Very low	92 Å²	92	119.7 Å²	119.7	76%	0.76	73%	0.733	S	S	*	*				47.5	134.1	115.1	0	0	0	0	0	116
660	S	22.1	Very low	23.8	Very low	114 Å²	114	119.6 Å²	119.6	80%	0.797	73%	0.727	S	S	*	*				178.5	173.7	52.7	45.6	0	0	0	0	108.7
661	A	24.8	Very low	23.7	Very low	83 Å²	83	116.9 Å²	116.9	69%	0.686	72%	0.719	S	S	*	*			trans	-46.9	168.6	171.3	0	0	0	0	0	113.9
662	D	24.6	Very low	23.6	Very low	150 Å²	150	119 Å²	119	80%	0.802	73%	0.729	S	S	*	*			cis	-178.3	175.5	37.5	-149.7	-10.7	0	0	0	109.9
663	S	22.7	Very low	23.5	Very low	90 Å²	90	118.9 Å²	118.9	63%	0.629	73%	0.733	S	S	*	*			trans	84.2	117.5	152.6	82.5	0	0	0	0	118.9
664	T	22.7	Very low	23.5	Very low	135 Å²	135	115.4 Å²	115.4	83%	0.828	73%	0.733	S	S	*	*				170.8	134.3	81.3	28.4	0	0	0	0	109.6
665	D	23.1	Very low	23.5	Very low	151 Å²	151	114.8 Å²	114.8	81%	0.807	74%	0.738	S	S	*	*			trans	-74	162.1	167	-137	9.3	0	0	0	109.7
666	P	31.5	Very low	23.7	Very low	103 Å²	103	115.1 Å²	115.1	67%	0.669	74%	0.742	S	S	*	*				-151	151.7	92.1	38.8	-20.6	0	0	0	116.8
667	T	23.3	Very low	23.7	Very low	108 Å²	108	119.3 Å²	119.3	66%	0.663	75%	0.746	S	S	*	*			trans	51.4	118.6	137.9	60.4	0	0	0	0	119.5
668	D	23.6	Very low	23.7	Very low	133 Å²	133	123.9 Å²	123.9	71%	0.711	76%	0.755	S	S	*	*				164.8	127.7	83.9	-116.9	-27.2	0	0	0	112.5
669	N	22.8	Very low	23.6	Very low	127 Å²	127	119.1 Å²	119.1	68%	0.679	75%	0.747	S	S	*	*			trans	52.1	120.7	135	-81.1	-40.9	0	0	0	124.7
670	N	22.8	Very low	23.8	Very low	136 Å²	136	119.8 Å²	119.8	73%	0.727	74%	0.743	S	S	*	*				84.1	102.1	127.7	-89.4	-25.6	0	0	0	122
671	S	22.6	Very low	23.8	Very low	84 Å²	84	123.1 Å²	123.1	59%	0.587	75%	0.746	S	S	*	*				47.3	123.9	109.9	69.7	0	0	0	0	118.9
672	T	22.3	Very low	23.7	Very low	127 Å²	127	125 Å²	125	78%	0.779	76%	0.755	S	S	*	*				171.1	136.2	94	28.1	0	0	0	0	113.5
673	S	22.3	Very low	23.6	Very low	110 Å²	110	126.4 Å²	126.4	77%	0.769	76%	0.756	S	S	*	*			trans	85.8	128.1	130.8	73.9	0	0	0	0	122.3
674	A	23	Very low	23.6	Very low	95 Å²	95	130.3 Å²	130.3	79%	0.785	76%	0.764	S	S	*	*				104.5	100	129.4	0	0	0	0	0	117.2
675	A	23	Very low	23.6	Very low	91 Å²	91	128.8 Å²	128.8	75%	0.752	76%	0.759	S	S	*	*			trans	-55.6	166.6	144.3	0	0	0	0	0	111
676	P	27.4	Very low	23.6	Very low	129 Å²	129	126.8 Å²	126.8	84%	0.838	76%	0.757	S	S	*	*				-140.4	160.6	92	31.3	-14	0	0	0	115.5
677	Q	22.5	Very low	23.1	Very low	181 Å²	181	127.3 Å²	127.3	85%	0.846	76%	0.764	S	S	*	*			trans	-55.2	152	169.5	-63.2	160	-35.4	0	0	113.2
678	M	23.2	Very low	23.1	Very low	181 Å²	181	132.3 Å²	132.3	89%	0.892	78%	0.776	S	S	*	*				-176.6	127.2	113.1	-98.6	-172.7	66.9	0	0	110.9
679	A	21.7	Very low	23.3	Very low	82 Å²	82	131.4 Å²	131.4	68%	0.678	78%	0.777	S	S	*	*			trans	-75.5	175	164.7	0	0	0	0	0	110
680	P	29	Very low	23.3	Very low	105 Å²	105	132.3 Å²	132.3	68%	0.682	79%	0.788	S	S	*	*				-146.1	160.5	59.7	33.5	-10.4	0	0	0	117.8
681	E	22	Very low	23.6	Very low	185 Å²	185	131 Å²	131	86%	0.864	78%	0.784	S	S	*	*			trans	59.3	113.7	135.3	-66.9	164.8	-167.7	0	0	121.7
682	S	22.6	Very low	23.7	Very low	123 Å²	123	134.4 Å²	134.4	86%	0.86	80%	0.796	S	S	*	*				-171.3	148.6	110.4	58.7	0	0	0	0	111.5
683	E	22.5	Very low	24	Very low	179 Å²	179	131.1 Å²	131.1	84%	0.836	79%	0.788	S	S	*	*			trans	-74.1	154.3	-159.3	-68.5	164.5	148.4	0	0	117.7
684	E	22.5	Very low	24.2	Very low	171 Å²	171	132.3 Å²	132.3	80%	0.799	79%	0.793	S	S	*	*			trans	51.3	123.3	134.2	-66.4	-170.1	155.2	0	0	124.6
685	S	21.9	Very low	24.5	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	80%	0.795	S	S	*	*				96.6	114.6	123	73.1	0	0	0	0	121.5
686	S	22.5	Very low	24.6	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	80%	0.799	S	S	*	*			trans	55.1	120.6	131.9	63.6	0	0	0	0	122.1
687	S	21.8	Very low	24.9	Very low	115 Å²	115	137 Å²	137	80%	0.804	80%	0.796	S	S	*	*				175.4	123.6	106.5	45.9	0	0	0	0	111.2
688	K	22.9	Very low	25.2	Very low	213 Å²	213	135.6 Å²	135.6	93%	0.926	80%	0.8	S	S	*	*			trans	-134.5	121.6	164.7	-88.3	-173.3	177.9	-179.9	0	107.2
689	P	27.3	Very low	25.3	Very low	114 Å²	114	130.3 Å²	130.3	74%	0.74	79%	0.792	S	S	*	*			trans	-111.1	137.4	157	33.9	-23.1	0	0	0	110.1
690	T	24	Very low	25.5	Very low	145 Å²	145	132.8 Å²	132.8	89%	0.89	80%	0.799	S	S	*	*			trans	-147.9	86.9	155.8	47.4	0	0	0	0	109.9
691	T	29.2	Very low	25.4	Very low	108 Å²	108	135.8 Å²	135.8	66%	0.663	80%	0.804	S	S	*	*			trans	-76	152.3	131.8	39	0	0	0	0	108.5
692	N	25.4	Very low	25.7	Very low	156 Å²	156	134.3 Å²	134.3	83%	0.834	80%	0.802	S	S	*	*				176	127.8	128.6	-86.8	-16.6	0	0	0	113.3
693	G	27.1	Very low	25.9	Very low	58 Å²	58	132.1 Å²	132.1	60%	0.598	80%	0.798	S	S	*	*			trans	-71	177.6	152.3	0	0	0	0	0	111.9
694	P	27.9	Very low	26.4	Very low	136 Å²	136	133.4 Å²	133.4	88%	0.883	81%	0.805	S	S	*	*			trans	-83.7	130.3	-164.9	32.7	-31.2	0	0	0	111.7
695	V	27.6	Very low	26.5	Very low	135 Å²	135	131.3 Å²	131.3	82%	0.818	81%	0.807	S	S	*	*			trans	-121.9	131.8	169.5	-179.4	0	0	0	0	108.8
696	D	26.4	Very low	26.8	Very low	160 Å²	160	137 Å²	137	86%	0.856	81%	0.813	S	S	*	*			trans	-63.1	143.9	173	-95.9	-31.9	0	0	0	112.5
697	P	34	Very low	27.2	Very low	118 Å²	118	134.7 Å²	134.7	77%	0.766	80%	0.797	S	S	*	*			trans	-113.4	125.6	169.2	35	-22.4	0	0	0	113
698	T	28.3	Very low	28	Very low	151 Å²	151	135 Å²	135	93%	0.926	80%	0.796	S	S	*	*			trans	-129.1	127.9	152.8	48.6	0	0	0	0	109.7
699	G	24.6	Very low	28.9	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	78%	0.783	S	S	*	*			trans	119.3	90.3	164	0	0	0	0	0	118.5
700	T	26.9	Very low	29.6	Very low	135 Å²	135	130.2 Å²	130.2	83%	0.828	77%	0.771	S	S	*	*			trans	24	133.6	140.7	32.4	0	0	0	0	120.8
701	Q	26.9	Very low	31.2	Very low	167 Å²	167	126.6 Å²	126.6	78%	0.78	75%	0.746	S	S	*	*			cis	-170.6	145	46.6	-117.9	170	39.4	0	0	113
702	N	28.2	Very low	32.9	Very low	155 Å²	155	125.9 Å²	125.9	83%	0.829	74%	0.743	S	S	*	*			trans	58.6	108.6	147.8	-64.7	-9	0	0	0	123.7
703	G	25.5	Very low	34.8	Very low	76 Å²	76	124.6 Å²	124.6	78%	0.784	73%	0.73	S	S	*	*			trans	167.3	101.7	157.3	0	0	0	0	0	111.6	C705	G703-C705 PolarHBondContact O-N 2.8Å
704	E	33	Very low	36.9	Very low	207 Å²	207	123.4 Å²	123.4	97%	0.967	71%	0.713	S	S	*	*			trans	-62	109.7	-169.4	-68.3	178.5	145.8	0	0	114.2
705	C	25.5	Very low	39.2	Very low	127 Å²	127	124.1 Å²	124.1	86%	0.858	70%	0.698	S	S	*	*			trans	-145.9	107	157.3	-129.8	0	0	0	0	108	G703 S707	G703-C705 PolarHBondContact O-N 2.8Å; C705-S707 PolarHBondContact O-N 3.32Å
706	R	28	Very low	41.7	Very low	222 Å²	222	122.8 Å²	122.8	84%	0.838	68%	0.683	S	S	*	*			trans	-63.2	124.2	-171.9	-75.8	-170.8	165.7	151.4	-0.7	112.2	E710	R706-E710 WeakPolarHBondContact CD-OE2 3.33Å; R706-E710 VanDerWaalsContact CG-OE2 3.23Å; R706-E710 WeakPolarHBondContact CG-OE2 3.24Å; R706-E710 IonicContact NE-OE2 3.88Å; R706-E710 PolarHBondContact NE-OE2 3.23Å
707	S	31.5	Very low	44.5	Very low	61 Å²	61	115.3 Å²	115.3	43%	0.427	64%	0.643	S	S	.	*			trans	-73.7	155	175.2	70	0	0	0	0	112.4	C705 L709 E710	C705-S707 PolarHBondContact O-N 3.32Å; S707-L709 PolarHBondContact O-N 2.85Å; S707-E710 PolarHBondContact O-N 3.48Å
708	P	38.7	Very low	46.8	Very low	122 Å²	122	111.7 Å²	111.7	79%	0.792	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-3	-179	-17.9	30.8	0	0	0	115.3
709	L	40.8	Very low	49.6	Very low	122 Å²	122	106.6 Å²	106.6	64%	0.639	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	4.1	-177.2	-75	163.3	0	0	0	113.7	S707 R715	S707-L709 PolarHBondContact O-N 2.85Å; L709-R715 VanDerWaalsContact O-CZ 3.24Å; L709-R715 PolarHBondContact O-NE 3.47Å; L709-R715 PolarHBondContact O-NH2 2.92Å
710	E	41.7	Very low	52.5	Low	104 Å²	104	106.2 Å²	106.2	49%	0.486	57%	0.566	S	S	.	*			trans	-91.1	-7.2	179.7	-72.9	-176.2	-175.7	0	0	114.7	R706 S707 P712	R706-E710 WeakPolarHBondContact CD-OE2 3.33Å; R706-E710 VanDerWaalsContact CG-OE2 3.23Å; R706-E710 WeakPolarHBondContact CG-OE2 3.24Å; R706-E710 IonicContact NE-OE2 3.88Å; R706-E710 PolarHBondContact NE-OE2 3.23Å; S707-E710 PolarHBondContact O-N 3.48Å; E710-P712 VanDerWaalsContact O-CD 3.28Å; E710-P712 WeakPolarHBondContact O-CD 3.28Å
711	D	58.7	Low	55.3	Low	68 Å²	68	99.8 Å²	99.8	36%	0.364	53%	0.527	S	S	.	.			trans	-81.6	114.7	174.6	-168.3	-13.3	0	0	0	110.1	K713 S714 R715	D711-K713 PolarHBondContact O-N 2.94Å; D711-K713 VanDerWaalsContact O-N 3.09Å; D711-K713 PolarHBondContact OD1-N 3.35Å; D711-K713 VanDerWaalsContact OD1-N 3.16Å; D711-S714 PolarHBondContact O-N 2.91Å; D711-S714 VanDerWaalsContact O-N 3.09Å; D711-R715 PolarHBondContact O-N 2.95Å
712	P	63.2	Low	58.1	Low	94 Å²	94	91.9 Å²	91.9	61%	0.61	49%	0.49	S	S	*	.	H	α-helix	trans	-57.8	-24.9	180	20.6	-31.4	0	0	0	113.1	E710 E716	E710-P712 VanDerWaalsContact O-CD 3.28Å; E710-P712 WeakPolarHBondContact O-CD 3.28Å; P712-E716 PolarHBondContact O-N 3.47Å
713	K	66.9	Low	60.7	Low	129 Å²	129	92.2 Å²	92.2	56%	0.561	48%	0.48	S	S	*	.	H	α-helix	trans	-75.7	-31.5	178.7	-65.5	-179.4	177.8	-178.5	0	113.3	Q625 D711 E716 V717	Q625-K713 PolarHBondContact NE2-O 3.32Å; D711-K713 PolarHBondContact O-N 2.94Å; D711-K713 VanDerWaalsContact O-N 3.09Å; D711-K713 PolarHBondContact OD1-N 3.35Å; D711-K713 VanDerWaalsContact OD1-N 3.16Å; K713-E716 PolarHBondContact O-N 2.88Å; K713-V717 WeakPolarHBondContact O-CG2 3.29Å; K713-V717 PolarHBondContact O-N 3.1Å; K713-V717 VanDerWaalsContact O-N 3.16Å
714	S	70.1	Confident	63.5	Low	33 Å²	33	91.2 Å²	91.2	23%	0.231	46%	0.464	C	S	.	.	H	α-helix	trans	-70.2	-37.2	174.5	-52.8	0	0	0	0	111.1	D711 E716 V717 V718	D711-S714 PolarHBondContact O-N 2.91Å; D711-S714 VanDerWaalsContact O-N 3.09Å; S714-E716 VanDerWaalsContact C-N 3.3Å; S714-E716 PolarHBondContact O-N 2.77Å; S714-V717 PolarHBondContact O-N 3.11Å; S714-V718 WeakPolarHBondContact O-CG2 3.49Å; S714-V718 PolarHBondContact O-N 3.49Å; S714-V718 VanDerWaalsContact O-N 3.12Å
715	R	76.3	Confident	66	Low	151 Å²	151	81.5 Å²	81.5	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-63.8	-37.5	173.2	-66.7	-176.5	-177.6	178.4	-1	111.8	L709 D711 V718 L719	L709-R715 VanDerWaalsContact O-CZ 3.24Å; L709-R715 PolarHBondContact O-NE 3.47Å; L709-R715 PolarHBondContact O-NH2 2.92Å; D711-R715 PolarHBondContact O-N 2.95Å; R715-V718 PolarHBondContact O-N 2.96Å; R715-L719 VanDerWaalsContact O-CB 3.27Å; R715-L719 WeakPolarHBondContact O-CB 3.39Å; R715-L719 PolarHBondContact O-N 2.91Å
716	E	81.1	Confident	68.8	Low	107 Å²	107	76.9 Å²	76.9	50%	0.5	39%	0.393	S	S	.	.	H	α-helix	trans	-66.1	-38.4	175.9	-167.9	177.7	-176	0	0	112.4	P712 K713 S714 L719 N720	P712-E716 PolarHBondContact O-N 3.47Å; K713-E716 PolarHBondContact O-N 2.88Å; S714-E716 VanDerWaalsContact C-N 3.3Å; S714-E716 PolarHBondContact O-N 2.77Å; E716-L719 PolarHBondContact O-N 2.91Å; E716-N720 WeakPolarHBondContact O-CB 3.3Å; E716-N720 PolarHBondContact O-N 2.85Å; E716-N720 PolarHBondContact O-ND2 3.38Å
717	V	83.6	Confident	71.6	Confident	3 Å²	3	67 Å²	67	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-61.4	-48.7	173.2	171	0	0	0	0	111.3	A618 Q621 L622 K713 S714 L719 N720 A721	A618-V717 HydrophobicContact CB-CG1 4.49Å; Q621-V717 HydrophobicContact CB-CB 4.47Å; Q621-V717 HydrophobicContact CB-CG1 3.7Å; Q621-V717 HydrophobicContact CB-CG2 4.08Å; Q621-V717 PolarHBondContact OE1-O 3.43Å; L622-V717 HydrophobicContact CD2-CG1 4.43Å; L622-V717 HydrophobicContact CD2-CG2 4.5Å; L622-V717 HydrophobicContact CG-CG1 4.17Å; K713-V717 WeakPolarHBondContact O-CG2 3.29Å; K713-V717 PolarHBondContact O-N 3.1Å; K713-V717 VanDerWaalsContact O-N 3.16Å; S714-V717 PolarHBondContact O-N 3.11Å; V717-L719 VanDerWaalsContact C-N 3.34Å; V717-L719 PolarHBondContact O-N 3.38Å; V717-N720 PolarHBondContact O-N 3.35Å; V717-A721 WeakPolarHBondContact O-CB 3.46Å; V717-A721 PolarHBondContact O-N 3.15Å
718	V	84.1	Confident	74.1	Confident	42 Å²	42	67 Å²	67	26%	0.255	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-42.8	178.6	175.8	0	0	0	0	110.6	F614 S714 R715 N720 A721 C722	F614-V718 HydrophobicContact CE2-CG1 4.5Å; F614-V718 HydrophobicContact CZ-CG1 4.36Å; S714-V718 WeakPolarHBondContact O-CG2 3.49Å; S714-V718 PolarHBondContact O-N 3.49Å; S714-V718 VanDerWaalsContact O-N 3.12Å; R715-V718 PolarHBondContact O-N 2.96Å; V718-N720 PolarHBondContact O-N 3.06Å; V718-A721 PolarHBondContact O-N 2.98Å; V718-C722 VanDerWaalsContact O-CB 3.29Å; V718-C722 WeakPolarHBondContact O-CB 3.48Å; V718-C722 PolarHBondContact O-N 3.13Å; V718-C722 PolarHBondContact O-SG 3.36Å; V718-C722 VanDerWaalsContact O-SG 3.34Å
719	L	85.9	Confident	76.3	Confident	44 Å²	44	62.3 Å²	62.3	23%	0.23	32%	0.323	C	S	.	.	H	α-helix	trans	-58.6	-46.9	175.7	179.7	71	0	0	0	111.9	R715 E716 V717 C722 R723 N730	R715-L719 VanDerWaalsContact O-CB 3.27Å; R715-L719 WeakPolarHBondContact O-CB 3.39Å; R715-L719 PolarHBondContact O-N 2.91Å; E716-L719 PolarHBondContact O-N 2.91Å; V717-L719 VanDerWaalsContact C-N 3.34Å; V717-L719 PolarHBondContact O-N 3.38Å; L719-C722 PolarHBondContact O-N 2.71Å; L719-R723 WeakPolarHBondContact O-CB 3.34Å; L719-R723 WeakPolarHBondContact O-CG 3.45Å; L719-R723 PolarHBondContact O-N 3.1Å; L719-N730 HydrophobicContact CD1-CB 3.54Å; L719-N730 WeakPolarHBondContact CD1-OD1 3.35Å
720	N	84.9	Confident	78.4	Confident	61 Å²	61	60.8 Å²	60.8	33%	0.326	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-40.9	179.8	-72	-24.3	0	0	0	111.6	E716 V717 V718 R723 A724	E716-N720 WeakPolarHBondContact O-CB 3.3Å; E716-N720 PolarHBondContact O-N 2.85Å; E716-N720 PolarHBondContact O-ND2 3.38Å; V717-N720 PolarHBondContact O-N 3.35Å; V718-N720 PolarHBondContact O-N 3.06Å; N720-R723 PolarHBondContact O-N 3.29Å; N720-A724 WeakPolarHBondContact O-CB 3.3Å; N720-A724 PolarHBondContact O-N 2.94Å
721	A	85.9	Confident	80.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64.6	-44.9	174.7	0	0	0	0	0	111.6	F614 M617 A618 V717 V718 R723 A724 V725	F614-A721 HydrophobicContact CD2-CB 3.62Å; F614-A721 HydrophobicContact CE2-CB 3.63Å; M617-A721 HydrophobicContact CB-CB 4.43Å; A618-A721 HydrophobicContact CB-CB 4.35Å; V717-A721 WeakPolarHBondContact O-CB 3.46Å; V717-A721 PolarHBondContact O-N 3.15Å; V718-A721 PolarHBondContact O-N 2.98Å; A721-R723 PolarHBondContact O-N 2.85Å; A721-A724 PolarHBondContact O-N 3.24Å; A721-V725 WeakPolarHBondContact O-CG2 3.43Å; A721-V725 PolarHBondContact O-N 2.93Å; A721-V725 VanDerWaalsContact O-N 3.1Å
722	C	85.4	Confident	81.7	Confident	1 Å²	1	61 Å²	61	1%	0.007	33%	0.329	C	S	.	.	H	α-helix	trans	-58.9	-45.5	175.4	-79.5	0	0	0	0	111.9	V718 L719 V725 G726 S727 S729 S732	V718-C722 VanDerWaalsContact O-CB 3.29Å; V718-C722 WeakPolarHBondContact O-CB 3.48Å; V718-C722 PolarHBondContact O-N 3.13Å; V718-C722 PolarHBondContact O-SG 3.36Å; V718-C722 VanDerWaalsContact O-SG 3.34Å; L719-C722 PolarHBondContact O-N 2.71Å; C722-V725 PolarHBondContact O-N 3.41Å; C722-G726 PolarHBondContact O-N 3.31Å; C722-S727 WeakPolarHBondContact O-CB 3.49Å; C722-S727 PolarHBondContact O-N 3.24Å; C722-S729 WeakPolarHBondContact CB-O 3.38Å; C722-S729 PolarHBondContact SG-O 3.48Å; C722-S732 PolarHBondContact SG-O 3.48Å; C722-S732 VanDerWaalsContact SG-O 3.41Å
723	R	84.3	Confident	83	Confident	162 Å²	162	58.8 Å²	58.8	61%	0.611	31%	0.31	S	S	*	.	H	α-helix	trans	-62.7	-43	176	-76.3	178.5	-179.7	177.7	-0.8	112.2	L719 N720 A721 V725 G726	L719-R723 WeakPolarHBondContact O-CB 3.34Å; L719-R723 WeakPolarHBondContact O-CG 3.45Å; L719-R723 PolarHBondContact O-N 3.1Å; N720-R723 PolarHBondContact O-N 3.29Å; A721-R723 PolarHBondContact O-N 2.85Å; R723-V725 VanDerWaalsContact C-N 3.31Å; R723-V725 PolarHBondContact O-N 3.25Å; R723-G726 PolarHBondContact O-N 3.13Å
724	A	83.5	Confident	84.2	Confident	56 Å²	56	53.8 Å²	53.8	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-65	-33.6	-179	0	0	0	0	0	113	M617 N720 A721	M617-A724 HydrophobicContact CE-CB 4.28Å; M617-A724 HydrophobicContact SD-CB 3.53Å; M617-A724 VanDerWaalsContact SD-CB 3.53Å; N720-A724 WeakPolarHBondContact O-CB 3.3Å; N720-A724 PolarHBondContact O-N 2.94Å; A721-A724 PolarHBondContact O-N 3.24Å
725	V	85.2	Confident	85.3	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.012	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	6.3	177.7	-55.1	0	0	0	0	113.8	R610 L613 F614 M617 A721 C722 R723 S727 F733	R610-V725 PolarHBondContact NE-O 2.7Å; R610-V725 PolarHBondContact NH2-O 3Å; L613-V725 HydrophobicContact CB-CG1 4.27Å; F614-V725 HydrophobicContact CB-CG1 3.87Å; F614-V725 HydrophobicContact CB-CG2 4.18Å; F614-V725 HydrophobicContact CD2-CG2 4.25Å; M617-V725 HydrophobicContact SD-CG1 4.45Å; A721-V725 WeakPolarHBondContact O-CG2 3.43Å; A721-V725 PolarHBondContact O-N 2.93Å; A721-V725 VanDerWaalsContact O-N 3.1Å; C722-V725 PolarHBondContact O-N 3.41Å; R723-V725 VanDerWaalsContact C-N 3.31Å; R723-V725 PolarHBondContact O-N 3.25Å; V725-S727 VanDerWaalsContact C-N 3.33Å; V725-S727 PolarHBondContact O-N 3.15Å; V725-F733 HydrophobicContact CG2-CD2 4.01Å; V725-F733 HydrophobicContact CG2-CE2 4.05Å
726	G	83.8	Confident	86.1	Confident	30 Å²	30	46.9 Å²	46.9	31%	0.309	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	34.2	178.8	0	0	0	0	0	113.5	C722 R723	C722-G726 PolarHBondContact O-N 3.31Å; R723-G726 PolarHBondContact O-N 3.13Å
727	S	88.1	Confident	86.8	Confident	16 Å²	16	42 Å²	42	11%	0.112	24%	0.235	C	C	.	.			trans	-70.6	144.7	175.1	-172.5	0	0	0	0	111.4	C722 V725 S729 S732 D734	C722-S727 WeakPolarHBondContact O-CB 3.49Å; C722-S727 PolarHBondContact O-N 3.24Å; V725-S727 VanDerWaalsContact C-N 3.33Å; V725-S727 PolarHBondContact O-N 3.15Å; S727-S729 VanDerWaalsContact C-N 3.35Å; S727-S729 PolarHBondContact OG-N 2.87Å; S727-S729 PolarHBondContact OG-O 2.94Å; S727-S732 PolarHBondContact OG-O 3.26Å; S727-D734 CarbonylContact C-O 3.59Å; S727-D734 VanDerWaalsContact CA-O 3.27Å; S727-D734 WeakPolarHBondContact CA-O 3.44Å; S727-D734 WeakPolarHBondContact CB-O 3.45Å; S727-D734 PolarHBondContact OG-N 3.08Å; S727-D734 PolarHBondContact OG-O 3.39Å
728	I	84.7	Confident	87.2	Confident	59 Å²	59	42.2 Å²	42.2	30%	0.303	24%	0.236	S	C	.	.	S	Bend	trans	-73.4	-31.6	174.8	-54.7	166.6	0	0	0	110.5	Q525 D734 R736	Q525-I728 HydrophobicContact CG-CD1 3.91Å; I728-D734 PolarHBondContact N-O 3.49Å; I728-R736 HydrophobicContact CD1-CB 3.61Å; I728-R736 HydrophobicContact CD1-CG 4.29Å
729	S	84.6	Confident	87.5	Confident	25 Å²	25	40.2 Å²	40.2	18%	0.175	22%	0.224	C	C	.	.			trans	-92.9	138.2	177.8	173.1	0	0	0	0	111.4	C722 S727 T731 S732	C722-S729 WeakPolarHBondContact CB-O 3.38Å; C722-S729 PolarHBondContact SG-O 3.48Å; S727-S729 VanDerWaalsContact C-N 3.35Å; S727-S729 PolarHBondContact OG-N 2.87Å; S727-S729 PolarHBondContact OG-O 2.94Å; S729-T731 VanDerWaalsContact C-N 3.3Å; S729-T731 PolarHBondContact OG-N 3.5Å; S729-T731 VanDerWaalsContact OG-N 3.16Å; S729-T731 PolarHBondContact OG-OG1 3.24Å; S729-T731 VanDerWaalsContact OG-OG1 3.1Å; S729-S732 VanDerWaalsContact CB-O 3.29Å; S729-S732 WeakPolarHBondContact CB-O 3.21Å; S729-S732 PolarHBondContact OG-N 2.99Å; S729-S732 PolarHBondContact OG-O 2.86Å; S729-S732 PolarHBondContact OG-OG 3.31Å; S729-S732 VanDerWaalsContact OG-OG 3.06Å
730	N	84.7	Confident	87.7	Confident	90 Å²	90	38.2 Å²	38.2	48%	0.481	21%	0.214	S	C	.	.	S	Bend	trans	-84	-6.3	174.5	-74.5	-36.3	0	0	0	113.3	L719	L719-N730 HydrophobicContact CD1-CB 3.54Å; L719-N730 WeakPolarHBondContact CD1-OD1 3.35Å
731	T	83.4	Confident	88	Confident	118 Å²	118	35.4 Å²	35.4	72%	0.724	20%	0.199	S	C	*	.	S	Bend	trans	-120.6	-18.2	-170.6	58.9	0	0	0	0	113.4	S729	S729-T731 VanDerWaalsContact C-N 3.3Å; S729-T731 PolarHBondContact OG-N 3.5Å; S729-T731 VanDerWaalsContact OG-N 3.16Å; S729-T731 PolarHBondContact OG-OG1 3.24Å; S729-T731 VanDerWaalsContact OG-OG1 3.1Å
732	S	86.7	Confident	88.1	Confident	59 Å²	59	37 Å²	37	41%	0.413	21%	0.206	S	C	.	.	S	Bend	trans	-149.7	156.4	-176.1	62.8	0	0	0	0	110	C722 S727 S729 D734	C722-S732 PolarHBondContact SG-O 3.48Å; C722-S732 VanDerWaalsContact SG-O 3.41Å; S727-S732 PolarHBondContact OG-O 3.26Å; S729-S732 VanDerWaalsContact CB-O 3.29Å; S729-S732 WeakPolarHBondContact CB-O 3.21Å; S729-S732 PolarHBondContact OG-N 2.99Å; S729-S732 PolarHBondContact OG-O 2.86Å; S729-S732 PolarHBondContact OG-OG 3.31Å; S729-S732 VanDerWaalsContact OG-OG 3.06Å; S732-D734 PolarHBondContact O-N 3.49Å
733	F	90.8	Very high	88	Confident	46 Å²	46	37.4 Å²	37.4	20%	0.202	21%	0.209	C	C	.	.			trans	-70	116.1	171	178.7	-92.7	0	0	0	110.3	V607 R610 Y611 F614 V725 I735	V607-F733 HydrophobicContact CG1-CE1 3.78Å; V607-F733 HydrophobicContact CG1-CZ 3.99Å; V607-F733 WeakPolarHBondContact O-CZ 3.32Å; R610-F733 HydrophobicContact CB-CE2 4.05Å; R610-F733 HydrophobicContact CB-CZ 4.14Å; Y611-F733 HydrophobicContact CD2-CB 4.3Å; Y611-F733 AromaticContact CD2-CD1 3.67Å; Y611-F733 HydrophobicContact CD2-CD1 3.67Å; Y611-F733 HydrophobicContact CD2-CD2 4.3Å; Y611-F733 HydrophobicContact CD2-CE1 4.01Å; Y611-F733 AromaticContact CD2-CG 3.83Å; Y611-F733 HydrophobicContact CD2-CG 3.83Å; Y611-F733 HydrophobicContact CD2-CZ 4.46Å; Y611-F733 HydrophobicContact CG-CD1 4.44Å; Y611-F733 HydrophobicContact CG-CE1 4.34Å; F614-F733 HydrophobicContact CB-CD2 3.89Å; F614-F733 HydrophobicContact CB-CE2 4.32Å; F614-F733 HydrophobicContact CD1-CB 4.16Å; F614-F733 HydrophobicContact CD1-CD2 4.39Å; F614-F733 HydrophobicContact CD2-CD2 4.42Å; F614-F733 HydrophobicContact CE1-CB 4.22Å; F614-F733 HydrophobicContact CG-CB 4.4Å; F614-F733 AromaticContact CG-CD2 3.98Å; F614-F733 HydrophobicContact CG-CD2 3.98Å; F614-F733 HydrophobicContact CZ-CB 4.5Å; V725-F733 HydrophobicContact CG2-CD2 4.01Å; V725-F733 HydrophobicContact CG2-CE2 4.05Å; F733-I735 HydrophobicContact CE2-CD1 3.6Å; F733-I735 HydrophobicContact CE2-CG1 3.96Å; F733-I735 HydrophobicContact CZ-CB 4.49Å; F733-I735 HydrophobicContact CZ-CD1 3.61Å; F733-I735 HydrophobicContact CZ-CG1 3.88Å
734	D	90.8	Very high	87.6	Confident	24 Å²	24	32 Å²	32	13%	0.128	19%	0.194	C	C	.	.			trans	-148	116.2	174	-176.4	12.5	0	0	0	109.7	S727 I728 S732 R736	S727-D734 CarbonylContact C-O 3.59Å; S727-D734 VanDerWaalsContact CA-O 3.27Å; S727-D734 WeakPolarHBondContact CA-O 3.44Å; S727-D734 WeakPolarHBondContact CB-O 3.45Å; S727-D734 PolarHBondContact OG-N 3.08Å; S727-D734 PolarHBondContact OG-O 3.39Å; I728-D734 PolarHBondContact N-O 3.49Å; S732-D734 PolarHBondContact O-N 3.49Å; D734-R736 IonicContact OD1-NE 3.39Å; D734-R736 PolarHBondContact OD1-NE 3.03Å; D734-R736 IonicContact OD2-CZ 2.64Å; D734-R736 VanDerWaalsContact OD2-CZ 3.28Å; D734-R736 IonicContact OD2-NE 2.63Å; D734-R736 PolarHBondContact OD2-NE 3.21Å; D734-R736 VanDerWaalsContact OD2-NE 3.07Å; D734-R736 IonicContact OD2-NH2 3.96Å; D734-R736 PolarHBondContact OD2-NH2 3.07Å
735	I	93.5	Very high	87.2	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	20%	0.202	C	C	.	.			trans	-123	120.6	176.3	-64.4	-176.3	0	0	0	107.8	V607 R610 F733 F737 L762	V607-I735 HydrophobicContact CG2-CB 4.16Å; V607-I735 HydrophobicContact CG2-CG2 3.96Å; R610-I735 HydrophobicContact CB-CD1 3.44Å; R610-I735 VanDerWaalsContact CB-CD1 3.44Å; R610-I735 HydrophobicContact CG-CD1 3.85Å; F733-I735 HydrophobicContact CE2-CD1 3.6Å; F733-I735 HydrophobicContact CE2-CG1 3.96Å; F733-I735 HydrophobicContact CZ-CB 4.49Å; F733-I735 HydrophobicContact CZ-CD1 3.61Å; F733-I735 HydrophobicContact CZ-CG1 3.88Å; I735-F737 HydrophobicContact CG2-CE2 4.18Å; I735-L762 HydrophobicContact CG2-CD1 4.22Å; I735-L762 HydrophobicContact CG2-CD2 3.92Å
736	R	93.7	Very high	87.3	Confident	38 Å²	38	33.4 Å²	33.4	14%	0.143	21%	0.21	C	C	.	.			trans	-137.7	155.8	174.2	-60.8	177.4	-92.1	163.3	3	108.7	S519 K523 Q525 I728 D734 Q759	S519-R736 VanDerWaalsContact OG-CD 3.27Å; S519-R736 WeakPolarHBondContact OG-CD 3.49Å; S519-R736 PolarHBondContact OG-NH1 2.94Å; K523-R736 CarbonylContact O-C 3.58Å; K523-R736 WeakPolarHBondContact O-CA 3.36Å; Q525-R736 HydrophobicContact CB-CB 3.91Å; Q525-R736 HydrophobicContact CG-CB 4.44Å; I728-R736 HydrophobicContact CD1-CB 3.61Å; I728-R736 HydrophobicContact CD1-CG 4.29Å; D734-R736 IonicContact OD1-NE 3.39Å; D734-R736 PolarHBondContact OD1-NE 3.03Å; D734-R736 IonicContact OD2-CZ 2.64Å; D734-R736 VanDerWaalsContact OD2-CZ 3.28Å; D734-R736 IonicContact OD2-NE 2.63Å; D734-R736 PolarHBondContact OD2-NE 3.21Å; D734-R736 VanDerWaalsContact OD2-NE 3.07Å; D734-R736 IonicContact OD2-NH2 3.96Å; D734-R736 PolarHBondContact OD2-NH2 3.07Å; R736-Q759 PolarHBondContact O-NE2 2.74Å; R736-Q759 PolarHBondContact O-OE1 3.2Å
737	F	94.6	Very high	87.5	Confident	4 Å²	4	37 Å²	37	2%	0.018	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-111.2	132.8	-177.2	-68.8	-92.5	0	0	0	110.2	K523 V524 Q525 P565 I603 F606 I735 P739 L762 L763 A766	K523-F737 PolarHBondContact O-N 3.07Å; V524-F737 CarbonylContact C-O 3.56Å; V524-F737 WeakPolarHBondContact CA-O 3.3Å; Q525-F737 PolarHBondContact N-O 2.99Å; P565-F737 HydrophobicContact CB-CB 4.22Å; P565-F737 HydrophobicContact CB-CD1 4.43Å; P565-F737 HydrophobicContact CG-CB 3.91Å; P565-F737 HydrophobicContact CG-CD1 4.03Å; P565-F737 HydrophobicContact CG-CG 3.93Å; I603-F737 HydrophobicContact CG2-CD2 4Å; I603-F737 HydrophobicContact CG2-CE2 3.81Å; F606-F737 HydrophobicContact CD1-CE2 4.39Å; F606-F737 AromaticContact CD1-CZ 3.79Å; F606-F737 HydrophobicContact CD1-CZ 3.79Å; F606-F737 AromaticContact CE1-CZ 3.85Å; F606-F737 HydrophobicContact CE1-CZ 3.85Å; I735-F737 HydrophobicContact CG2-CE2 4.18Å; F737-P739 WeakPolarHBondContact O-CD 2.88Å; F737-L762 HydrophobicContact CD1-CD2 4.14Å; F737-L762 HydrophobicContact CD1-CG 4.4Å; F737-L762 HydrophobicContact CE1-CD2 3.91Å; F737-L762 HydrophobicContact CE1-CG 3.77Å; F737-L762 HydrophobicContact CZ-CD2 4.19Å; F737-L762 HydrophobicContact CZ-CG 4.12Å; F737-L763 HydrophobicContact CD1-CD1 4.28Å; F737-L763 HydrophobicContact CE1-CD1 4.36Å; F737-A766 HydrophobicContact CE1-CB 4.13Å; F737-A766 HydrophobicContact CZ-CB 4.15Å
738	N	93.2	Very high	87.6	Confident	7 Å²	7	38 Å²	38	4%	0.037	22%	0.216	C	C	.	.			trans	-77.1	114.4	164.5	175.3	-9.2	0	0	0	109	Q525 H527 D740 I741 Q759	Q525-N738 HydrophobicContact CB-CB 4.4Å; H527-N738 WeakPolarHBondContact CB-ND2 3.43Å; H527-N738 PolarHBondContact CE1-OD1 3.26Å; H527-N738 VanDerWaalsContact CG-CG 3.48Å; H527-N738 VanDerWaalsContact CG-ND2 3.32Å; H527-N738 PolarHBondContact ND1-OD1 2.99Å; N738-D740 PolarHBondContact O-N 3.43Å; N738-D740 PolarHBondContact OD1-N 2.85Å; N738-I741 HydrophobicContact CB-CD1 4.32Å; N738-I741 HydrophobicContact CB-CG1 3.63Å; N738-I741 WeakPolarHBondContact O-CG1 3.49Å; N738-I741 PolarHBondContact O-N 3.5Å; N738-Q759 HydrophobicContact CB-CG 4.36Å
739	P	90.6	Very high	87.9	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.006	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-19	-175	28.6	-34.8	0	0	0	113.4	V524 R562 F737	V524-P739 HydrophobicContact CG1-CG 4.12Å; R562-P739 VanDerWaalsContact O-CB 3.32Å; R562-P739 WeakPolarHBondContact O-CB 3.43Å; F737-P739 WeakPolarHBondContact O-CD 2.88Å
740	D	90.3	Very high	88.1	Confident	1 Å²	1	41 Å²	41	1%	0.005	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	2.6	-176.7	-64.5	-47.1	0	0	0	114	H527 S542 V543 N738 F742 S743 V746 F748	H527-D740 IonicContact CE1-OD2 2.8Å; H527-D740 PolarHBondContact CE1-OD2 2.78Å; H527-D740 IonicContact NE2-OD2 2.92Å; H527-D740 PolarHBondContact NE2-OD2 2.59Å; S542-D740 WeakPolarHBondContact CA-OD1 3.38Å; S542-D740 VanDerWaalsContact CA-OD2 3.25Å; S542-D740 WeakPolarHBondContact CA-OD2 3.48Å; S542-D740 WeakPolarHBondContact CB-OD1 3.48Å; S542-D740 PolarHBondContact OG-OD1 3.5Å; V543-D740 WeakPolarHBondContact CG2-OD2 3.45Å; V543-D740 PolarHBondContact N-OD1 3.08Å; V543-D740 PolarHBondContact N-OD2 3.29Å; N738-D740 PolarHBondContact O-N 3.43Å; N738-D740 PolarHBondContact OD1-N 2.85Å; D740-F742 PolarHBondContact O-N 3.48Å; D740-S743 WeakPolarHBondContact CA-OG 3.41Å; D740-S743 WeakPolarHBondContact O-CB 3.4Å; D740-S743 PolarHBondContact O-N 3.41Å; D740-V746 HydrophobicContact CB-CG1 4.14Å; D740-V746 HydrophobicContact CB-CG2 4.34Å; D740-F748 HydrophobicContact CB-CZ 4.46Å
741	I	90.3	Very high	88.3	Confident	3 Å²	3	42 Å²	42	2%	0.015	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	119.9	171.5	-65.3	-70.6	0	0	0	108.8	P566 N738 S743 F748 V756 Q759 K760 L763	P566-I741 WeakPolarHBondContact CG-O 3.48Å; N738-I741 HydrophobicContact CB-CD1 4.32Å; N738-I741 HydrophobicContact CB-CG1 3.63Å; N738-I741 WeakPolarHBondContact O-CG1 3.49Å; N738-I741 PolarHBondContact O-N 3.5Å; I741-S743 VanDerWaalsContact C-N 3.26Å; I741-S743 PolarHBondContact O-N 3.06Å; I741-F748 HydrophobicContact CD1-CE2 4.35Å; I741-F748 HydrophobicContact CD1-CZ 4.07Å; I741-V756 HydrophobicContact CD1-CB 4.44Å; I741-V756 HydrophobicContact CD1-CG1 3.92Å; I741-V756 HydrophobicContact CD1-CG2 4.48Å; I741-Q759 HydrophobicContact CD1-CB 3.89Å; I741-Q759 HydrophobicContact CG1-CB 3.94Å; I741-K760 HydrophobicContact CG2-CG 3.87Å; I741-L763 HydrophobicContact CG2-CD2 4.28Å
742	F	87.7	Confident	88.5	Confident	33 Å²	33	37.4 Å²	37.4	15%	0.145	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	15.4	-171.9	-49.5	-67.7	0	0	0	115.7	L568 L571 V573 E576 D740 K760 L763	L568-F742 HydrophobicContact CD1-CD2 4.38Å; L568-F742 HydrophobicContact CD1-CE2 3.85Å; L568-F742 HydrophobicContact CD2-CD2 3.46Å; L568-F742 VanDerWaalsContact CD2-CD2 3.46Å; L568-F742 HydrophobicContact CD2-CE2 3.75Å; L568-F742 HydrophobicContact CD2-CG 4.19Å; L568-F742 HydrophobicContact CG-CD2 4.48Å; L568-F742 HydrophobicContact CG-CE2 4.43Å; L571-F742 HydrophobicContact CD2-CB 4.27Å; V573-F742 HydrophobicContact CB-CD1 4.32Å; V573-F742 HydrophobicContact CG1-CD1 3.76Å; V573-F742 HydrophobicContact CG1-CE1 4.07Å; V573-F742 HydrophobicContact CG2-CB 4.15Å; V573-F742 HydrophobicContact CG2-CD1 3.94Å; V573-F742 HydrophobicContact CG2-CG 4.1Å; E576-F742 HydrophobicContact CG-CE1 3.74Å; E576-F742 HydrophobicContact CG-CZ 4.16Å; D740-F742 PolarHBondContact O-N 3.48Å; F742-K760 HydrophobicContact CE1-CD 3.98Å; F742-K760 HydrophobicContact CE1-CG 4.02Å; F742-K760 HydrophobicContact CE2-CB 4.24Å; F742-K760 HydrophobicContact CE2-CG 3.92Å; F742-K760 HydrophobicContact CZ-CB 3.89Å; F742-K760 HydrophobicContact CZ-CD 3.79Å; F742-K760 HydrophobicContact CZ-CG 3.46Å; F742-K760 VanDerWaalsContact CZ-CG 3.46Å; F742-L763 HydrophobicContact CD2-CD2 3.97Å; F742-L763 HydrophobicContact CE2-CD2 4.21Å
743	S	82.9	Confident	88.5	Confident	10 Å²	10	39.2 Å²	39.2	7%	0.07	21%	0.213	C	C	.	.			trans	-67.7	133.5	168.7	-77.6	0	0	0	0	110.9	D740 I741 G745 V746	D740-S743 WeakPolarHBondContact CA-OG 3.41Å; D740-S743 WeakPolarHBondContact O-CB 3.4Å; D740-S743 PolarHBondContact O-N 3.41Å; I741-S743 VanDerWaalsContact C-N 3.26Å; I741-S743 PolarHBondContact O-N 3.06Å; S743-G745 PolarHBondContact O-N 3.22Å; S743-V746 PolarHBondContact O-N 3.47Å
744	P	76.3	Confident	88.4	Confident	48 Å²	48	44.2 Å²	44.2	31%	0.312	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	136.8	176.9	-21.9	33.5	0	0	0	111.4	L433 V746	L433-P744 HydrophobicContact CD2-CG 3.92Å; P744-V746 PolarHBondContact O-N 3.41Å
745	G	76.6	Confident	88.2	Confident	61 Å²	61	46.8 Å²	46.8	63%	0.629	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-9.2	175.9	0	0	0	0	0	115.7	S743	S743-G745 PolarHBondContact O-N 3.22Å
746	V	85.6	Confident	88.1	Confident	27 Å²	27	47.4 Å²	47.4	16%	0.164	25%	0.254	C	S	.	.			trans	-82.1	131.7	177.7	-177.6	0	0	0	0	110.7	V529 V543 D740 S743 P744 F748	V529-V746 HydrophobicContact CB-CG1 4.21Å; V529-V746 HydrophobicContact CG1-CG1 3.65Å; V543-V746 HydrophobicContact CB-CG2 4.24Å; V543-V746 HydrophobicContact CG1-CG2 4.44Å; V543-V746 HydrophobicContact CG2-CG1 4.34Å; V543-V746 HydrophobicContact CG2-CG2 4.03Å; D740-V746 HydrophobicContact CB-CG1 4.14Å; D740-V746 HydrophobicContact CB-CG2 4.34Å; S743-V746 PolarHBondContact O-N 3.47Å; P744-V746 PolarHBondContact O-N 3.41Å; V746-F748 HydrophobicContact CG1-CE1 4.24Å; V746-F748 HydrophobicContact CG1-CE2 4.22Å; V746-F748 HydrophobicContact CG1-CZ 3.87Å
747	R	88.2	Confident	87.9	Confident	104 Å²	104	50.4 Å²	50.4	39%	0.392	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-121.5	145.8	177.3	-62.2	-176.2	-65.7	162.5	6.5	109.8	V529 L530 N531 E534	V529-R747 CarbonylContact C-O 3.57Å; V529-R747 WeakPolarHBondContact CA-O 3.4Å; L530-R747 HydrophobicContact CB-CB 4.1Å; L530-R747 HydrophobicContact CD1-CB 4.27Å; L530-R747 PolarHBondContact N-O 3.4Å; N531-R747 PolarHBondContact O-NH2 3.06Å; N531-R747 VanDerWaalsContact O-NH2 3.09Å; E534-R747 IonicContact OE1-CZ 2.74Å; E534-R747 IonicContact OE1-NH1 2.72Å; E534-R747 PolarHBondContact OE1-NH1 3.29Å; E534-R747 IonicContact OE1-NH2 3.48Å; E534-R747 PolarHBondContact OE1-NH2 2.93Å; E534-R747 IonicContact OE2-CZ 3.08Å; E534-R747 IonicContact OE2-NH1 3.52Å; E534-R747 IonicContact OE2-NH2 2.63Å
748	F	90.8	Very high	87.7	Confident	39 Å²	39	55.9 Å²	55.9	17%	0.171	29%	0.294	C	S	.	.			trans	-112.8	142.2	-176.6	-63.2	-79.1	0	0	0	110.8	K528 V529 L530 D740 I741 V746 V756	K528-F748 VanDerWaalsContact O-CD1 3.26Å; K528-F748 WeakPolarHBondContact O-CD1 3.4Å; V529-F748 HydrophobicContact CG1-CE1 4.23Å; L530-F748 WeakPolarHBondContact CD1-O 3.16Å; D740-F748 HydrophobicContact CB-CZ 4.46Å; I741-F748 HydrophobicContact CD1-CE2 4.35Å; I741-F748 HydrophobicContact CD1-CZ 4.07Å; V746-F748 HydrophobicContact CG1-CE1 4.24Å; V746-F748 HydrophobicContact CG1-CE2 4.22Å; V746-F748 HydrophobicContact CG1-CZ 3.87Å; F748-V756 HydrophobicContact CB-CG2 3.86Å; F748-V756 HydrophobicContact CD1-CG2 3.86Å; F748-V756 HydrophobicContact CD2-CG1 4.19Å; F748-V756 HydrophobicContact CD2-CG2 4.05Å; F748-V756 HydrophobicContact CE1-CG2 4.49Å; F748-V756 HydrophobicContact CG-CG2 3.63Å
749	P	91.3	Very high	87.7	Confident	7 Å²	7	56.1 Å²	56.1	5%	0.045	30%	0.295	C	S	.	.			trans	-59.7	147	172.5	-26	36.2	0	0	0	113.7	K528 L530 S536 D751 T752	K528-P749 HydrophobicContact CB-CG 3.94Å; L530-P749 HydrophobicContact CD2-CB 4.34Å; L530-P749 HydrophobicContact CD2-CG 3.85Å; L530-P749 HydrophobicContact CG-CG 4Å; S536-P749 WeakPolarHBondContact OG-CG 3.29Å; P749-D751 WeakPolarHBondContact CB-OD1 3.32Å; P749-D751 PolarHBondContact O-N 2.95Å; P749-T752 PolarHBondContact O-N 3.42Å; P749-T752 PolarHBondContact O-OG1 3.21Å
750	D	87.9	Confident	87.8	Confident	138 Å²	138	58.2 Å²	58.2	74%	0.738	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-59.5	-30.3	-178.2	-72.1	-26.3	0	0	0	113.4	T752 L753	D750-T752 PolarHBondContact O-N 3.24Å; D750-L753 HydrophobicContact CB-CD1 4.29Å; D750-L753 WeakPolarHBondContact O-CD1 3.32Å; D750-L753 WeakPolarHBondContact O-CG 3.33Å; D750-L753 PolarHBondContact O-N 3.36Å
751	D	88.8	Confident	87.9	Confident	112 Å²	112	62.5 Å²	62.5	60%	0.599	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-66.4	-17.2	176.7	59.2	-47.2	0	0	0	113.3	K528 P749	K528-D751 IonicContact NZ-OD2 3.07Å; K528-D751 PolarHBondContact NZ-OD2 2.76Å; P749-D751 WeakPolarHBondContact CB-OD1 3.32Å; P749-D751 PolarHBondContact O-N 2.95Å
752	T	88.7	Confident	88	Confident	22 Å²	22	62.7 Å²	62.7	14%	0.135	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-105.4	2.4	-176.1	64.3	0	0	0	0	114.2	K528 P749 D750 E754 D755 V756	K528-T752 HydrophobicContact CD-CG2 4.35Å; P749-T752 PolarHBondContact O-N 3.42Å; P749-T752 PolarHBondContact O-OG1 3.21Å; D750-T752 PolarHBondContact O-N 3.24Å; T752-E754 VanDerWaalsContact C-N 3.34Å; T752-E754 PolarHBondContact O-N 3.35Å; T752-D755 PolarHBondContact O-N 3Å; T752-D755 VanDerWaalsContact O-N 3.1Å; T752-V756 WeakPolarHBondContact O-CG2 3.39Å; T752-V756 PolarHBondContact O-N 3.45Å
753	L	87.1	Confident	88.3	Confident	96 Å²	96	61.2 Å²	61.2	50%	0.503	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-39.7	-173.2	-74.6	169.3	0	0	0	114.1	D750 Q757	D750-L753 HydrophobicContact CB-CD1 4.29Å; D750-L753 WeakPolarHBondContact O-CD1 3.32Å; D750-L753 WeakPolarHBondContact O-CG 3.33Å; D750-L753 PolarHBondContact O-N 3.36Å; L753-Q757 PolarHBondContact O-N 2.98Å
754	E	87.6	Confident	88.8	Confident	151 Å²	151	62 Å²	62	71%	0.706	32%	0.32	S	S	*	.	H	α-helix	trans	-64.2	-41.2	177.2	-69.3	-169.7	176.9	0	0	112.1	T752 Q757 K758	T752-E754 VanDerWaalsContact C-N 3.34Å; T752-E754 PolarHBondContact O-N 3.35Å; E754-Q757 PolarHBondContact O-N 3.21Å; E754-K758 WeakPolarHBondContact O-CG 3.23Å; E754-K758 PolarHBondContact O-N 3.22Å
755	D	86.9	Confident	89.6	Confident	79 Å²	79	61.8 Å²	61.8	42%	0.422	32%	0.317	S	S	.	.	H	α-helix	trans	-73.7	-36.8	-179.4	-69.1	-25	0	0	0	111.6	T752 Q757 K758 Q759	T752-D755 PolarHBondContact O-N 3Å; T752-D755 VanDerWaalsContact O-N 3.1Å; D755-Q757 VanDerWaalsContact C-N 3.29Å; D755-Q757 PolarHBondContact O-N 2.89Å; D755-K758 PolarHBondContact O-N 3.25Å; D755-K758 IonicContact OD1-NZ 3.48Å; D755-K758 PolarHBondContact OD1-NZ 3.36Å; D755-Q759 WeakPolarHBondContact O-CB 3.49Å; D755-Q759 WeakPolarHBondContact O-CG 3.27Å; D755-Q759 PolarHBondContact O-N 3.41Å
756	V	90.3	Very high	90.5	Very high	14 Å²	14	59 Å²	59	9%	0.085	29%	0.288	C	S	.	.	H	α-helix	trans	-57.5	-44.7	169.2	171.3	0	0	0	0	110.1	I741 F748 T752 K758 Q759 K760	I741-V756 HydrophobicContact CD1-CB 4.44Å; I741-V756 HydrophobicContact CD1-CG1 3.92Å; I741-V756 HydrophobicContact CD1-CG2 4.48Å; F748-V756 HydrophobicContact CB-CG2 3.86Å; F748-V756 HydrophobicContact CD1-CG2 3.86Å; F748-V756 HydrophobicContact CD2-CG1 4.19Å; F748-V756 HydrophobicContact CD2-CG2 4.05Å; F748-V756 HydrophobicContact CE1-CG2 4.49Å; F748-V756 HydrophobicContact CG-CG2 3.63Å; T752-V756 WeakPolarHBondContact O-CG2 3.39Å; T752-V756 PolarHBondContact O-N 3.45Å; V756-K758 PolarHBondContact O-N 3.19Å; V756-Q759 PolarHBondContact O-N 3.03Å; V756-K760 HydrophobicContact CG1-CD 4.45Å; V756-K760 HydrophobicContact CG1-CG 4.48Å; V756-K760 VanDerWaalsContact O-CG 3.32Å; V756-K760 WeakPolarHBondContact O-CG 3.37Å; V756-K760 PolarHBondContact O-N 3.38Å
757	Q	90.4	Very high	90.9	Very high	101 Å²	101	57.7 Å²	57.7	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-65.2	-39.1	178.8	-168.7	63.1	13.9	0	0	112.6	L753 E754 D755 K760 Q761	L753-Q757 PolarHBondContact O-N 2.98Å; E754-Q757 PolarHBondContact O-N 3.21Å; D755-Q757 VanDerWaalsContact C-N 3.29Å; D755-Q757 PolarHBondContact O-N 2.89Å; Q757-K760 PolarHBondContact O-N 3.11Å; Q757-Q761 PolarHBondContact O-N 2.95Å; Q757-Q761 VanDerWaalsContact O-N 3.08Å
758	K	90.4	Very high	91.3	Very high	119 Å²	119	53.4 Å²	53.4	52%	0.517	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-43.3	172.8	-68.4	170.4	-159.7	152.6	0	111.5	E754 D755 V756 Q761 L762	E754-K758 WeakPolarHBondContact O-CG 3.23Å; E754-K758 PolarHBondContact O-N 3.22Å; D755-K758 PolarHBondContact O-N 3.25Å; D755-K758 IonicContact OD1-NZ 3.48Å; D755-K758 PolarHBondContact OD1-NZ 3.36Å; V756-K758 PolarHBondContact O-N 3.19Å; K758-Q761 PolarHBondContact O-N 2.86Å; K758-L762 WeakPolarHBondContact O-CB 3.48Å; K758-L762 PolarHBondContact O-N 3.03Å
759	Q	92.3	Very high	91.5	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.056	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-39.9	178.4	-75.7	-66.1	-48.2	0	0	112.4	R736 N738 I741 D755 V756 Q761 L762 L763	R736-Q759 PolarHBondContact O-NE2 2.74Å; R736-Q759 PolarHBondContact O-OE1 3.2Å; N738-Q759 HydrophobicContact CB-CG 4.36Å; I741-Q759 HydrophobicContact CD1-CB 3.89Å; I741-Q759 HydrophobicContact CG1-CB 3.94Å; D755-Q759 WeakPolarHBondContact O-CB 3.49Å; D755-Q759 WeakPolarHBondContact O-CG 3.27Å; D755-Q759 PolarHBondContact O-N 3.41Å; V756-Q759 PolarHBondContact O-N 3.03Å; Q759-Q761 VanDerWaalsContact C-N 3.32Å; Q759-Q761 PolarHBondContact O-N 3.45Å; Q759-L762 PolarHBondContact O-N 2.94Å; Q759-L763 WeakPolarHBondContact O-CB 3.25Å; Q759-L763 PolarHBondContact O-N 3.36Å
760	K	92.8	Very high	91.8	Very high	46 Å²	46	52 Å²	52	20%	0.2	26%	0.26	C	S	.	.	H	α-helix	trans	-56.8	-46	170.8	-72.2	-179.8	169.4	-169	0	111.5	E576 I741 F742 V756 Q757 L763 K764	E576-K760 WeakPolarHBondContact OE1-CD 3.24Å; E576-K760 IonicContact OE1-NZ 3.3Å; E576-K760 PolarHBondContact OE1-NZ 3.47Å; I741-K760 HydrophobicContact CG2-CG 3.87Å; F742-K760 HydrophobicContact CE1-CD 3.98Å; F742-K760 HydrophobicContact CE1-CG 4.02Å; F742-K760 HydrophobicContact CE2-CB 4.24Å; F742-K760 HydrophobicContact CE2-CG 3.92Å; F742-K760 HydrophobicContact CZ-CB 3.89Å; F742-K760 HydrophobicContact CZ-CD 3.79Å; F742-K760 HydrophobicContact CZ-CG 3.46Å; F742-K760 VanDerWaalsContact CZ-CG 3.46Å; V756-K760 HydrophobicContact CG1-CD 4.45Å; V756-K760 HydrophobicContact CG1-CG 4.48Å; V756-K760 VanDerWaalsContact O-CG 3.32Å; V756-K760 WeakPolarHBondContact O-CG 3.37Å; V756-K760 PolarHBondContact O-N 3.38Å; Q757-K760 PolarHBondContact O-N 3.11Å; K760-L763 PolarHBondContact O-N 3.49Å; K760-K764 WeakPolarHBondContact O-CG 3.35Å; K760-K764 PolarHBondContact O-N 2.95Å; K760-K764 VanDerWaalsContact O-N 3.09Å
761	Q	92.3	Very high	92.1	Very high	91 Å²	91	45.5 Å²	45.5	43%	0.425	23%	0.225	S	C	.	.	H	α-helix	trans	-65.2	-43.7	177.8	-174.5	58.9	41.1	0	0	112.1	Q757 K758 Q759 L763 K764 D765	Q757-Q761 PolarHBondContact O-N 2.95Å; Q757-Q761 VanDerWaalsContact O-N 3.08Å; K758-Q761 PolarHBondContact O-N 2.86Å; Q759-Q761 VanDerWaalsContact C-N 3.32Å; Q759-Q761 PolarHBondContact O-N 3.45Å; Q761-L763 VanDerWaalsContact C-N 3.26Å; Q761-L763 PolarHBondContact O-N 3.03Å; Q761-K764 WeakPolarHBondContact O-CB 3.12Å; Q761-K764 PolarHBondContact O-N 3.46Å; Q761-K764 VanDerWaalsContact O-N 3.14Å; Q761-D765 PolarHBondContact NE2-OD1 3.37Å; Q761-D765 PolarHBondContact O-N 3.2Å
762	L	93.1	Very high	92.4	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-58	-40.5	177.4	-175.3	68	0	0	0	111.7	F606 I735 F737 K758 Q759 D765 A766	F606-L762 HydrophobicContact CE1-CD1 3.79Å; F606-L762 HydrophobicContact CE1-CG 4.44Å; F606-L762 HydrophobicContact CZ-CD1 4.08Å; I735-L762 HydrophobicContact CG2-CD1 4.22Å; I735-L762 HydrophobicContact CG2-CD2 3.92Å; F737-L762 HydrophobicContact CD1-CD2 4.14Å; F737-L762 HydrophobicContact CD1-CG 4.4Å; F737-L762 HydrophobicContact CE1-CD2 3.91Å; F737-L762 HydrophobicContact CE1-CG 3.77Å; F737-L762 HydrophobicContact CZ-CD2 4.19Å; F737-L762 HydrophobicContact CZ-CG 4.12Å; K758-L762 WeakPolarHBondContact O-CB 3.48Å; K758-L762 PolarHBondContact O-N 3.03Å; Q759-L762 PolarHBondContact O-N 2.94Å; L762-D765 PolarHBondContact O-N 3.27Å; L762-A766 PolarHBondContact O-N 3.45Å
763	L	93.2	Very high	92.7	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-69	-38	177.2	-170.5	59.8	0	0	0	112.5	P565 P566 L568 L598 F737 I741 F742 Q759 K760 Q761 D765 A766 A767	P565-L763 HydrophobicContact CB-CD1 3.74Å; P565-L763 HydrophobicContact CG-CD1 4.13Å; P566-L763 HydrophobicContact CG-CD2 4Å; P566-L763 WeakPolarHBondContact O-CD1 3.39Å; L568-L763 HydrophobicContact CD1-CB 4.09Å; L568-L763 HydrophobicContact CD1-CD2 3.9Å; L568-L763 HydrophobicContact CD1-CG 3.71Å; L568-L763 HydrophobicContact CD2-CD2 3.95Å; L568-L763 HydrophobicContact CG-CD2 3.81Å; L568-L763 HydrophobicContact CG-CG 3.85Å; L598-L763 HydrophobicContact CD1-CD1 3.68Å; F737-L763 HydrophobicContact CD1-CD1 4.28Å; F737-L763 HydrophobicContact CE1-CD1 4.36Å; I741-L763 HydrophobicContact CG2-CD2 4.28Å; F742-L763 HydrophobicContact CD2-CD2 3.97Å; F742-L763 HydrophobicContact CE2-CD2 4.21Å; Q759-L763 WeakPolarHBondContact O-CB 3.25Å; Q759-L763 PolarHBondContact O-N 3.36Å; K760-L763 PolarHBondContact O-N 3.49Å; Q761-L763 VanDerWaalsContact C-N 3.26Å; Q761-L763 PolarHBondContact O-N 3.03Å; L763-D765 VanDerWaalsContact C-N 3.33Å; L763-A766 PolarHBondContact O-N 2.93Å; L763-A767 WeakPolarHBondContact O-CB 3.19Å; L763-A767 PolarHBondContact O-N 3.39Å
764	K	94.1	Very high	93.2	Very high	25 Å²	25	39.7 Å²	39.7	11%	0.109	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-41.7	171.9	-69.8	177.5	-174	-167.7	0	111.6	L568 E576 E577 L578 K760 Q761 A767 A768	L568-K764 HydrophobicContact CD1-CG 3.76Å; E576-K764 VanDerWaalsContact OE2-CE 3.26Å; E576-K764 WeakPolarHBondContact OE2-CE 3.1Å; E576-K764 IonicContact OE2-NZ 2.73Å; E576-K764 PolarHBondContact OE2-NZ 2.86Å; E577-K764 WeakPolarHBondContact O-CE 3.17Å; E577-K764 PolarHBondContact O-NZ 3.04Å; L578-K764 HydrophobicContact CD2-CG 4.27Å; K760-K764 WeakPolarHBondContact O-CG 3.35Å; K760-K764 PolarHBondContact O-N 2.95Å; K760-K764 VanDerWaalsContact O-N 3.09Å; Q761-K764 WeakPolarHBondContact O-CB 3.12Å; Q761-K764 PolarHBondContact O-N 3.46Å; Q761-K764 VanDerWaalsContact O-N 3.14Å; K764-A767 PolarHBondContact O-N 3.23Å; K764-A768 WeakPolarHBondContact O-CB 3.34Å; K764-A768 PolarHBondContact O-N 2.87Å
765	D	94.1	Very high	93.6	Very high	45 Å²	45	32.6 Å²	32.6	24%	0.241	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-44	176.6	-69	-1	0	0	0	111.3	F606 R610 Q761 L762 L763 A768 F769	F606-D765 HydrophobicContact CE2-CB 4.2Å; F606-D765 HydrophobicContact CZ-CB 3.96Å; R610-D765 IonicContact CZ-OD2 3.04Å; R610-D765 IonicContact NH1-OD2 3.72Å; R610-D765 PolarHBondContact NH1-OD2 3.1Å; R610-D765 IonicContact NH2-OD2 2.64Å; R610-D765 PolarHBondContact NH2-OD2 3.27Å; Q761-D765 PolarHBondContact NE2-OD1 3.37Å; Q761-D765 PolarHBondContact O-N 3.2Å; L762-D765 PolarHBondContact O-N 3.27Å; L763-D765 VanDerWaalsContact C-N 3.33Å; D765-A768 PolarHBondContact O-N 3.47Å; D765-F769 WeakPolarHBondContact O-CB 3.5Å; D765-F769 PolarHBondContact O-N 3.19Å
766	A	94.9	Very high	94	Very high	2 Å²	2	30.5 Å²	30.5	2%	0.017	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-42	177.3	0	0	0	0	0	112	L598 F606 F737 L762 L763 A768 F769 L770	L598-A766 HydrophobicContact CD1-CB 4.03Å; F606-A766 HydrophobicContact CD1-CB 4.15Å; F606-A766 HydrophobicContact CD2-CB 4.24Å; F606-A766 HydrophobicContact CE1-CB 4.14Å; F606-A766 HydrophobicContact CE2-CB 4.24Å; F606-A766 HydrophobicContact CG-CB 4.18Å; F606-A766 HydrophobicContact CZ-CB 4.18Å; F737-A766 HydrophobicContact CE1-CB 4.13Å; F737-A766 HydrophobicContact CZ-CB 4.15Å; L762-A766 PolarHBondContact O-N 3.45Å; L763-A766 PolarHBondContact O-N 2.93Å; A766-A768 VanDerWaalsContact C-N 3.34Å; A766-A768 PolarHBondContact O-N 3.38Å; A766-F769 PolarHBondContact O-N 2.97Å; A766-L770 PolarHBondContact O-N 3.23Å
767	A	94.6	Very high	94.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.6	-39.5	174.5	0	0	0	0	0	112.1	L568 N569 L763 K764	L568-A767 HydrophobicContact CB-CB 4.25Å; N569-A767 PolarHBondContact ND2-O 3.13Å; L763-A767 WeakPolarHBondContact O-CB 3.19Å; L763-A767 PolarHBondContact O-N 3.39Å; K764-A767 PolarHBondContact O-N 3.23Å
768	A	95.5	Very high	94.6	Very high	13 Å²	13	27 Å²	27	11%	0.107	14%	0.143	C	C	.	.	H	α-helix	trans	-68.9	-39.7	175	0	0	0	0	0	112.1	K764 D765 A766 L770 V771 T772	K764-A768 WeakPolarHBondContact O-CB 3.34Å; K764-A768 PolarHBondContact O-N 2.87Å; D765-A768 PolarHBondContact O-N 3.47Å; A766-A768 VanDerWaalsContact C-N 3.34Å; A766-A768 PolarHBondContact O-N 3.38Å; A768-L770 VanDerWaalsContact C-N 3.33Å; A768-L770 PolarHBondContact O-N 3.1Å; A768-V771 PolarHBondContact O-N 3.42Å; A768-T772 WeakPolarHBondContact O-CB 3.2Å; A768-T772 WeakPolarHBondContact O-CG2 3.27Å; A768-T772 PolarHBondContact O-N 3.26Å; A768-T772 PolarHBondContact O-OG1 2.96Å
769	F	96.2	Very high	94.9	Very high	15 Å²	15	21.4 Å²	21.4	7%	0.066	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-39.1	178.7	174.6	-108.3	0	0	0	112.9	L602 A605 F606 H609 D765 A766 V771 C773 Q774	L602-F769 HydrophobicContact CD1-CD1 4.14Å; L602-F769 HydrophobicContact CD1-CE1 4.44Å; A605-F769 HydrophobicContact CB-CE1 4.36Å; F606-F769 HydrophobicContact CB-CD1 3.87Å; F606-F769 HydrophobicContact CB-CE1 3.97Å; F606-F769 HydrophobicContact CD2-CB 3.74Å; F606-F769 AromaticContact CD2-CD1 3.74Å; F606-F769 HydrophobicContact CD2-CD1 3.74Å; F606-F769 HydrophobicContact CD2-CD2 4.4Å; F606-F769 HydrophobicContact CD2-CE1 4.4Å; F606-F769 AromaticContact CD2-CG 3.72Å; F606-F769 HydrophobicContact CD2-CG 3.72Å; F606-F769 HydrophobicContact CE2-CB 4.11Å; F606-F769 HydrophobicContact CE2-CG 4.47Å; F606-F769 HydrophobicContact CG-CD1 4.3Å; H609-F769 HydrophobicContact CB-CE2 3.77Å; H609-F769 HydrophobicContact CB-CZ 3.73Å; H609-F769 AromaticContact CD2-CD2 3.91Å; H609-F769 AromaticContact CD2-CE2 3.61Å; H609-F769 AromaticContact CG-CE2 3.49Å; H609-F769 VanDerWaalsContact CG-CE2 3.49Å; H609-F769 AromaticContact CG-CZ 3.99Å; H609-F769 AromaticContact ND1-CE2 3.94Å; D765-F769 WeakPolarHBondContact O-CB 3.5Å; D765-F769 PolarHBondContact O-N 3.19Å; A766-F769 PolarHBondContact O-N 2.97Å; F769-V771 VanDerWaalsContact C-N 3.32Å; F769-V771 PolarHBondContact O-N 2.98Å; F769-C773 HydrophobicContact CD2-CB 3.55Å; F769-C773 HydrophobicContact CE2-CB 3.53Å; F769-C773 HydrophobicContact CG-CB 4.35Å; F769-C773 HydrophobicContact CZ-CB 4.34Å; F769-C773 WeakPolarHBondContact O-CA 3.4Å; F769-C773 VanDerWaalsContact O-CB 3.29Å; F769-C773 WeakPolarHBondContact O-CB 3.37Å; F769-C773 PolarHBondContact O-N 2.95Å; F769-Q774 HydrophobicContact CD1-CG 4.15Å; F769-Q774 HydrophobicContact CE1-CG 3.79Å; F769-Q774 HydrophobicContact CZ-CG 4.31Å; F769-Q774 PolarHBondContact O-N 2.79Å
770	L	96.2	Very high	95	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.016	14%	0.142	C	C	.	.	I	π-helix	trans	-55.9	-49.6	174.9	-176.5	157.5	0	0	0	111.1	L602 A766 A768 Q774 I775 Y808	L602-L770 HydrophobicContact CD1-CB 3.84Å; L602-L770 HydrophobicContact CD1-CD1 4.21Å; L602-L770 HydrophobicContact CD1-CG 4.12Å; L602-L770 HydrophobicContact CD2-CB 4.12Å; L602-L770 HydrophobicContact CD2-CD1 3.71Å; L602-L770 HydrophobicContact CD2-CG 4.39Å; A766-L770 PolarHBondContact O-N 3.23Å; A768-L770 VanDerWaalsContact C-N 3.33Å; A768-L770 PolarHBondContact O-N 3.1Å; L770-Q774 WeakPolarHBondContact O-CB 3.24Å; L770-Q774 PolarHBondContact O-N 3.17Å; L770-I775 HydrophobicContact CD2-CD1 3.79Å; L770-I775 HydrophobicContact CD2-CG1 4.12Å; L770-I775 PolarHBondContact O-N 2.84Å; L770-Y808 HydrophobicContact CD1-CD2 4.32Å; L770-Y808 HydrophobicContact CD1-CE2 3.65Å; L770-Y808 HydrophobicContact CD2-CD1 3.73Å; L770-Y808 HydrophobicContact CD2-CD2 4.12Å; L770-Y808 HydrophobicContact CD2-CE1 3.38Å; L770-Y808 HydrophobicContact CD2-CE2 3.8Å; L770-Y808 HydrophobicContact CD2-CG 4.06Å; L770-Y808 HydrophobicContact CG-CE2 4.44Å
771	V	95.3	Very high	95.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-79.4	-34.2	-171.5	177.2	0	0	0	0	112.2	Q585 F587 A768 F769 Y808	Q585-V771 HydrophobicContact CB-CG1 4.25Å; Q585-V771 HydrophobicContact CG-CG1 4.19Å; F587-V771 HydrophobicContact CD2-CG1 4.3Å; F587-V771 HydrophobicContact CD2-CG2 4.15Å; F587-V771 HydrophobicContact CE2-CG1 3.91Å; F587-V771 HydrophobicContact CE2-CG2 3.7Å; F587-V771 HydrophobicContact CZ-CG2 4.26Å; A768-V771 PolarHBondContact O-N 3.42Å; F769-V771 VanDerWaalsContact C-N 3.32Å; F769-V771 PolarHBondContact O-N 2.98Å; V771-Y808 HydrophobicContact CG2-CE1 3.87Å
772	T	94.3	Very high	95.2	Very high	54 Å²	54	21.5 Å²	21.5	33%	0.331	12%	0.119	S	C	.	.	I	π-helix	trans	-94.6	-22.4	-175	58.5	0	0	0	0	114	E581 A768	E581-T772 HydrophobicContact CB-CG2 3.75Å; E581-T772 HydrophobicContact CG-CG2 4.18Å; A768-T772 WeakPolarHBondContact O-CB 3.2Å; A768-T772 WeakPolarHBondContact O-CG2 3.27Å; A768-T772 PolarHBondContact O-N 3.26Å; A768-T772 PolarHBondContact O-OG1 2.96Å
773	C	95.3	Very high	95.2	Very high	42 Å²	42	23.2 Å²	23.2	28%	0.284	13%	0.128	S	C	.	.	I	π-helix	trans	-121.2	-54.4	-177.3	-58	0	0	0	0	112.7	F769 S777	F769-C773 HydrophobicContact CD2-CB 3.55Å; F769-C773 HydrophobicContact CE2-CB 3.53Å; F769-C773 HydrophobicContact CG-CB 4.35Å; F769-C773 HydrophobicContact CZ-CB 4.34Å; F769-C773 WeakPolarHBondContact O-CA 3.4Å; F769-C773 VanDerWaalsContact O-CB 3.29Å; F769-C773 WeakPolarHBondContact O-CB 3.37Å; F769-C773 PolarHBondContact O-N 2.95Å; C773-S777 VanDerWaalsContact O-CB 3.24Å; C773-S777 WeakPolarHBondContact O-CB 3.3Å; C773-S777 PolarHBondContact O-N 3.19Å; C773-S777 PolarHBondContact O-OG 3.1Å
774	Q	97	Very high	95.1	Very high	13 Å²	13	28 Å²	28	6%	0.061	15%	0.153	C	C	.	.	I	π-helix	trans	-68.5	-47.5	-172.8	-67	-61.9	-28.2	0	0	113	L602 F769 L770 S777 L778 R802 I804	L602-Q774 HydrophobicContact CD1-CG 3.76Å; F769-Q774 HydrophobicContact CD1-CG 4.15Å; F769-Q774 HydrophobicContact CE1-CG 3.79Å; F769-Q774 HydrophobicContact CZ-CG 4.31Å; F769-Q774 PolarHBondContact O-N 2.79Å; L770-Q774 WeakPolarHBondContact O-CB 3.24Å; L770-Q774 PolarHBondContact O-N 3.17Å; Q774-S777 PolarHBondContact O-N 3.11Å; Q774-L778 PolarHBondContact O-N 2.98Å; Q774-R802 PolarHBondContact OE1-O 3.47Å; Q774-I804 HydrophobicContact CB-CD1 4.28Å; Q774-I804 HydrophobicContact CB-CG1 4.15Å
775	I	96.6	Very high	94.9	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-59.6	-51	177.6	-70.7	174.7	0	0	0	111.6	L770 S777 L778 V779 I804 Y808 T811 V812 F815	L770-I775 HydrophobicContact CD2-CD1 3.79Å; L770-I775 HydrophobicContact CD2-CG1 4.12Å; L770-I775 PolarHBondContact O-N 2.84Å; I775-S777 VanDerWaalsContact C-N 3.29Å; I775-S777 PolarHBondContact O-N 3.36Å; I775-L778 PolarHBondContact O-N 3.33Å; I775-V779 PolarHBondContact O-N 3.09Å; I775-I804 HydrophobicContact CG1-CD1 3.91Å; I775-I804 HydrophobicContact CG1-CG1 4.27Å; I775-I804 HydrophobicContact CG1-CG2 4.38Å; I775-Y808 HydrophobicContact CD1-CD1 3.89Å; I775-Y808 HydrophobicContact CD1-CG 4.4Å; I775-T811 HydrophobicContact CD1-CG2 4.03Å; I775-V812 HydrophobicContact CD1-CG2 4.27Å; I775-V812 HydrophobicContact CG1-CG2 4.13Å; I775-V812 HydrophobicContact CG2-CG2 4.08Å; I775-F815 HydrophobicContact CG2-CB 4.42Å; I775-F815 HydrophobicContact CG2-CG 4.4Å
776	P	96	Very high	94.7	Very high	35 Å²	35	28 Å²	28	23%	0.227	16%	0.157	C	C	.	.	H	α-helix	trans	-60.5	-36.1	175.4	-27.9	37.5	0	0	0	113.7	V779 K780 F815	P776-V779 PolarHBondContact O-N 3.15Å; P776-K780 WeakPolarHBondContact O-CB 3.37Å; P776-K780 PolarHBondContact O-N 3.13Å; P776-F815 HydrophobicContact CB-CE1 4.43Å; P776-F815 HydrophobicContact CB-CE2 4.39Å; P776-F815 HydrophobicContact CB-CZ 3.85Å; P776-F815 HydrophobicContact CG-CE2 3.94Å; P776-F815 HydrophobicContact CG-CZ 3.91Å
777	S	95.9	Very high	94.5	Very high	40 Å²	40	29.6 Å²	29.6	28%	0.28	17%	0.166	S	C	.	.	H	α-helix	trans	-66.1	-42.4	178.3	-60.3	0	0	0	0	111.9	C773 Q774 I775 V779 K780 D781	C773-S777 VanDerWaalsContact O-CB 3.24Å; C773-S777 WeakPolarHBondContact O-CB 3.3Å; C773-S777 PolarHBondContact O-N 3.19Å; C773-S777 PolarHBondContact O-OG 3.1Å; Q774-S777 PolarHBondContact O-N 3.11Å; I775-S777 VanDerWaalsContact C-N 3.29Å; I775-S777 PolarHBondContact O-N 3.36Å; S777-V779 VanDerWaalsContact C-N 3.34Å; S777-V779 PolarHBondContact O-N 3.45Å; S777-K780 WeakPolarHBondContact O-CB 3.41Å; S777-K780 PolarHBondContact O-N 2.91Å; S777-D781 PolarHBondContact O-N 2.9Å
778	L	96.5	Very high	94.3	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-58.5	-46.6	174	174.8	66.6	0	0	0	111.5	Q774 I775 K780 D781 C782 A798 L799 R802 I804 F828	Q774-L778 PolarHBondContact O-N 2.98Å; I775-L778 PolarHBondContact O-N 3.33Å; L778-K780 VanDerWaalsContact C-N 3.27Å; L778-K780 PolarHBondContact O-N 3.33Å; L778-D781 WeakPolarHBondContact O-CB 3.26Å; L778-D781 PolarHBondContact O-N 3.16Å; L778-C782 PolarHBondContact O-N 2.99Å; L778-C782 VanDerWaalsContact O-N 3.11Å; L778-C782 PolarHBondContact O-SG 3.23Å; L778-A798 HydrophobicContact CD1-CB 4.2Å; L778-L799 HydrophobicContact CD2-CD2 3.4Å; L778-L799 VanDerWaalsContact CD2-CD2 3.4Å; L778-L799 HydrophobicContact CD2-CG 4.15Å; L778-R802 HydrophobicContact CB-CG 4.33Å; L778-R802 HydrophobicContact CD1-CG 4.27Å; L778-I804 HydrophobicContact CB-CD1 4.1Å; L778-I804 HydrophobicContact CD2-CD1 3.87Å; L778-F828 HydrophobicContact CD2-CZ 4.41Å
779	V	95.9	Very high	94.3	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-64.7	-37.1	180	174	0	0	0	0	110.8	I775 P776 S777 C782 L783 V812 F815 V816 L825	I775-V779 PolarHBondContact O-N 3.09Å; P776-V779 PolarHBondContact O-N 3.15Å; S777-V779 VanDerWaalsContact C-N 3.34Å; S777-V779 PolarHBondContact O-N 3.45Å; V779-C782 PolarHBondContact O-N 3.2Å; V779-L783 HydrophobicContact CG1-CD1 4.22Å; V779-L783 PolarHBondContact O-N 3.37Å; V779-V812 HydrophobicContact CG2-CG1 4.46Å; V779-F815 HydrophobicContact CB-CD1 4.12Å; V779-F815 HydrophobicContact CB-CE1 4.02Å; V779-F815 HydrophobicContact CG1-CD1 4.1Å; V779-F815 HydrophobicContact CG1-CE1 3.99Å; V779-F815 HydrophobicContact CG2-CD1 3.83Å; V779-F815 HydrophobicContact CG2-CE1 4.22Å; V779-V816 HydrophobicContact CG1-CG2 4.1Å; V779-V816 HydrophobicContact CG2-CG2 3.87Å; V779-L825 HydrophobicContact CG1-CD1 3.55Å
780	K	95	Very high	94.2	Very high	128 Å²	128	30.9 Å²	30.9	56%	0.557	17%	0.171	S	C	*	.	H	α-helix	trans	-62.8	-44.8	172.1	-173.7	-173.8	173.6	-168.5	0	111.8	P776 S777 L778 C782 L783 D784	P776-K780 WeakPolarHBondContact O-CB 3.37Å; P776-K780 PolarHBondContact O-N 3.13Å; S777-K780 WeakPolarHBondContact O-CB 3.41Å; S777-K780 PolarHBondContact O-N 2.91Å; L778-K780 VanDerWaalsContact C-N 3.27Å; L778-K780 PolarHBondContact O-N 3.33Å; K780-C782 VanDerWaalsContact C-N 3.26Å; K780-C782 PolarHBondContact O-N 3.04Å; K780-L783 WeakPolarHBondContact O-CA 3.42Å; K780-L783 VanDerWaalsContact O-CB 3.26Å; K780-L783 WeakPolarHBondContact O-CB 3.35Å; K780-L783 PolarHBondContact O-N 3.26Å; K780-L783 VanDerWaalsContact O-N 3.09Å; K780-D784 WeakPolarHBondContact CE-OD2 3.48Å; K780-D784 WeakPolarHBondContact O-CB 3.42Å; K780-D784 PolarHBondContact O-N 3.11Å
781	D	94.8	Very high	94.1	Very high	24 Å²	24	31 Å²	31	13%	0.128	17%	0.172	C	C	.	.	H	α-helix	trans	-58.3	-39.8	178.5	-66.3	-18.9	0	0	0	112.3	S777 L778 D784 H785 S786 T787 R802	S777-D781 PolarHBondContact O-N 2.9Å; L778-D781 WeakPolarHBondContact O-CB 3.26Å; L778-D781 PolarHBondContact O-N 3.16Å; D781-D784 CarbonylContact O-C 3.55Å; D781-D784 PolarHBondContact O-N 3.25Å; D781-H785 PolarHBondContact O-N 3.22Å; D781-H785 VanDerWaalsContact O-N 3.08Å; D781-S786 VanDerWaalsContact CA-OG 3.24Å; D781-S786 WeakPolarHBondContact CA-OG 3.41Å; D781-S786 VanDerWaalsContact CB-OG 3.25Å; D781-S786 WeakPolarHBondContact CB-OG 3.37Å; D781-S786 PolarHBondContact O-N 3.13Å; D781-S786 PolarHBondContact O-OG 3.48Å; D781-T787 PolarHBondContact O-N 2.8Å; D781-R802 IonicContact OD1-NH2 3.61Å; D781-R802 PolarHBondContact OD1-NH2 2.86Å; D781-R802 IonicContact OD2-CZ 2.84Å; D781-R802 IonicContact OD2-NE 3.19Å; D781-R802 PolarHBondContact OD2-NE 2.96Å; D781-R802 IonicContact OD2-NH2 3.45Å; D781-R802 PolarHBondContact OD2-NH2 3.43Å
782	C	94.5	Very high	94.1	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-69.5	-38.4	175.5	-66.5	0	0	0	0	112.4	L778 V779 K780 D784 H785 T787 L825 F828	L778-C782 PolarHBondContact O-N 2.99Å; L778-C782 VanDerWaalsContact O-N 3.11Å; L778-C782 PolarHBondContact O-SG 3.23Å; V779-C782 PolarHBondContact O-N 3.2Å; K780-C782 VanDerWaalsContact C-N 3.26Å; K780-C782 PolarHBondContact O-N 3.04Å; C782-D784 VanDerWaalsContact C-N 3.34Å; C782-H785 PolarHBondContact O-N 3.45Å; C782-H785 VanDerWaalsContact O-N 3.12Å; C782-T787 WeakPolarHBondContact CA-O 3.47Å; C782-T787 PolarHBondContact SG-O 3.28Å; C782-T787 VanDerWaalsContact SG-O 3.41Å; C782-L825 HydrophobicContact CB-CD2 4.03Å; C782-F828 HydrophobicContact CB-CD2 4.31Å
783	L	92.7	Very high	94	Very high	42 Å²	42	31 Å²	31	22%	0.22	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-43.2	172	-111.5	136.3	0	0	0	111.9	V779 K780 H785 A821 L825	V779-L783 HydrophobicContact CG1-CD1 4.22Å; V779-L783 PolarHBondContact O-N 3.37Å; K780-L783 WeakPolarHBondContact O-CA 3.42Å; K780-L783 VanDerWaalsContact O-CB 3.26Å; K780-L783 WeakPolarHBondContact O-CB 3.35Å; K780-L783 PolarHBondContact O-N 3.26Å; K780-L783 VanDerWaalsContact O-N 3.09Å; L783-H785 PolarHBondContact O-CE1 3.04Å; L783-H785 VanDerWaalsContact O-CE1 3.29Å; L783-H785 PolarHBondContact O-N 3.34Å; L783-H785 PolarHBondContact O-ND1 3.38Å; L783-A821 HydrophobicContact CD1-CB 4.25Å; L783-A821 HydrophobicContact CD2-CB 3.75Å; L783-A821 HydrophobicContact CG-CB 4.43Å; L783-L825 HydrophobicContact CB-CD2 4.32Å; L783-L825 HydrophobicContact CD1-CD1 3.63Å; L783-L825 HydrophobicContact CD1-CD2 4.05Å; L783-L825 HydrophobicContact CD1-CG 3.99Å; L783-L825 HydrophobicContact CG-CD1 4.23Å; L783-L825 HydrophobicContact CG-CD2 3.86Å; L783-L825 HydrophobicContact CG-CG 4.03Å
784	D	91.1	Very high	94.1	Very high	102 Å²	102	29.9 Å²	29.9	55%	0.545	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.2	177.8	-66.3	-19.6	0	0	0	111.8	K780 D781 C782 S786	K780-D784 WeakPolarHBondContact CE-OD2 3.48Å; K780-D784 WeakPolarHBondContact O-CB 3.42Å; K780-D784 PolarHBondContact O-N 3.11Å; D781-D784 CarbonylContact O-C 3.55Å; D781-D784 PolarHBondContact O-N 3.25Å; C782-D784 VanDerWaalsContact C-N 3.34Å; D784-S786 PolarHBondContact O-N 3.31Å; D784-S786 VanDerWaalsContact O-N 3.16Å
785	H	89.9	Confident	94.1	Very high	30 Å²	30	29.3 Å²	29.3	14%	0.139	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	24.9	-177.4	-57.9	69.8	0	0	0	113.2	D781 C782 L783 T787 L788 Y1157 H1158	D781-H785 PolarHBondContact O-N 3.22Å; D781-H785 VanDerWaalsContact O-N 3.08Å; C782-H785 PolarHBondContact O-N 3.45Å; C782-H785 VanDerWaalsContact O-N 3.12Å; L783-H785 PolarHBondContact O-CE1 3.04Å; L783-H785 VanDerWaalsContact O-CE1 3.29Å; L783-H785 PolarHBondContact O-N 3.34Å; L783-H785 PolarHBondContact O-ND1 3.38Å; H785-T787 VanDerWaalsContact C-N 3.35Å; H785-L788 HydrophobicContact CB-CD1 4.06Å; H785-L788 HydrophobicContact CB-CD2 4.18Å; H785-L788 HydrophobicContact CB-CG 4.19Å; H785-Y1157 PolarHBondContact CE1-O 2.85Å; H785-H1158 AromaticContact CD2-CE1 3.23Å; H785-H1158 PolarHBondContact CD2-CE1 2.88Å; H785-H1158 AromaticContact CD2-ND1 3.83Å; H785-H1158 AromaticContact CE1-CE1 3.63Å; H785-H1158 AromaticContact CE1-ND1 3.4Å; H785-H1158 PolarHBondContact CE1-ND1 2.87Å; H785-H1158 AromaticContact CG-CE1 3.45Å; H785-H1158 VanDerWaalsContact CG-CE1 3.45Å; H785-H1158 AromaticContact CG-ND1 3.86Å; H785-H1158 AromaticContact ND1-CE1 3.66Å; H785-H1158 AromaticContact ND1-ND1 3.58Å; H785-H1158 AromaticContact NE2-CE1 3.35Å; H785-H1158 PolarHBondContact NE2-CE1 2.8Å; H785-H1158 VanDerWaalsContact NE2-CE1 3.35Å; H785-H1158 AromaticContact NE2-ND1 3.53Å
786	S	89.6	Confident	94.1	Very high	41 Å²	41	30 Å²	30	29%	0.287	17%	0.172	S	C	.	.	S	Bend	trans	-77.3	-27.1	174.9	65.8	0	0	0	0	112.1	D781 D784	D781-S786 VanDerWaalsContact CA-OG 3.24Å; D781-S786 WeakPolarHBondContact CA-OG 3.41Å; D781-S786 VanDerWaalsContact CB-OG 3.25Å; D781-S786 WeakPolarHBondContact CB-OG 3.37Å; D781-S786 PolarHBondContact O-N 3.13Å; D781-S786 PolarHBondContact O-OG 3.48Å; D784-S786 PolarHBondContact O-N 3.31Å; D784-S786 VanDerWaalsContact O-N 3.16Å
787	T	91.2	Very high	94	Very high	36 Å²	36	33.2 Å²	33.2	22%	0.221	18%	0.183	C	C	.	.	S	Bend	trans	-130.3	119.9	171	-56.6	0	0	0	0	108.3	D781 C782 H785 P789 A798	D781-T787 PolarHBondContact O-N 2.8Å; C782-T787 WeakPolarHBondContact CA-O 3.47Å; C782-T787 PolarHBondContact SG-O 3.28Å; C782-T787 VanDerWaalsContact SG-O 3.41Å; H785-T787 VanDerWaalsContact C-N 3.35Å; T787-P789 HydrophobicContact CG2-CG 4.44Å; T787-P789 WeakPolarHBondContact O-CD 3.43Å; T787-A798 HydrophobicContact CG2-CB 3.7Å
788	L	91.7	Very high	94.1	Very high	43 Å²	43	31.6 Å²	31.6	23%	0.225	17%	0.172	C	C	.	.			trans	-123.6	85	-178.6	-75.4	169	0	0	0	110.4	H785 M790 P1121	H785-L788 HydrophobicContact CB-CD1 4.06Å; H785-L788 HydrophobicContact CB-CD2 4.18Å; H785-L788 HydrophobicContact CB-CG 4.19Å; L788-M790 PolarHBondContact O-N 3.12Å; L788-P1121 HydrophobicContact CD2-CB 4.25Å; L788-P1121 HydrophobicContact CD2-CG 4.08Å
789	P	94.5	Very high	94.1	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.013	17%	0.172	C	C	.	.			trans	-58.5	132.2	172.3	-22.6	35.3	0	0	0	110.3	T787 L795 A798 F828 I831 H1120	T787-P789 HydrophobicContact CG2-CG 4.44Å; T787-P789 WeakPolarHBondContact O-CD 3.43Å; P789-L795 HydrophobicContact CB-CB 3.95Å; P789-L795 HydrophobicContact CB-CD1 4.34Å; P789-L795 HydrophobicContact CG-CD1 4.14Å; P789-A798 HydrophobicContact CG-CB 4.2Å; P789-F828 HydrophobicContact CG-CD2 4.12Å; P789-F828 HydrophobicContact CG-CE2 4.3Å; P789-I831 WeakPolarHBondContact O-CD1 3.48Å; P789-H1120 PolarHBondContact O-NE2 3.23Å; P789-H1120 VanDerWaalsContact O-NE2 3.16Å
790	M	93.5	Very high	94.1	Very high	9 Å²	9	33.6 Å²	33.6	4%	0.044	18%	0.181	C	C	.	.			trans	-103.5	-24	178.4	-70.3	-173	-106.5	0	0	112.2	L788 T794 P1079 Q1083 M1112 C1116 E1122	L788-M790 PolarHBondContact O-N 3.12Å; M790-T794 PolarHBondContact N-OG1 3.48Å; M790-P1079 HydrophobicContact CB-CB 3.85Å; M790-P1079 HydrophobicContact CB-CG 3.89Å; M790-P1079 HydrophobicContact CE-CB 3.53Å; M790-P1079 HydrophobicContact CG-CB 4.28Å; M790-P1079 HydrophobicContact SD-CB 3.8Å; M790-Q1083 HydrophobicContact CE-CG 3.93Å; M790-M1112 HydrophobicContact CB-CE 4.39Å; M790-M1112 HydrophobicContact CG-CE 3.88Å; M790-M1112 HydrophobicContact SD-CE 3.82Å; M790-M1112 HydrophobicContact SD-SD 4.08Å; M790-C1116 VanDerWaalsContact O-CB 3.28Å; M790-C1116 WeakPolarHBondContact O-CB 3.27Å; M790-E1122 HydrophobicContact SD-CG 4.4Å
791	D	94.8	Very high	94.1	Very high	6 Å²	6	33.2 Å²	33.2	3%	0.032	18%	0.181	C	C	.	.	S	Bend	trans	-148.8	-177.7	-179.5	75.4	-7.4	0	0	0	112.2	A793 T794 L795 I831 R951 P1079 V1115	D791-A793 VanDerWaalsContact C-N 3.3Å; D791-A793 PolarHBondContact O-N 3.12Å; D791-A793 PolarHBondContact OD1-N 3.21Å; D791-T794 PolarHBondContact N-OG1 2.85Å; D791-T794 PolarHBondContact O-OG1 3.36Å; D791-T794 VanDerWaalsContact O-OG1 3.08Å; D791-T794 WeakPolarHBondContact OD1-CB 3.29Å; D791-T794 WeakPolarHBondContact OD1-CG2 3.38Å; D791-T794 PolarHBondContact OD1-N 3.22Å; D791-T794 PolarHBondContact OD1-OG1 3.49Å; D791-L795 WeakPolarHBondContact O-CB 3.12Å; D791-L795 PolarHBondContact O-N 2.92Å; D791-I831 WeakPolarHBondContact O-CG2 3.49Å; D791-R951 IonicContact OD2-CZ 3.8Å; D791-R951 IonicContact OD2-NH1 2.97Å; D791-R951 PolarHBondContact OD2-NH1 3.23Å; D791-R951 IonicContact OD2-NH2 3.71Å; D791-R951 PolarHBondContact OD2-NH2 2.85Å; D791-P1079 HydrophobicContact CB-CG 4.37Å; D791-V1115 HydrophobicContact CB-CG1 3.69Å
792	G	94.4	Very high	94.2	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-31.5	-177.9	0	0	0	0	0	114.3	T796 E835	G792-T796 WeakPolarHBondContact O-CB 3.41Å; G792-T796 PolarHBondContact O-N 2.84Å; G792-T796 PolarHBondContact O-OG1 3.48Å; G792-E835 WeakPolarHBondContact CA-OE2 3.37Å
793	A	93.9	Very high	94.2	Very high	52 Å²	52	35.7 Å²	35.7	43%	0.43	19%	0.189	S	C	.	.	H	α-helix	trans	-71.5	-50.4	178.5	0	0	0	0	0	111.1	D791 L795 T796 E797	D791-A793 VanDerWaalsContact C-N 3.3Å; D791-A793 PolarHBondContact O-N 3.12Å; D791-A793 PolarHBondContact OD1-N 3.21Å; A793-L795 VanDerWaalsContact C-N 3.3Å; A793-L795 PolarHBondContact O-N 3.04Å; A793-T796 WeakPolarHBondContact O-CB 3.3Å; A793-T796 PolarHBondContact O-N 3.14Å; A793-T796 VanDerWaalsContact O-N 3.12Å; A793-E797 PolarHBondContact O-N 2.86Å
794	T	95.7	Very high	94.5	Very high	20 Å²	20	33.7 Å²	33.7	12%	0.123	18%	0.179	C	C	.	.	H	α-helix	trans	-64.3	-32.4	176.1	50.8	0	0	0	0	112.5	M790 D791 E797 A798 P1079	M790-T794 PolarHBondContact N-OG1 3.48Å; D791-T794 PolarHBondContact N-OG1 2.85Å; D791-T794 PolarHBondContact O-OG1 3.36Å; D791-T794 VanDerWaalsContact O-OG1 3.08Å; D791-T794 WeakPolarHBondContact OD1-CB 3.29Å; D791-T794 WeakPolarHBondContact OD1-CG2 3.38Å; D791-T794 PolarHBondContact OD1-N 3.22Å; D791-T794 PolarHBondContact OD1-OG1 3.49Å; T794-E797 PolarHBondContact O-N 3.28Å; T794-A798 WeakPolarHBondContact O-CB 3.42Å; T794-A798 PolarHBondContact O-N 2.84Å; T794-P1079 HydrophobicContact CG2-CB 4.03Å; T794-P1079 HydrophobicContact CG2-CG 3.84Å
795	L	96.9	Very high	94.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.4	-43.8	170.6	175.4	62.3	0	0	0	112	P789 D791 A793 E797 A798 L799 L809 F828 I831 E835	P789-L795 HydrophobicContact CB-CB 3.95Å; P789-L795 HydrophobicContact CB-CD1 4.34Å; P789-L795 HydrophobicContact CG-CD1 4.14Å; D791-L795 WeakPolarHBondContact O-CB 3.12Å; D791-L795 PolarHBondContact O-N 2.92Å; A793-L795 VanDerWaalsContact C-N 3.3Å; A793-L795 PolarHBondContact O-N 3.04Å; L795-E797 VanDerWaalsContact C-N 3.28Å; L795-E797 PolarHBondContact O-N 2.97Å; L795-A798 PolarHBondContact O-N 3.24Å; L795-L799 HydrophobicContact CD1-CD1 4.45Å; L795-L799 HydrophobicContact CD1-CG 4.49Å; L795-L799 HydrophobicContact CG-CD1 4.24Å; L795-L799 WeakPolarHBondContact O-CG 3.46Å; L795-L799 PolarHBondContact O-N 3.04Å; L795-L809 HydrophobicContact CD2-CD1 4.19Å; L795-F828 HydrophobicContact CD1-CD2 4.01Å; L795-F828 HydrophobicContact CD1-CE2 3.3Å; L795-F828 HydrophobicContact CD1-CZ 3.86Å; L795-I831 HydrophobicContact CB-CG2 4.13Å; L795-I831 HydrophobicContact CD2-CG2 4.03Å; L795-E835 HydrophobicContact CD2-CB 4.22Å; L795-E835 HydrophobicContact CD2-CG 4.5Å
796	T	96.9	Very high	94.9	Very high	17 Å²	17	29.3 Å²	29.3	10%	0.104	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-40.5	176.6	-64.8	0	0	0	0	111	G792 A793 L799 H800 V806 E835 R839	G792-T796 WeakPolarHBondContact O-CB 3.41Å; G792-T796 PolarHBondContact O-N 2.84Å; G792-T796 PolarHBondContact O-OG1 3.48Å; A793-T796 WeakPolarHBondContact O-CB 3.3Å; A793-T796 PolarHBondContact O-N 3.14Å; A793-T796 VanDerWaalsContact O-N 3.12Å; T796-L799 PolarHBondContact O-N 3.37Å; T796-H800 WeakPolarHBondContact CG2-CE1 3.13Å; T796-H800 WeakPolarHBondContact O-CB 3.38Å; T796-H800 PolarHBondContact O-N 2.99Å; T796-H800 PolarHBondContact O-ND1 2.9Å; T796-V806 HydrophobicContact CG2-CG2 3.73Å; T796-E835 PolarHBondContact OG1-OE1 3.28Å; T796-R839 PolarHBondContact OG1-NH2 2.68Å
797	E	95.2	Very high	95.2	Very high	102 Å²	102	28 Å²	28	48%	0.477	15%	0.145	S	C	.	.	H	α-helix	trans	-63	-48.6	175.5	-167.2	-176.9	168.5	0	0	111.5	A793 T794 L795 L799 H800 Q801	A793-E797 PolarHBondContact O-N 2.86Å; T794-E797 PolarHBondContact O-N 3.28Å; L795-E797 VanDerWaalsContact C-N 3.28Å; L795-E797 PolarHBondContact O-N 2.97Å; E797-L799 VanDerWaalsContact C-N 3.31Å; E797-L799 PolarHBondContact O-N 3.3Å; E797-H800 PolarHBondContact O-N 3.48Å; E797-H800 VanDerWaalsContact O-N 3.1Å; E797-Q801 HydrophobicContact CG-CG 4.4Å; E797-Q801 WeakPolarHBondContact O-CG 3.38Å; E797-Q801 PolarHBondContact O-N 3.4Å; E797-Q801 PolarHBondContact OE1-NE2 3.32Å; E797-Q801 VanDerWaalsContact OE1-NE2 3.11Å
798	A	96.4	Very high	95.5	Very high	5 Å²	5	26.2 Å²	26.2	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-58.4	-40.4	177	0	0	0	0	0	112.8	L778 T787 P789 T794 L795 R802	L778-A798 HydrophobicContact CD1-CB 4.2Å; T787-A798 HydrophobicContact CG2-CB 3.7Å; P789-A798 HydrophobicContact CG-CB 4.2Å; T794-A798 WeakPolarHBondContact O-CB 3.42Å; T794-A798 PolarHBondContact O-N 2.84Å; L795-A798 PolarHBondContact O-N 3.24Å; A798-R802 PolarHBondContact O-N 2.99Å
799	L	97.7	Very high	95.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-48.9	173.2	-73	164.8	0	0	0	111.1	L778 L795 T796 E797 R802 G803 I804 V806 L809 V812	L778-L799 HydrophobicContact CD2-CD2 3.4Å; L778-L799 VanDerWaalsContact CD2-CD2 3.4Å; L778-L799 HydrophobicContact CD2-CG 4.15Å; L795-L799 HydrophobicContact CD1-CD1 4.45Å; L795-L799 HydrophobicContact CD1-CG 4.49Å; L795-L799 HydrophobicContact CG-CD1 4.24Å; L795-L799 WeakPolarHBondContact O-CG 3.46Å; L795-L799 PolarHBondContact O-N 3.04Å; T796-L799 PolarHBondContact O-N 3.37Å; E797-L799 VanDerWaalsContact C-N 3.31Å; E797-L799 PolarHBondContact O-N 3.3Å; L799-R802 CarbonylContact O-C 3.5Å; L799-R802 PolarHBondContact O-N 3.44Å; L799-G803 PolarHBondContact O-N 2.82Å; L799-I804 CarbonylContact C-O 3.58Å; L799-I804 HydrophobicContact CB-CB 4.3Å; L799-I804 HydrophobicContact CD2-CB 4.02Å; L799-I804 HydrophobicContact CD2-CD1 4.32Å; L799-I804 HydrophobicContact CD2-CG2 3.7Å; L799-I804 WeakPolarHBondContact O-CA 3.49Å; L799-I804 WeakPolarHBondContact O-CB 3.38Å; L799-I804 PolarHBondContact O-N 2.92Å; L799-V806 HydrophobicContact CD1-CG2 4.46Å; L799-L809 HydrophobicContact CD1-CD1 4.49Å; L799-V812 HydrophobicContact CD2-CG2 4.06Å
800	H	96.3	Very high	95.8	Very high	46 Å²	46	24.1 Å²	24.1	21%	0.213	12%	0.124	C	C	.	.	H	α-helix	trans	-66.8	-37.7	-178.2	-68.5	165.6	0	0	0	113.4	R599 E601 T796 E797 R802 G803 I804	R599-H800 VanDerWaalsContact CZ-CD2 3.46Å; R599-H800 PolarHBondContact NH1-CD2 2.95Å; R599-H800 PolarHBondContact NH1-CE1 3.02Å; R599-H800 PolarHBondContact NH1-NE2 2.89Å; E601-H800 WeakPolarHBondContact CB-O 3.38Å; E601-H800 WeakPolarHBondContact CG-O 3.49Å; T796-H800 WeakPolarHBondContact CG2-CE1 3.13Å; T796-H800 WeakPolarHBondContact O-CB 3.38Å; T796-H800 PolarHBondContact O-N 2.99Å; T796-H800 PolarHBondContact O-ND1 2.9Å; E797-H800 PolarHBondContact O-N 3.48Å; E797-H800 VanDerWaalsContact O-N 3.1Å; H800-R802 PolarHBondContact O-N 3.23Å; H800-G803 WeakPolarHBondContact O-CA 3.41Å; H800-G803 PolarHBondContact O-N 3.21Å; H800-I804 PolarHBondContact CD2-O 3.3Å
801	Q	94.8	Very high	95.9	Very high	119 Å²	119	23.9 Å²	23.9	56%	0.556	12%	0.123	S	C	*	.	H	α-helix	trans	-58.7	-30.9	174.6	-74	175.9	4.8	0	0	112	E797 G803	E797-Q801 HydrophobicContact CG-CG 4.4Å; E797-Q801 WeakPolarHBondContact O-CG 3.38Å; E797-Q801 PolarHBondContact O-N 3.4Å; E797-Q801 PolarHBondContact OE1-NE2 3.32Å; E797-Q801 VanDerWaalsContact OE1-NE2 3.11Å; Q801-G803 VanDerWaalsContact C-N 3.35Å
802	R	95.5	Very high	96.1	Very high	75 Å²	75	23.7 Å²	23.7	28%	0.283	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	7.4	173.2	-69.4	-68.3	-163.7	166.8	-7.3	113.7	Q774 L778 D781 A798 L799 H800 I804	Q774-R802 PolarHBondContact OE1-O 3.47Å; L778-R802 HydrophobicContact CB-CG 4.33Å; L778-R802 HydrophobicContact CD1-CG 4.27Å; D781-R802 IonicContact OD1-NH2 3.61Å; D781-R802 PolarHBondContact OD1-NH2 2.86Å; D781-R802 IonicContact OD2-CZ 2.84Å; D781-R802 IonicContact OD2-NE 3.19Å; D781-R802 PolarHBondContact OD2-NE 2.96Å; D781-R802 IonicContact OD2-NH2 3.45Å; D781-R802 PolarHBondContact OD2-NH2 3.43Å; A798-R802 PolarHBondContact O-N 2.99Å; L799-R802 CarbonylContact O-C 3.5Å; L799-R802 PolarHBondContact O-N 3.44Å; H800-R802 PolarHBondContact O-N 3.23Å; R802-I804 HydrophobicContact CB-CD1 3.91Å; R802-I804 HydrophobicContact CB-CG1 4.19Å; R802-I804 PolarHBondContact O-N 3.47Å
803	G	96	Very high	96.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.01	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	10.3	-177.4	0	0	0	0	0	115.1	L799 H800 Q801	L799-G803 PolarHBondContact O-N 2.82Å; H800-G803 WeakPolarHBondContact O-CA 3.41Å; H800-G803 PolarHBondContact O-N 3.21Å; Q801-G803 VanDerWaalsContact C-N 3.35Å
804	I	97.6	Very high	96.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.113	C	C	.	.			trans	-86.5	119.6	-178.6	-56.9	163.2	0	0	0	108.7	Q774 I775 L778 L799 H800 R802 Y808	Q774-I804 HydrophobicContact CB-CD1 4.28Å; Q774-I804 HydrophobicContact CB-CG1 4.15Å; I775-I804 HydrophobicContact CG1-CD1 3.91Å; I775-I804 HydrophobicContact CG1-CG1 4.27Å; I775-I804 HydrophobicContact CG1-CG2 4.38Å; L778-I804 HydrophobicContact CB-CD1 4.1Å; L778-I804 HydrophobicContact CD2-CD1 3.87Å; L799-I804 CarbonylContact C-O 3.58Å; L799-I804 HydrophobicContact CB-CB 4.3Å; L799-I804 HydrophobicContact CD2-CB 4.02Å; L799-I804 HydrophobicContact CD2-CD1 4.32Å; L799-I804 HydrophobicContact CD2-CG2 3.7Å; L799-I804 WeakPolarHBondContact O-CA 3.49Å; L799-I804 WeakPolarHBondContact O-CB 3.38Å; L799-I804 PolarHBondContact O-N 2.92Å; H800-I804 PolarHBondContact CD2-O 3.3Å; R802-I804 HydrophobicContact CB-CD1 3.91Å; R802-I804 HydrophobicContact CB-CG1 4.19Å; R802-I804 PolarHBondContact O-N 3.47Å; I804-Y808 HydrophobicContact CG2-CD2 4.42Å; I804-Y808 HydrophobicContact CG2-CG 4.3Å
805	N	95.4	Very high	96.1	Very high	33 Å²	33	25.8 Å²	25.8	18%	0.176	12%	0.12	C	C	.	.			trans	-74.7	143.3	173.5	-172.1	-68	0	0	0	110.7	R599 R807 Y808	R599-N805 HydrophobicContact CG-CB 4.37Å; N805-R807 HydrophobicContact CB-CG 3.98Å; N805-R807 PolarHBondContact ND2-NH2 3.23Å; N805-R807 PolarHBondContact O-N 3.42Å; N805-R807 WeakPolarHBondContact OD1-CG 3.44Å; N805-R807 PolarHBondContact OD1-N 2.63Å; N805-R807 PolarHBondContact OD1-NE 2.73Å; N805-Y808 HydrophobicContact CB-CD2 4.43Å; N805-Y808 WeakPolarHBondContact O-CB 3.46Å; N805-Y808 PolarHBondContact O-N 2.64Å
806	V	95.4	Very high	96.1	Very high	7 Å²	7	25.8 Å²	25.8	4%	0.042	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-56.8	-20.6	-179.7	-173.8	0	0	0	0	113.7	T796 L799 Y808 L809 Y926	T796-V806 HydrophobicContact CG2-CG2 3.73Å; L799-V806 HydrophobicContact CD1-CG2 4.46Å; V806-Y808 PolarHBondContact O-N 2.78Å; V806-Y808 VanDerWaalsContact O-N 3.1Å; V806-L809 HydrophobicContact CG1-CB 4.37Å; V806-L809 HydrophobicContact CG1-CD2 4.43Å; V806-L809 WeakPolarHBondContact O-CB 3.4Å; V806-L809 PolarHBondContact O-N 3.27Å; V806-Y926 HydrophobicContact CG1-CE1 4.3Å; V806-Y926 WeakPolarHBondContact O-CE1 3.01Å
807	R	95	Very high	95.9	Very high	13 Å²	13	28.7 Å²	28.7	5%	0.049	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-55	-25.3	170.2	70.8	-177.4	116.6	-121.8	4.4	113.6	D567 F570 C597 N805 L809 Y925	D567-R807 IonicContact OD2-NE 3.82Å; F570-R807 HydrophobicContact CD2-CG 4.19Å; F570-R807 HydrophobicContact CE2-CG 3.73Å; F570-R807 HydrophobicContact CZ-CB 4.35Å; F570-R807 HydrophobicContact CZ-CG 3.92Å; C597-R807 PolarHBondContact O-NH2 3.08Å; C597-R807 VanDerWaalsContact O-NH2 3.08Å; N805-R807 HydrophobicContact CB-CG 3.98Å; N805-R807 PolarHBondContact ND2-NH2 3.23Å; N805-R807 PolarHBondContact O-N 3.42Å; N805-R807 WeakPolarHBondContact OD1-CG 3.44Å; N805-R807 PolarHBondContact OD1-N 2.63Å; N805-R807 PolarHBondContact OD1-NE 2.73Å; R807-L809 VanDerWaalsContact C-N 3.3Å; R807-L809 PolarHBondContact O-N 3.39Å; R807-Y925 HydrophobicContact CB-CE1 4.48Å
808	Y	97.1	Very high	95.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-81	-0.2	175.2	-75.5	-89.7	0	0	0	114.6	D567 N569 F570 F587 L770 V771 I775 I804 N805 V806 G810 T811 V812	D567-Y808 PolarHBondContact OD1-OH 2.91Å; D567-Y808 VanDerWaalsContact OD1-OH 3.13Å; D567-Y808 WeakPolarHBondContact OD2-CE2 3.44Å; D567-Y808 PolarHBondContact OD2-OH 3.47Å; N569-Y808 HydrophobicContact CB-CE1 4.43Å; N569-Y808 WeakPolarHBondContact CB-OH 3.28Å; N569-Y808 PolarHBondContact ND2-OH 2.99Å; F570-Y808 HydrophobicContact CD2-CE2 4.06Å; F570-Y808 AromaticContact CD2-CZ 3.96Å; F570-Y808 HydrophobicContact CE2-CD1 4.03Å; F570-Y808 AromaticContact CE2-CD2 3.88Å; F570-Y808 HydrophobicContact CE2-CD2 3.88Å; F570-Y808 AromaticContact CE2-CE1 3.67Å; F570-Y808 HydrophobicContact CE2-CE1 3.67Å; F570-Y808 AromaticContact CE2-CE2 3.51Å; F570-Y808 HydrophobicContact CE2-CE2 3.51Å; F570-Y808 HydrophobicContact CE2-CG 4.14Å; F570-Y808 AromaticContact CE2-CZ 3.42Å; F570-Y808 VanDerWaalsContact CE2-CZ 3.42Å; F570-Y808 HydrophobicContact CZ-CD1 4.47Å; F570-Y808 HydrophobicContact CZ-CE1 4.45Å; F587-Y808 AromaticContact CE1-CE1 3.97Å; F587-Y808 HydrophobicContact CE1-CE1 3.97Å; F587-Y808 HydrophobicContact CE2-CE1 4.37Å; F587-Y808 AromaticContact CZ-CD1 3.95Å; F587-Y808 HydrophobicContact CZ-CD1 3.95Å; F587-Y808 AromaticContact CZ-CE1 3.57Å; F587-Y808 HydrophobicContact CZ-CE1 3.57Å; L770-Y808 HydrophobicContact CD1-CD2 4.32Å; L770-Y808 HydrophobicContact CD1-CE2 3.65Å; L770-Y808 HydrophobicContact CD2-CD1 3.73Å; L770-Y808 HydrophobicContact CD2-CD2 4.12Å; L770-Y808 HydrophobicContact CD2-CE1 3.38Å; L770-Y808 HydrophobicContact CD2-CE2 3.8Å; L770-Y808 HydrophobicContact CD2-CG 4.06Å; L770-Y808 HydrophobicContact CG-CE2 4.44Å; V771-Y808 HydrophobicContact CG2-CE1 3.87Å; I775-Y808 HydrophobicContact CD1-CD1 3.89Å; I775-Y808 HydrophobicContact CD1-CG 4.4Å; I804-Y808 HydrophobicContact CG2-CD2 4.42Å; I804-Y808 HydrophobicContact CG2-CG 4.3Å; N805-Y808 HydrophobicContact CB-CD2 4.43Å; N805-Y808 WeakPolarHBondContact O-CB 3.46Å; N805-Y808 PolarHBondContact O-N 2.64Å; V806-Y808 PolarHBondContact O-N 2.78Å; V806-Y808 VanDerWaalsContact O-N 3.1Å; Y808-G810 PolarHBondContact O-N 3.02Å; Y808-G810 VanDerWaalsContact O-N 3.16Å; Y808-T811 WeakPolarHBondContact O-CA 3.41Å; Y808-T811 WeakPolarHBondContact O-CB 3.37Å; Y808-T811 PolarHBondContact O-N 3.48Å; Y808-V812 PolarHBondContact O-N 3.17Å
809	L	97.3	Very high	95.6	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-53.4	-40.3	-175.6	-179.4	60.9	0	0	0	112.6	L795 L799 V806 R807 T811 V812 L813 E835 L836 Y926	L795-L809 HydrophobicContact CD2-CD1 4.19Å; L799-L809 HydrophobicContact CD1-CD1 4.49Å; V806-L809 HydrophobicContact CG1-CB 4.37Å; V806-L809 HydrophobicContact CG1-CD2 4.43Å; V806-L809 WeakPolarHBondContact O-CB 3.4Å; V806-L809 PolarHBondContact O-N 3.27Å; R807-L809 VanDerWaalsContact C-N 3.3Å; R807-L809 PolarHBondContact O-N 3.39Å; L809-T811 PolarHBondContact O-N 3.11Å; L809-V812 PolarHBondContact O-N 3.39Å; L809-L813 HydrophobicContact CD1-CD1 4.44Å; L809-L813 HydrophobicContact CD1-CG 4.4Å; L809-L813 HydrophobicContact CG-CD1 4.19Å; L809-L813 VanDerWaalsContact O-CG 3.3Å; L809-L813 WeakPolarHBondContact O-CG 3.45Å; L809-L813 PolarHBondContact O-N 3.41Å; L809-E835 HydrophobicContact CD2-CB 4.17Å; L809-E835 HydrophobicContact CD2-CG 3.98Å; L809-L836 HydrophobicContact CD2-CB 3.91Å; L809-L836 HydrophobicContact CD2-CD1 4.27Å; L809-Y926 HydrophobicContact CB-CD1 4.06Å; L809-Y926 HydrophobicContact CB-CE1 4.39Å
810	G	96.3	Very high	95.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.7	-40.1	175.5	0	0	0	0	0	113.4	Y808 L813 E814 Y926	Y808-G810 PolarHBondContact O-N 3.02Å; Y808-G810 VanDerWaalsContact O-N 3.16Å; G810-L813 PolarHBondContact O-N 2.74Å; G810-E814 WeakPolarHBondContact O-CG 3.43Å; G810-E814 PolarHBondContact O-N 3.13Å; G810-Y926 WeakPolarHBondContact CA-O 3.11Å
811	T	96.2	Very high	95	Very high	4 Å²	4	38 Å²	38	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-64.8	-41	174.7	-56.4	0	0	0	0	111.8	F587 R589 I775 Y808 L809 E814 F815	F587-T811 HydrophobicContact CE2-CG2 4.33Å; F587-T811 HydrophobicContact CZ-CG2 4.3Å; R589-T811 PolarHBondContact NH1-OG1 3.44Å; R589-T811 VanDerWaalsContact NH1-OG1 3.07Å; I775-T811 HydrophobicContact CD1-CG2 4.03Å; Y808-T811 WeakPolarHBondContact O-CA 3.41Å; Y808-T811 WeakPolarHBondContact O-CB 3.37Å; Y808-T811 PolarHBondContact O-N 3.48Å; L809-T811 PolarHBondContact O-N 3.11Å; T811-E814 PolarHBondContact O-N 2.65Å; T811-F815 WeakPolarHBondContact O-CB 3.48Å; T811-F815 PolarHBondContact O-N 3.16Å
812	V	97.1	Very high	94.9	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-46.4	175.8	174.3	0	0	0	0	110.4	I775 V779 L799 Y808 L809 F815 V816 F828	I775-V812 HydrophobicContact CD1-CG2 4.27Å; I775-V812 HydrophobicContact CG1-CG2 4.13Å; I775-V812 HydrophobicContact CG2-CG2 4.08Å; V779-V812 HydrophobicContact CG2-CG1 4.46Å; L799-V812 HydrophobicContact CD2-CG2 4.06Å; Y808-V812 PolarHBondContact O-N 3.17Å; L809-V812 PolarHBondContact O-N 3.39Å; V812-F815 WeakPolarHBondContact O-CB 3.37Å; V812-F815 PolarHBondContact O-N 2.92Å; V812-V816 WeakPolarHBondContact O-CG2 3.38Å; V812-V816 PolarHBondContact O-N 2.8Å; V812-F828 HydrophobicContact CG1-CE1 3.69Å; V812-F828 HydrophobicContact CG1-CZ 3.71Å
813	L	96.6	Very high	94.7	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-43.7	177.6	-72	171.1	0	0	0	112.4	L809 G810 F815 V816 D817 Y829 I833 L836 F928	L809-L813 HydrophobicContact CD1-CD1 4.44Å; L809-L813 HydrophobicContact CD1-CG 4.4Å; L809-L813 HydrophobicContact CG-CD1 4.19Å; L809-L813 VanDerWaalsContact O-CG 3.3Å; L809-L813 WeakPolarHBondContact O-CG 3.45Å; L809-L813 PolarHBondContact O-N 3.41Å; G810-L813 PolarHBondContact O-N 2.74Å; L813-F815 VanDerWaalsContact C-N 3.31Å; L813-F815 PolarHBondContact O-N 3.25Å; L813-V816 PolarHBondContact O-N 2.96Å; L813-D817 WeakPolarHBondContact O-CB 3.45Å; L813-D817 PolarHBondContact O-N 3.08Å; L813-Y829 HydrophobicContact CB-CE2 4.13Å; L813-Y829 HydrophobicContact CD2-CD2 3.63Å; L813-Y829 HydrophobicContact CD2-CE2 3.86Å; L813-Y829 HydrophobicContact CD2-CG 4.3Å; L813-I833 HydrophobicContact CD1-CD1 3.91Å; L813-I833 HydrophobicContact CD2-CD1 4.4Å; L813-I833 HydrophobicContact CD2-CG1 4.33Å; L813-L836 HydrophobicContact CD1-CB 4.37Å; L813-L836 HydrophobicContact CD1-CD2 4.09Å; L813-F928 HydrophobicContact CB-CD2 4.05Å; L813-F928 HydrophobicContact CB-CE2 3.78Å; L813-F928 HydrophobicContact CD1-CD2 4.35Å; L813-F928 HydrophobicContact CD1-CE2 4.31Å
814	E	94.6	Very high	94.6	Very high	55 Å²	55	38.6 Å²	38.6	26%	0.257	21%	0.209	S	C	.	.	H	α-helix	trans	-62.9	-36.9	174.8	-77.9	-171.6	-174	0	0	112.7	G810 T811 D817 K818 F928	G810-E814 WeakPolarHBondContact O-CG 3.43Å; G810-E814 PolarHBondContact O-N 3.13Å; T811-E814 PolarHBondContact O-N 2.65Å; E814-D817 PolarHBondContact O-N 3.01Å; E814-K818 VanDerWaalsContact O-CG 3.31Å; E814-K818 WeakPolarHBondContact O-CG 3.14Å; E814-K818 PolarHBondContact O-N 2.85Å; E814-K818 VanDerWaalsContact O-N 3.12Å; E814-K818 IonicContact OE2-NZ 3.28Å; E814-F928 HydrophobicContact CG-CD2 4.32Å
815	F	94.9	Very high	94.5	Very high	61 Å²	61	38.6 Å²	38.6	27%	0.268	21%	0.209	S	C	.	.	H	α-helix	trans	-64.5	-44.8	176.4	-175.7	-86.6	0	0	0	111	I775 P776 V779 T811 V812 L813 D817 K818 T819	I775-F815 HydrophobicContact CG2-CB 4.42Å; I775-F815 HydrophobicContact CG2-CG 4.4Å; P776-F815 HydrophobicContact CB-CE1 4.43Å; P776-F815 HydrophobicContact CB-CE2 4.39Å; P776-F815 HydrophobicContact CB-CZ 3.85Å; P776-F815 HydrophobicContact CG-CE2 3.94Å; P776-F815 HydrophobicContact CG-CZ 3.91Å; V779-F815 HydrophobicContact CB-CD1 4.12Å; V779-F815 HydrophobicContact CB-CE1 4.02Å; V779-F815 HydrophobicContact CG1-CD1 4.1Å; V779-F815 HydrophobicContact CG1-CE1 3.99Å; V779-F815 HydrophobicContact CG2-CD1 3.83Å; V779-F815 HydrophobicContact CG2-CE1 4.22Å; T811-F815 WeakPolarHBondContact O-CB 3.48Å; T811-F815 PolarHBondContact O-N 3.16Å; V812-F815 WeakPolarHBondContact O-CB 3.37Å; V812-F815 PolarHBondContact O-N 2.92Å; L813-F815 VanDerWaalsContact C-N 3.31Å; L813-F815 PolarHBondContact O-N 3.25Å; F815-D817 VanDerWaalsContact C-N 3.33Å; F815-D817 PolarHBondContact O-N 3.48Å; F815-K818 PolarHBondContact O-N 3.41Å; F815-T819 PolarHBondContact O-N 3.48Å; F815-T819 VanDerWaalsContact O-N 3.16Å; F815-T819 PolarHBondContact O-OG1 2.63Å
816	V	95.7	Very high	94.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-41.8	175	173.9	0	0	0	0	111.2	V779 V812 L813 K818 T819 L825 F828 Y829	V779-V816 HydrophobicContact CG1-CG2 4.1Å; V779-V816 HydrophobicContact CG2-CG2 3.87Å; V812-V816 WeakPolarHBondContact O-CG2 3.38Å; V812-V816 PolarHBondContact O-N 2.8Å; L813-V816 PolarHBondContact O-N 2.96Å; V816-K818 VanDerWaalsContact C-N 3.27Å; V816-K818 PolarHBondContact O-N 2.84Å; V816-T819 WeakPolarHBondContact O-CB 3.22Å; V816-T819 PolarHBondContact O-N 2.72Å; V816-T819 VanDerWaalsContact O-N 3.12Å; V816-L825 HydrophobicContact CG1-CB 3.82Å; V816-L825 HydrophobicContact CG1-CD1 3.97Å; V816-L825 HydrophobicContact CG2-CD1 4.3Å; V816-F828 HydrophobicContact CG2-CD1 3.87Å; V816-F828 HydrophobicContact CG2-CE1 3.74Å; V816-Y829 HydrophobicContact CB-CD2 4.21Å; V816-Y829 HydrophobicContact CG1-CD2 3.92Å; V816-Y829 HydrophobicContact CG1-CG 4.41Å
817	D	92.8	Very high	94.4	Very high	79 Å²	79	40.5 Å²	40.5	42%	0.422	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-33.2	180	-163	48	0	0	0	112.8	L813 E814 F815 K822 Y829	L813-D817 WeakPolarHBondContact O-CB 3.45Å; L813-D817 PolarHBondContact O-N 3.08Å; E814-D817 PolarHBondContact O-N 3.01Å; F815-D817 VanDerWaalsContact C-N 3.33Å; F815-D817 PolarHBondContact O-N 3.48Å; D817-K822 VanDerWaalsContact OD1-CE 3.29Å; D817-K822 WeakPolarHBondContact OD1-CE 3.35Å; D817-K822 IonicContact OD1-NZ 2.75Å; D817-K822 PolarHBondContact OD1-NZ 3.29Å; D817-Y829 HydrophobicContact CB-CE2 4.32Å
818	K	92.2	Very high	94.4	Very high	157 Å²	157	40 Å²	40	68%	0.683	21%	0.214	S	C	*	.	H	α-helix	trans	-83.9	-11.2	177.2	-67.8	168	-172.4	163.8	0	113.6	E814 F815 V816	E814-K818 VanDerWaalsContact O-CG 3.31Å; E814-K818 WeakPolarHBondContact O-CG 3.14Å; E814-K818 PolarHBondContact O-N 2.85Å; E814-K818 VanDerWaalsContact O-N 3.12Å; E814-K818 IonicContact OE2-NZ 3.28Å; F815-K818 PolarHBondContact O-N 3.41Å; V816-K818 VanDerWaalsContact C-N 3.27Å; V816-K818 PolarHBondContact O-N 2.84Å
819	T	93.6	Very high	94.4	Very high	27 Å²	27	40.8 Å²	40.8	17%	0.166	22%	0.217	C	C	.	.	S	Bend	trans	-80.7	133.4	-175.1	-65.4	0	0	0	0	110.6	F815 V816 A821 K822 L825	F815-T819 PolarHBondContact O-N 3.48Å; F815-T819 VanDerWaalsContact O-N 3.16Å; F815-T819 PolarHBondContact O-OG1 2.63Å; V816-T819 WeakPolarHBondContact O-CB 3.22Å; V816-T819 PolarHBondContact O-N 2.72Å; V816-T819 VanDerWaalsContact O-N 3.12Å; T819-A821 HydrophobicContact CG2-CB 4.18Å; T819-A821 PolarHBondContact O-N 3.47Å; T819-A821 VanDerWaalsContact O-N 3.13Å; T819-K822 WeakPolarHBondContact O-CB 3.4Å; T819-K822 PolarHBondContact O-N 2.97Å; T819-L825 HydrophobicContact CG2-CD1 4.47Å
820	P	90.6	Very high	94.3	Very high	139 Å²	139	41.7 Å²	41.7	90%	0.903	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.5	-179.2	24.6	-35.1	0	0	0	113.4	K822	P820-K822 VanDerWaalsContact C-N 3.29Å; P820-K822 PolarHBondContact O-N 3.33Å
821	A	90.1	Very high	94.3	Very high	24 Å²	24	42 Å²	42	20%	0.198	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	17.1	176.2	0	0	0	0	0	114.3	L783 T819 A823 Q824 L825	L783-A821 HydrophobicContact CD1-CB 4.25Å; L783-A821 HydrophobicContact CD2-CB 3.75Å; L783-A821 HydrophobicContact CG-CB 4.43Å; T819-A821 HydrophobicContact CG2-CB 4.18Å; T819-A821 PolarHBondContact O-N 3.47Å; T819-A821 VanDerWaalsContact O-N 3.13Å; A821-A823 PolarHBondContact O-N 2.79Å; A821-A823 VanDerWaalsContact O-N 3.07Å; A821-Q824 WeakPolarHBondContact O-CB 3.38Å; A821-Q824 PolarHBondContact O-N 3.4Å; A821-L825 PolarHBondContact O-N 3.47Å
822	K	92.9	Very high	94.3	Very high	84 Å²	84	41.9 Å²	41.9	37%	0.365	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-46.8	-40.2	179.6	179.3	-175.2	174.6	179.5	0	113.8	D817 T819 P820 Q824 L825 E826	D817-K822 VanDerWaalsContact OD1-CE 3.29Å; D817-K822 WeakPolarHBondContact OD1-CE 3.35Å; D817-K822 IonicContact OD1-NZ 2.75Å; D817-K822 PolarHBondContact OD1-NZ 3.29Å; T819-K822 WeakPolarHBondContact O-CB 3.4Å; T819-K822 PolarHBondContact O-N 2.97Å; P820-K822 VanDerWaalsContact C-N 3.29Å; P820-K822 PolarHBondContact O-N 3.33Å; K822-Q824 PolarHBondContact O-N 2.89Å; K822-L825 CarbonylContact O-C 3.56Å; K822-L825 WeakPolarHBondContact O-CA 3.45Å; K822-L825 PolarHBondContact O-N 2.79Å; K822-E826 PolarHBondContact O-N 3.36Å; K822-E826 VanDerWaalsContact O-N 3.11Å
823	A	91.9	Very high	94.3	Very high	64 Å²	64	41.9 Å²	41.9	53%	0.529	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-60.7	-33.4	-179.7	0	0	0	0	0	113	A821 L825	A821-A823 PolarHBondContact O-N 2.79Å; A821-A823 VanDerWaalsContact O-N 3.07Å; A823-L825 VanDerWaalsContact C-N 3.29Å
824	Q	93.9	Very high	94.4	Very high	60 Å²	60	42.3 Å²	42.3	28%	0.28	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-79.6	-12.8	175	-64.6	175.7	4.6	0	0	112.6	A821 K822 Y1157	A821-Q824 WeakPolarHBondContact O-CB 3.38Å; A821-Q824 PolarHBondContact O-N 3.4Å; K822-Q824 PolarHBondContact O-N 2.89Å; Q824-Y1157 VanDerWaalsContact O-CD1 3.27Å; Q824-Y1157 WeakPolarHBondContact O-CD1 3.5Å
825	L	95.1	Very high	94.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-107.6	10.2	178.8	-67.2	172.3	0	0	0	112.6	V779 C782 L783 V816 T819 A821 K822 A823 H827 F828 Y829	V779-L825 HydrophobicContact CG1-CD1 3.55Å; C782-L825 HydrophobicContact CB-CD2 4.03Å; L783-L825 HydrophobicContact CB-CD2 4.32Å; L783-L825 HydrophobicContact CD1-CD1 3.63Å; L783-L825 HydrophobicContact CD1-CD2 4.05Å; L783-L825 HydrophobicContact CD1-CG 3.99Å; L783-L825 HydrophobicContact CG-CD1 4.23Å; L783-L825 HydrophobicContact CG-CD2 3.86Å; L783-L825 HydrophobicContact CG-CG 4.03Å; V816-L825 HydrophobicContact CG1-CB 3.82Å; V816-L825 HydrophobicContact CG1-CD1 3.97Å; V816-L825 HydrophobicContact CG2-CD1 4.3Å; T819-L825 HydrophobicContact CG2-CD1 4.47Å; A821-L825 PolarHBondContact O-N 3.47Å; K822-L825 CarbonylContact O-C 3.56Å; K822-L825 WeakPolarHBondContact O-CA 3.45Å; K822-L825 PolarHBondContact O-N 2.79Å; A823-L825 VanDerWaalsContact C-N 3.29Å; L825-H827 VanDerWaalsContact C-N 3.28Å; L825-H827 PolarHBondContact O-N 2.94Å; L825-F828 PolarHBondContact O-N 3.39Å; L825-F828 VanDerWaalsContact O-N 3.13Å; L825-Y829 WeakPolarHBondContact O-CB 3.22Å; L825-Y829 PolarHBondContact O-N 2.94Å
826	E	94.8	Very high	94.6	Very high	81 Å²	81	36.9 Å²	36.9	38%	0.379	20%	0.2	S	C	.	.	H	α-helix	trans	-61.5	-36.4	-173.7	-169.3	171.3	-171.3	0	0	112.5	K822 Y829 R830 K1156 Y1157	K822-E826 PolarHBondContact O-N 3.36Å; K822-E826 VanDerWaalsContact O-N 3.11Å; E826-Y829 PolarHBondContact O-N 3.37Å; E826-R830 VanDerWaalsContact O-CB 3.3Å; E826-R830 WeakPolarHBondContact O-CB 3.25Å; E826-R830 PolarHBondContact O-N 3.4Å; E826-K1156 WeakPolarHBondContact OE2-CE 3.44Å; E826-K1156 IonicContact OE2-NZ 3.09Å; E826-K1156 PolarHBondContact OE2-NZ 2.84Å; E826-Y1157 HydrophobicContact CB-CE1 4.34Å
827	H	93.6	Very high	94.7	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-50.1	173.4	70.7	-79.7	0	0	0	111.8	L825 R830 I831 H1120 P1121 Y1157	L825-H827 VanDerWaalsContact C-N 3.28Å; L825-H827 PolarHBondContact O-N 2.94Å; H827-R830 PolarHBondContact O-N 3.26Å; H827-I831 VanDerWaalsContact O-CG1 3.31Å; H827-I831 WeakPolarHBondContact O-CG1 3.29Å; H827-I831 PolarHBondContact O-N 3.47Å; H827-H1120 AromaticContact CD2-NE2 3.88Å; H827-P1121 VanDerWaalsContact CG-CD 3.46Å; H827-Y1157 HydrophobicContact CB-CE1 4Å; H827-Y1157 AromaticContact ND1-CD1 3.57Å; H827-Y1157 AromaticContact ND1-CE1 3.42Å; H827-Y1157 WeakPolarHBondContact ND1-CE1 3.42Å
828	F	95.6	Very high	95	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-43.9	178.4	175.5	-94.6	0	0	0	111.4	L778 C782 P789 L795 V812 V816 L825 I831 G832	L778-F828 HydrophobicContact CD2-CZ 4.41Å; C782-F828 HydrophobicContact CB-CD2 4.31Å; P789-F828 HydrophobicContact CG-CD2 4.12Å; P789-F828 HydrophobicContact CG-CE2 4.3Å; L795-F828 HydrophobicContact CD1-CD2 4.01Å; L795-F828 HydrophobicContact CD1-CE2 3.3Å; L795-F828 HydrophobicContact CD1-CZ 3.86Å; V812-F828 HydrophobicContact CG1-CE1 3.69Å; V812-F828 HydrophobicContact CG1-CZ 3.71Å; V816-F828 HydrophobicContact CG2-CD1 3.87Å; V816-F828 HydrophobicContact CG2-CE1 3.74Å; L825-F828 PolarHBondContact O-N 3.39Å; L825-F828 VanDerWaalsContact O-N 3.13Å; F828-I831 PolarHBondContact O-N 3.25Å; F828-G832 PolarHBondContact O-N 3.35Å
829	Y	95.8	Very high	95.2	Very high	17 Å²	17	28 Å²	28	7%	0.067	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-45.4	176.7	-173.1	-98.4	0	0	0	111.5	L813 V816 D817 L825 E826 G832 I833 Y942	L813-Y829 HydrophobicContact CB-CE2 4.13Å; L813-Y829 HydrophobicContact CD2-CD2 3.63Å; L813-Y829 HydrophobicContact CD2-CE2 3.86Å; L813-Y829 HydrophobicContact CD2-CG 4.3Å; V816-Y829 HydrophobicContact CB-CD2 4.21Å; V816-Y829 HydrophobicContact CG1-CD2 3.92Å; V816-Y829 HydrophobicContact CG1-CG 4.41Å; D817-Y829 HydrophobicContact CB-CE2 4.32Å; L825-Y829 WeakPolarHBondContact O-CB 3.22Å; L825-Y829 PolarHBondContact O-N 2.94Å; E826-Y829 PolarHBondContact O-N 3.37Å; Y829-G832 PolarHBondContact O-N 2.93Å; Y829-I833 HydrophobicContact CD1-CG1 4.09Å; Y829-I833 HydrophobicContact CE1-CD1 4.13Å; Y829-I833 HydrophobicContact CE1-CG1 3.74Å; Y829-I833 VanDerWaalsContact O-CG1 3.31Å; Y829-I833 WeakPolarHBondContact O-CG1 3.35Å; Y829-I833 PolarHBondContact O-N 3.47Å; Y829-Y942 AromaticContact CE1-CD1 3.85Å; Y829-Y942 HydrophobicContact CE1-CD1 3.85Å; Y829-Y942 AromaticContact CE1-CE1 3.99Å; Y829-Y942 HydrophobicContact CE1-CE1 3.99Å
830	R	95.5	Very high	95.4	Very high	20 Å²	20	26.7 Å²	26.7	8%	0.075	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-48.8	178	-174.2	171.3	65.6	-123.8	-0	111.8	E826 H827 G832 I833 V834 G943 L944 C1116 D1119	E826-R830 VanDerWaalsContact O-CB 3.3Å; E826-R830 WeakPolarHBondContact O-CB 3.25Å; E826-R830 PolarHBondContact O-N 3.4Å; H827-R830 PolarHBondContact O-N 3.26Å; R830-G832 VanDerWaalsContact C-N 3.3Å; R830-G832 PolarHBondContact O-N 3.44Å; R830-I833 PolarHBondContact O-N 2.93Å; R830-V834 WeakPolarHBondContact O-CG2 3.44Å; R830-V834 PolarHBondContact O-N 3.36Å; R830-G943 VanDerWaalsContact CD-O 3.22Å; R830-G943 WeakPolarHBondContact CD-O 3.24Å; R830-L944 HydrophobicContact CG-CD2 3.4Å; R830-C1116 PolarHBondContact NH2-O 3.1Å; R830-D1119 PolarHBondContact NH1-O 3.1Å; R830-D1119 IonicContact NH1-OD2 3.29Å; R830-D1119 PolarHBondContact NH1-OD2 2.89Å; R830-D1119 PolarHBondContact NH2-O 3.44Å
831	I	96.6	Very high	95.8	Very high	7 Å²	7	20 Å²	20	4%	0.036	11%	0.105	C	C	.	.	H	α-helix	trans	-60.8	-42.2	177.5	-65.4	165.2	0	0	0	110.3	P789 D791 L795 H827 F828 I833 V834 E835	P789-I831 WeakPolarHBondContact O-CD1 3.48Å; D791-I831 WeakPolarHBondContact O-CG2 3.49Å; L795-I831 HydrophobicContact CB-CG2 4.13Å; L795-I831 HydrophobicContact CD2-CG2 4.03Å; H827-I831 VanDerWaalsContact O-CG1 3.31Å; H827-I831 WeakPolarHBondContact O-CG1 3.29Å; H827-I831 PolarHBondContact O-N 3.47Å; F828-I831 PolarHBondContact O-N 3.25Å; I831-I833 PolarHBondContact O-N 2.81Å; I831-V834 WeakPolarHBondContact O-CB 3.48Å; I831-V834 PolarHBondContact O-N 2.93Å; I831-E835 WeakPolarHBondContact O-CB 3.37Å; I831-E835 PolarHBondContact O-N 2.81Å
832	G	97.1	Very high	96.1	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-63.9	-36.3	176.4	0	0	0	0	0	113.6	F828 Y829 R830 E835 L836	F828-G832 PolarHBondContact O-N 3.35Å; Y829-G832 PolarHBondContact O-N 2.93Å; R830-G832 VanDerWaalsContact C-N 3.3Å; R830-G832 PolarHBondContact O-N 3.44Å; G832-E835 PolarHBondContact O-N 2.74Å; G832-L836 VanDerWaalsContact O-CB 3.26Å; G832-L836 WeakPolarHBondContact O-CB 3.33Å; G832-L836 PolarHBondContact O-N 3.48Å
833	I	97.3	Very high	96.2	Very high	2 Å²	2	19 Å²	19	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-68	-42.3	173.5	-65.4	-70.7	0	0	0	111.2	L813 Y829 R830 I831 L836 I837 F928 Y942 L944	L813-I833 HydrophobicContact CD1-CD1 3.91Å; L813-I833 HydrophobicContact CD2-CD1 4.4Å; L813-I833 HydrophobicContact CD2-CG1 4.33Å; Y829-I833 HydrophobicContact CD1-CG1 4.09Å; Y829-I833 HydrophobicContact CE1-CD1 4.13Å; Y829-I833 HydrophobicContact CE1-CG1 3.74Å; Y829-I833 VanDerWaalsContact O-CG1 3.31Å; Y829-I833 WeakPolarHBondContact O-CG1 3.35Å; Y829-I833 PolarHBondContact O-N 3.47Å; R830-I833 PolarHBondContact O-N 2.93Å; I831-I833 PolarHBondContact O-N 2.81Å; I833-L836 PolarHBondContact O-N 3Å; I833-I837 HydrophobicContact CG2-CD1 3.78Å; I833-I837 HydrophobicContact CG2-CG1 4.41Å; I833-I837 WeakPolarHBondContact O-CB 3.36Å; I833-I837 VanDerWaalsContact O-CG1 3.3Å; I833-I837 WeakPolarHBondContact O-CG1 3.18Å; I833-I837 PolarHBondContact O-N 3.37Å; I833-F928 HydrophobicContact CD1-CE1 3.81Å; I833-F928 HydrophobicContact CD1-CE2 4.49Å; I833-F928 HydrophobicContact CD1-CZ 3.64Å; I833-Y942 HydrophobicContact CD1-CE1 4.37Å; I833-Y942 HydrophobicContact CG1-CD1 4.36Å; I833-Y942 HydrophobicContact CG2-CD2 3.91Å; I833-Y942 HydrophobicContact CG2-CE2 4.28Å; I833-Y942 HydrophobicContact CG2-CG 4.07Å; I833-L944 HydrophobicContact CG2-CD1 4.11Å
834	V	97.1	Very high	96.4	Very high	10 Å²	10	17.2 Å²	17.2	6%	0.061	8%	0.078	C	C	.	.	H	α-helix	trans	-58.4	-47.9	173.4	168	0	0	0	0	110.6	R830 I831 L836 I837 T838 L944 T948 L949 E952	R830-V834 WeakPolarHBondContact O-CG2 3.44Å; R830-V834 PolarHBondContact O-N 3.36Å; I831-V834 WeakPolarHBondContact O-CB 3.48Å; I831-V834 PolarHBondContact O-N 2.93Å; V834-L836 VanDerWaalsContact C-N 3.35Å; V834-L836 PolarHBondContact O-N 3.14Å; V834-I837 PolarHBondContact O-N 3.25Å; V834-T838 HydrophobicContact CG1-CG2 4.31Å; V834-T838 WeakPolarHBondContact O-CB 3.29Å; V834-T838 WeakPolarHBondContact O-CG2 3.22Å; V834-T838 PolarHBondContact O-N 3.35Å; V834-T838 PolarHBondContact O-OG1 3.21Å; V834-L944 HydrophobicContact CG2-CD1 3.99Å; V834-L944 HydrophobicContact CG2-CD2 3.83Å; V834-L944 HydrophobicContact CG2-CG 4.39Å; V834-T948 HydrophobicContact CG1-CG2 4.23Å; V834-L949 HydrophobicContact CG1-CD2 4.2Å; V834-L949 HydrophobicContact CG2-CD2 4.4Å; V834-E952 HydrophobicContact CG1-CB 4.41Å; V834-E952 HydrophobicContact CG1-CG 3.81Å
835	E	97.6	Very high	96.5	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-63.1	-41.3	179.2	-175.9	64	-175.4	0	0	111.7	G792 L795 T796 L809 I831 G832 T838 R839 K956	G792-E835 WeakPolarHBondContact CA-OE2 3.37Å; L795-E835 HydrophobicContact CD2-CB 4.22Å; L795-E835 HydrophobicContact CD2-CG 4.5Å; T796-E835 PolarHBondContact OG1-OE1 3.28Å; L809-E835 HydrophobicContact CD2-CB 4.17Å; L809-E835 HydrophobicContact CD2-CG 3.98Å; I831-E835 WeakPolarHBondContact O-CB 3.37Å; I831-E835 PolarHBondContact O-N 2.81Å; G832-E835 PolarHBondContact O-N 2.74Å; E835-T838 PolarHBondContact O-OG1 2.88Å; E835-R839 WeakPolarHBondContact O-CB 3.49Å; E835-R839 VanDerWaalsContact O-CG 3.27Å; E835-R839 WeakPolarHBondContact O-CG 3.28Å; E835-R839 PolarHBondContact O-N 2.61Å; E835-R839 IonicContact OE1-CZ 3.61Å; E835-R839 IonicContact OE1-NE 3.15Å; E835-R839 PolarHBondContact OE1-NE 3.42Å; E835-R839 IonicContact OE1-NH2 3.69Å; E835-R839 PolarHBondContact OE1-NH2 2.96Å; E835-K956 IonicContact OE1-NZ 2.64Å; E835-K956 PolarHBondContact OE1-NZ 3.41Å; E835-K956 WeakPolarHBondContact OE2-CE 3.32Å; E835-K956 IonicContact OE2-NZ 2.91Å; E835-K956 PolarHBondContact OE2-NZ 3.19Å
836	L	97.8	Very high	96.4	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-60	-53	176.2	-179.5	73.1	0	0	0	111.2	L809 L813 G832 I833 V834 R839 C840 A922 Y926 F928	L809-L836 HydrophobicContact CD2-CB 3.91Å; L809-L836 HydrophobicContact CD2-CD1 4.27Å; L813-L836 HydrophobicContact CD1-CB 4.37Å; L813-L836 HydrophobicContact CD1-CD2 4.09Å; G832-L836 VanDerWaalsContact O-CB 3.26Å; G832-L836 WeakPolarHBondContact O-CB 3.33Å; G832-L836 PolarHBondContact O-N 3.48Å; I833-L836 PolarHBondContact O-N 3Å; V834-L836 VanDerWaalsContact C-N 3.35Å; V834-L836 PolarHBondContact O-N 3.14Å; L836-R839 PolarHBondContact O-N 3.49Å; L836-C840 WeakPolarHBondContact O-CB 3.35Å; L836-C840 PolarHBondContact O-N 2.88Å; L836-C840 PolarHBondContact O-SG 3.44Å; L836-A922 HydrophobicContact CD2-CB 4.37Å; L836-Y926 VanDerWaalsContact CD1-CB 3.48Å; L836-Y926 HydrophobicContact CD1-CD1 3.95Å; L836-Y926 HydrophobicContact CD1-CD2 3.37Å; L836-Y926 HydrophobicContact CD1-CE2 4.05Å; L836-Y926 HydrophobicContact CD1-CG 3.3Å; L836-F928 HydrophobicContact CD2-CB 4Å; L836-F928 HydrophobicContact CD2-CD1 3.38Å; L836-F928 HydrophobicContact CD2-CE1 3.99Å; L836-F928 HydrophobicContact CD2-CG 3.77Å
837	I	97.9	Very high	96.2	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-63.4	-46.9	-176.9	-70	173.2	0	0	0	110.6	I833 V834 R839 C840 A841 F868 W915 I918 M930 V938 L944 L949	I833-I837 HydrophobicContact CG2-CD1 3.78Å; I833-I837 HydrophobicContact CG2-CG1 4.41Å; I833-I837 WeakPolarHBondContact O-CB 3.36Å; I833-I837 VanDerWaalsContact O-CG1 3.3Å; I833-I837 WeakPolarHBondContact O-CG1 3.18Å; I833-I837 PolarHBondContact O-N 3.37Å; V834-I837 PolarHBondContact O-N 3.25Å; I837-R839 PolarHBondContact O-N 3.43Å; I837-C840 PolarHBondContact O-N 3.31Å; I837-A841 WeakPolarHBondContact O-CB 3.37Å; I837-A841 PolarHBondContact O-N 2.78Å; I837-F868 HydrophobicContact CG2-CE2 3.77Å; I837-F868 HydrophobicContact CG2-CZ 3.94Å; I837-W915 HydrophobicContact CD1-CZ3 4.36Å; I837-W915 HydrophobicContact CG2-CH2 3.83Å; I837-W915 HydrophobicContact CG2-CZ3 4.04Å; I837-I918 HydrophobicContact CG2-CG2 4.41Å; I837-M930 HydrophobicContact CD1-SD 4.05Å; I837-M930 HydrophobicContact CG1-SD 4.01Å; I837-V938 HydrophobicContact CD1-CB 4.49Å; I837-V938 HydrophobicContact CD1-CG1 3.36Å; I837-V938 HydrophobicContact CD1-CG2 4.34Å; I837-L944 HydrophobicContact CD1-CD1 4.07Å; I837-L949 HydrophobicContact CG2-CD2 4.29Å
838	T	97.8	Very high	96.1	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-69.2	-33.4	-176.6	56.2	0	0	0	0	112.1	V834 E835 K842 F868 L949 E952 K956	V834-T838 HydrophobicContact CG1-CG2 4.31Å; V834-T838 WeakPolarHBondContact O-CB 3.29Å; V834-T838 WeakPolarHBondContact O-CG2 3.22Å; V834-T838 PolarHBondContact O-N 3.35Å; V834-T838 PolarHBondContact O-OG1 3.21Å; E835-T838 PolarHBondContact O-OG1 2.88Å; T838-K842 WeakPolarHBondContact O-CB 3.34Å; T838-K842 PolarHBondContact O-N 2.95Å; T838-F868 HydrophobicContact CG2-CZ 4.47Å; T838-L949 HydrophobicContact CG2-CD2 3.85Å; T838-E952 HydrophobicContact CG2-CB 3.61Å; T838-K956 VanDerWaalsContact OG1-CE 3.24Å; T838-K956 WeakPolarHBondContact OG1-CE 3.21Å
839	R	97.5	Very high	96	Very high	46 Å²	46	19.2 Å²	19.2	17%	0.174	9%	0.089	C	C	.	.	H	α-helix	trans	-69	-40.3	170.5	-73.9	-173.2	178.8	-109.5	-4.3	113.1	T796 E835 L836 I837 K842 H843 Y926 K956	T796-R839 PolarHBondContact OG1-NH2 2.68Å; E835-R839 WeakPolarHBondContact O-CB 3.49Å; E835-R839 VanDerWaalsContact O-CG 3.27Å; E835-R839 WeakPolarHBondContact O-CG 3.28Å; E835-R839 PolarHBondContact O-N 2.61Å; E835-R839 IonicContact OE1-CZ 3.61Å; E835-R839 IonicContact OE1-NE 3.15Å; E835-R839 PolarHBondContact OE1-NE 3.42Å; E835-R839 IonicContact OE1-NH2 3.69Å; E835-R839 PolarHBondContact OE1-NH2 2.96Å; L836-R839 PolarHBondContact O-N 3.49Å; I837-R839 PolarHBondContact O-N 3.43Å; R839-K842 WeakPolarHBondContact O-CB 3.43Å; R839-K842 PolarHBondContact O-N 3.27Å; R839-H843 PolarHBondContact O-CD2 3.46Å; R839-H843 VanDerWaalsContact O-CD2 3.27Å; R839-H843 PolarHBondContact O-N 2.9Å; R839-Y926 HydrophobicContact CB-CE2 4.41Å; R839-Y926 VanDerWaalsContact CB-OH 3.25Å; R839-Y926 WeakPolarHBondContact CB-OH 2.99Å; R839-Y926 VanDerWaalsContact CD-OH 3.23Å; R839-Y926 WeakPolarHBondContact CD-OH 3.43Å; R839-K956 HydrophobicContact CG-CD 4.44Å
840	C	97.8	Very high	95.6	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.1	-47.6	174.1	-68	0	0	0	0	110.7	L836 I837 K842 H843 I844 I918 E921	L836-C840 WeakPolarHBondContact O-CB 3.35Å; L836-C840 PolarHBondContact O-N 2.88Å; L836-C840 PolarHBondContact O-SG 3.44Å; I837-C840 PolarHBondContact O-N 3.31Å; C840-K842 VanDerWaalsContact C-N 3.31Å; C840-K842 PolarHBondContact O-N 3.48Å; C840-H843 PolarHBondContact O-N 3.45Å; C840-I844 WeakPolarHBondContact O-CG1 3.45Å; C840-I844 PolarHBondContact O-N 3.08Å; C840-I918 HydrophobicContact CB-CG2 3.92Å; C840-E921 HydrophobicContact CB-CB 3.98Å; C840-E921 HydrophobicContact CB-CG 3.66Å
841	A	98	Very high	94.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.2	-42	174.3	0	0	0	0	0	111.6	I837 H843 I844 F845 F864 F868 I918 I953	I837-A841 WeakPolarHBondContact O-CB 3.37Å; I837-A841 PolarHBondContact O-N 2.78Å; A841-H843 PolarHBondContact O-N 2.83Å; A841-I844 PolarHBondContact O-N 3.05Å; A841-F845 WeakPolarHBondContact O-CB 3.39Å; A841-F845 PolarHBondContact O-N 2.95Å; A841-F864 HydrophobicContact CB-CZ 4.43Å; A841-F868 HydrophobicContact CB-CD2 4.2Å; A841-F868 HydrophobicContact CB-CE2 3.77Å; A841-F868 HydrophobicContact CB-CZ 3.97Å; A841-I918 HydrophobicContact CB-CD1 4.26Å; A841-I953 HydrophobicContact CB-CD1 3.97Å
842	K	96.9	Very high	94.4	Very high	52 Å²	52	22.2 Å²	22.2	23%	0.226	12%	0.117	C	C	.	.	H	α-helix	trans	-59.9	-43.8	174.5	-177	180	87	174.7	0	113.1	T838 R839 C840 I844 F845 R846 I953 K956 T957	T838-K842 WeakPolarHBondContact O-CB 3.34Å; T838-K842 PolarHBondContact O-N 2.95Å; R839-K842 WeakPolarHBondContact O-CB 3.43Å; R839-K842 PolarHBondContact O-N 3.27Å; C840-K842 VanDerWaalsContact C-N 3.31Å; C840-K842 PolarHBondContact O-N 3.48Å; K842-I844 VanDerWaalsContact C-N 3.28Å; K842-I844 PolarHBondContact O-N 2.97Å; K842-F845 PolarHBondContact O-N 3.04Å; K842-R846 WeakPolarHBondContact O-CB 3.25Å; K842-R846 PolarHBondContact O-N 3.49Å; K842-I953 HydrophobicContact CB-CD1 4.33Å; K842-K956 HydrophobicContact CD-CB 3.97Å; K842-K956 WeakPolarHBondContact CD-O 3.38Å; K842-T957 HydrophobicContact CB-CG2 4.37Å; K842-T957 HydrophobicContact CG-CG2 4Å
843	H	95.1	Very high	93.7	Very high	34 Å²	34	25.2 Å²	25.2	16%	0.157	13%	0.131	C	C	.	.	H	α-helix	trans	-60.1	-41.6	178.6	-67.4	177.8	0	0	0	111.4	R839 C840 A841 T847 E921 Y925	R839-H843 PolarHBondContact O-CD2 3.46Å; R839-H843 VanDerWaalsContact O-CD2 3.27Å; R839-H843 PolarHBondContact O-N 2.9Å; C840-H843 PolarHBondContact O-N 3.45Å; A841-H843 PolarHBondContact O-N 2.83Å; H843-T847 PolarHBondContact O-OG1 3.3Å; H843-E921 HydrophobicContact CB-CG 4.36Å; H843-E921 IonicContact CE1-OE1 2.8Å; H843-E921 IonicContact CG-OE1 2.65Å; H843-E921 IonicContact ND1-OE1 3.11Å; H843-E921 PolarHBondContact ND1-OE1 3.48Å; H843-Y925 AromaticContact CE1-CE1 3.97Å; H843-Y925 AromaticContact CE1-CZ 3.99Å
844	I	96.3	Very high	93.2	Very high	26 Å²	26	31 Å²	31	13%	0.133	16%	0.161	C	C	.	.	H	α-helix	trans	-69.2	-48.3	176.7	-60.5	162.3	0	0	0	110	C840 A841 K842 R846 T847 Y848 F864 L914 N917 I918	C840-I844 WeakPolarHBondContact O-CG1 3.45Å; C840-I844 PolarHBondContact O-N 3.08Å; A841-I844 PolarHBondContact O-N 3.05Å; K842-I844 VanDerWaalsContact C-N 3.28Å; K842-I844 PolarHBondContact O-N 2.97Å; I844-R846 VanDerWaalsContact C-N 3.28Å; I844-R846 PolarHBondContact O-N 3.24Å; I844-T847 PolarHBondContact O-N 3.44Å; I844-T847 VanDerWaalsContact O-N 3.13Å; I844-Y848 WeakPolarHBondContact O-CB 3Å; I844-Y848 PolarHBondContact O-N 2.84Å; I844-F864 HydrophobicContact CG2-CE2 4.21Å; I844-L914 HydrophobicContact CD1-CD1 4.17Å; I844-L914 HydrophobicContact CG2-CD1 3.9Å; I844-N917 HydrophobicContact CD1-CB 3.74Å; I844-N917 HydrophobicContact CG1-CB 4.49Å; I844-I918 HydrophobicContact CD1-CB 4.44Å; I844-I918 HydrophobicContact CD1-CG1 3.67Å
845	F	96.3	Very high	92.6	Very high	8 Å²	8	33.9 Å²	33.9	4%	0.035	18%	0.181	C	C	.	.	H	α-helix	trans	-56.2	-40.4	-179.7	-175.8	-107.4	0	0	0	112.8	A841 K842 T847 Y848 L849 V861 F864 T957 I959	A841-F845 WeakPolarHBondContact O-CB 3.39Å; A841-F845 PolarHBondContact O-N 2.95Å; K842-F845 PolarHBondContact O-N 3.04Å; F845-T847 PolarHBondContact O-N 3.25Å; F845-Y848 HydrophobicContact CD2-CD1 4.33Å; F845-Y848 WeakPolarHBondContact O-CB 3.38Å; F845-Y848 PolarHBondContact O-N 2.71Å; F845-L849 HydrophobicContact CD1-CD1 4.11Å; F845-L849 HydrophobicContact CD1-CG 4.39Å; F845-L849 HydrophobicContact CD2-CG 4.35Å; F845-L849 HydrophobicContact CE1-CD1 3.31Å; F845-L849 HydrophobicContact CE1-CG 3.95Å; F845-L849 HydrophobicContact CE2-CD1 4Å; F845-L849 HydrophobicContact CE2-CD2 4.22Å; F845-L849 HydrophobicContact CE2-CG 3.91Å; F845-L849 HydrophobicContact CZ-CD1 3.26Å; F845-L849 HydrophobicContact CZ-CD2 4.24Å; F845-L849 HydrophobicContact CZ-CG 3.71Å; F845-L849 PolarHBondContact O-N 3Å; F845-V861 HydrophobicContact CE2-CG2 4.28Å; F845-V861 HydrophobicContact CZ-CG1 4.46Å; F845-V861 HydrophobicContact CZ-CG2 3.99Å; F845-F864 HydrophobicContact CB-CE1 4.03Å; F845-F864 HydrophobicContact CB-CE2 4.08Å; F845-F864 HydrophobicContact CB-CZ 3.71Å; F845-F864 HydrophobicContact CD2-CB 4.24Å; F845-F864 AromaticContact CD2-CD1 3.5Å; F845-F864 HydrophobicContact CD2-CD1 3.5Å; F845-F864 VanDerWaalsContact CD2-CD1 3.5Å; F845-F864 AromaticContact CD2-CD2 3.88Å; F845-F864 HydrophobicContact CD2-CD2 3.88Å; F845-F864 AromaticContact CD2-CE1 3.71Å; F845-F864 HydrophobicContact CD2-CE1 3.71Å; F845-F864 HydrophobicContact CD2-CE2 4.06Å; F845-F864 AromaticContact CD2-CG 3.6Å; F845-F864 HydrophobicContact CD2-CG 3.6Å; F845-F864 AromaticContact CD2-CZ 3.99Å; F845-F864 HydrophobicContact CD2-CZ 3.99Å; F845-F864 HydrophobicContact CE2-CB 4.25Å; F845-F864 HydrophobicContact CE2-CD1 4.01Å; F845-F864 HydrophobicContact CE2-CG 4.07Å; F845-F864 HydrophobicContact CG-CD1 4.44Å; F845-F864 HydrophobicContact CG-CE1 4.24Å; F845-F864 HydrophobicContact CG-CZ 4.33Å; F845-T957 HydrophobicContact CD1-CG2 3.5Å; F845-T957 HydrophobicContact CE1-CG2 3.89Å; F845-T957 HydrophobicContact CG-CG2 4.27Å; F845-I959 HydrophobicContact CE1-CD1 4.11Å; F845-I959 HydrophobicContact CE1-CG1 4.39Å; F845-I959 HydrophobicContact CE2-CD1 4.2Å; F845-I959 HydrophobicContact CZ-CD1 3.63Å; F845-I959 HydrophobicContact CZ-CG1 4.07Å
846	R	92.1	Very high	92.2	Very high	66 Å²	66	34 Å²	34	25%	0.249	18%	0.183	C	C	.	.	H	α-helix	trans	-55.4	-51.6	176.5	-175	-169.1	71.9	-167.1	2.3	111.1	H440 G473 K842 I844 Q850	H440-R846 PolarHBondContact CD2-NH1 3.13Å; H440-R846 PolarHBondContact CE1-NH1 3.19Å; H440-R846 PolarHBondContact ND1-NH1 3.07Å; H440-R846 VanDerWaalsContact ND1-NH1 3.18Å; H440-R846 PolarHBondContact NE2-NH1 3.41Å; G473-R846 WeakPolarHBondContact CA-O 3.47Å; G473-R846 WeakPolarHBondContact O-CG 3.49Å; K842-R846 WeakPolarHBondContact O-CB 3.25Å; K842-R846 PolarHBondContact O-N 3.49Å; I844-R846 VanDerWaalsContact C-N 3.28Å; I844-R846 PolarHBondContact O-N 3.24Å; R846-Q850 WeakPolarHBondContact O-CG 3.43Å; R846-Q850 PolarHBondContact O-N 2.89Å
847	T	90.5	Very high	91.9	Very high	81 Å²	81	35 Å²	35	50%	0.497	19%	0.188	S	C	.	.	H	α-helix	trans	-71.8	-34.5	-179	-44.9	0	0	0	0	111.1	H843 I844 F845 L849 Q850	H843-T847 PolarHBondContact O-OG1 3.3Å; I844-T847 PolarHBondContact O-N 3.44Å; I844-T847 VanDerWaalsContact O-N 3.13Å; F845-T847 PolarHBondContact O-N 3.25Å; T847-L849 VanDerWaalsContact C-N 3.34Å; T847-L849 PolarHBondContact O-N 3.33Å; T847-Q850 PolarHBondContact O-N 3.03Å
848	Y	92.6	Very high	91.6	Very high	25 Å²	25	36.6 Å²	36.6	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-61.4	-38	176.3	173.6	-87.8	0	0	0	113	I844 F845 V852 A860 H863 F864 W906 L909	I844-Y848 WeakPolarHBondContact O-CB 3Å; I844-Y848 PolarHBondContact O-N 2.84Å; F845-Y848 HydrophobicContact CD2-CD1 4.33Å; F845-Y848 WeakPolarHBondContact O-CB 3.38Å; F845-Y848 PolarHBondContact O-N 2.71Å; Y848-V852 WeakPolarHBondContact O-CG2 3.35Å; Y848-A860 HydrophobicContact CE1-CB 4.02Å; Y848-A860 VanDerWaalsContact CE1-O 3.26Å; Y848-A860 WeakPolarHBondContact CE1-O 2.99Å; Y848-A860 PolarHBondContact OH-O 3.06Å; Y848-H863 PolarHBondContact OH-ND1 3.1Å; Y848-F864 HydrophobicContact CD1-CB 4.35Å; Y848-F864 AromaticContact CD1-CD2 3.96Å; Y848-F864 HydrophobicContact CD1-CD2 3.96Å; Y848-F864 HydrophobicContact CD1-CG 4.47Å; Y848-F864 HydrophobicContact CD2-CD2 4.16Å; Y848-F864 HydrophobicContact CE1-CB 3.78Å; Y848-F864 HydrophobicContact CE1-CD2 4.13Å; Y848-F864 HydrophobicContact CE1-CG 4.36Å; Y848-F864 HydrophobicContact CE2-CD2 4.28Å; Y848-F864 AromaticContact CG-CD2 3.98Å; Y848-F864 HydrophobicContact CG-CD2 3.98Å; Y848-W906 HydrophobicContact CD2-CB 3.92Å; Y848-W906 HydrophobicContact CE1-CB 4.4Å; Y848-W906 HydrophobicContact CE2-CB 3.55Å; Y848-W906 WeakPolarHBondContact CE2-O 3.34Å; Y848-L909 HydrophobicContact CD2-CD2 3.81Å; Y848-L909 HydrophobicContact CE2-CB 4.15Å; Y848-L909 HydrophobicContact CE2-CD2 3.62Å
849	L	92.1	Very high	91.4	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-82	-18.3	178.1	-76.9	-166.5	0	0	0	114.5	F845 T847 G851 V852 L857 A860 V861 I984	F845-L849 HydrophobicContact CD1-CD1 4.11Å; F845-L849 HydrophobicContact CD1-CG 4.39Å; F845-L849 HydrophobicContact CD2-CG 4.35Å; F845-L849 HydrophobicContact CE1-CD1 3.31Å; F845-L849 HydrophobicContact CE1-CG 3.95Å; F845-L849 HydrophobicContact CE2-CD1 4Å; F845-L849 HydrophobicContact CE2-CD2 4.22Å; F845-L849 HydrophobicContact CE2-CG 3.91Å; F845-L849 HydrophobicContact CZ-CD1 3.26Å; F845-L849 HydrophobicContact CZ-CD2 4.24Å; F845-L849 HydrophobicContact CZ-CG 3.71Å; F845-L849 PolarHBondContact O-N 3Å; T847-L849 VanDerWaalsContact C-N 3.34Å; T847-L849 PolarHBondContact O-N 3.33Å; L849-G851 PolarHBondContact O-N 2.98Å; L849-G851 VanDerWaalsContact O-N 3.16Å; L849-V852 HydrophobicContact CD2-CG2 4.34Å; L849-V852 WeakPolarHBondContact O-CG2 3.33Å; L849-V852 PolarHBondContact O-N 2.87Å; L849-V852 VanDerWaalsContact O-N 3.15Å; L849-L857 HydrophobicContact CD1-CD1 4.47Å; L849-L857 HydrophobicContact CD2-CD1 3.94Å; L849-A860 HydrophobicContact CD2-CB 4.33Å; L849-V861 HydrophobicContact CD1-CG2 4.47Å; L849-V861 HydrophobicContact CD2-CG2 4.07Å; L849-I984 HydrophobicContact CD1-CD1 4.11Å
850	Q	87.9	Confident	91.2	Very high	54 Å²	54	34.6 Å²	34.6	25%	0.252	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	119.8	179.4	-77.5	172.1	9.2	0	0	110.2	G473 Y474 R846 T847	G473-Q850 WeakPolarHBondContact O-CG 3.34Å; G473-Q850 PolarHBondContact O-NE2 3.22Å; Y474-Q850 HydrophobicContact CE1-CG 4.3Å; R846-Q850 WeakPolarHBondContact O-CG 3.43Å; R846-Q850 PolarHBondContact O-N 2.89Å; T847-Q850 PolarHBondContact O-N 3.03Å
851	G	78.9	Confident	91.2	Very high	43 Å²	43	34.6 Å²	34.6	44%	0.443	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	1.1	179.4	0	0	0	0	0	115.5	Y474 L849 E853	Y474-G851 PolarHBondContact OH-N 2.84Å; L849-G851 PolarHBondContact O-N 2.98Å; L849-G851 VanDerWaalsContact O-N 3.16Å; G851-E853 PolarHBondContact O-N 3.22Å
852	V	87.1	Confident	91.1	Very high	11 Å²	11	35 Å²	35	7%	0.067	20%	0.196	C	C	.	.			trans	-67.5	123.6	172.1	178.8	0	0	0	0	109.8	Y848 L849 A856 L857 A860 W906	Y848-V852 WeakPolarHBondContact O-CG2 3.35Å; L849-V852 HydrophobicContact CD2-CG2 4.34Å; L849-V852 WeakPolarHBondContact O-CG2 3.33Å; L849-V852 PolarHBondContact O-N 2.87Å; L849-V852 VanDerWaalsContact O-N 3.15Å; V852-A856 HydrophobicContact CG1-CB 4.43Å; V852-L857 HydrophobicContact CG1-CD1 4.28Å; V852-A860 HydrophobicContact CG1-CB 3.85Å; V852-A860 HydrophobicContact CG2-CB 4.28Å; V852-W906 HydrophobicContact CG2-CG 4.2Å
853	E	84	Confident	91	Very high	64 Å²	64	32.8 Å²	32.8	30%	0.299	19%	0.186	S	C	.	.			trans	-62.9	146.6	175.5	-66.7	-165.5	-171.6	0	0	110.4	G851 S855 A856 L857 R896 N903	G851-E853 PolarHBondContact O-N 3.22Å; E853-S855 PolarHBondContact O-N 2.97Å; E853-S855 VanDerWaalsContact O-N 3.16Å; E853-A856 PolarHBondContact O-N 3.12Å; E853-L857 PolarHBondContact O-N 3.35Å; E853-R896 IonicContact OE1-CZ 3.89Å; E853-R896 IonicContact OE1-NH1 3.79Å; E853-R896 PolarHBondContact OE1-NH1 3.07Å; E853-R896 IonicContact OE2-NH1 3.13Å; E853-N903 PolarHBondContact OE1-ND2 3.4Å
854	L	85.1	Confident	91	Very high	123 Å²	123	31.1 Å²	31.1	64%	0.644	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-57.6	-32.8	-177.2	-175.7	65.5	0	0	0	112.7	A856 L857	L854-A856 PolarHBondContact O-N 3.17Å; L854-L857 HydrophobicContact CD1-CD2 4.13Å; L854-L857 PolarHBondContact O-N 3.27Å
855	S	85.6	Confident	91.1	Very high	70 Å²	70	29.9 Å²	29.9	49%	0.49	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-64	-25	177.4	52	0	0	0	0	113.9	E853 E883	E853-S855 PolarHBondContact O-N 2.97Å; E853-S855 VanDerWaalsContact O-N 3.16Å; S855-E883 PolarHBondContact OG-OE1 3.13Å; S855-E883 VanDerWaalsContact OG-OE1 3.06Å
856	A	88.8	Confident	91.1	Very high	5 Å²	5	30 Å²	30	4%	0.041	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-112.1	7.2	-175.8	0	0	0	0	0	113.1	V852 E853 L854 A859 A860 L879 W906	V852-A856 HydrophobicContact CG1-CB 4.43Å; E853-A856 PolarHBondContact O-N 3.12Å; L854-A856 PolarHBondContact O-N 3.17Å; A856-A859 PolarHBondContact O-N 2.88Å; A856-A860 WeakPolarHBondContact O-CB 3.44Å; A856-A860 PolarHBondContact O-N 3.21Å; A856-L879 HydrophobicContact CB-CD2 4.2Å; A856-W906 HydrophobicContact CB-CZ2 3.85Å
857	L	90.8	Very high	91.2	Very high	20 Å²	20	26.9 Å²	26.9	11%	0.105	16%	0.161	C	C	.	.	H	α-helix	trans	-64.4	-47.4	-174.2	-173.6	65.1	0	0	0	112.4	R472 L849 V852 E853 L854 A860 V861 I984	R472-L857 HydrophobicContact CG-CD2 4.47Å; L849-L857 HydrophobicContact CD1-CD1 4.47Å; L849-L857 HydrophobicContact CD2-CD1 3.94Å; V852-L857 HydrophobicContact CG1-CD1 4.28Å; E853-L857 PolarHBondContact O-N 3.35Å; L854-L857 HydrophobicContact CD1-CD2 4.13Å; L854-L857 PolarHBondContact O-N 3.27Å; L857-A860 PolarHBondContact O-N 2.85Å; L857-V861 WeakPolarHBondContact O-CG2 3.36Å; L857-V861 PolarHBondContact O-N 3.43Å; L857-I984 HydrophobicContact CD1-CD1 4.01Å; L857-I984 HydrophobicContact CD2-CD1 3.91Å; L857-I984 HydrophobicContact CG-CD1 3.95Å
858	S	93.3	Very high	91.5	Very high	37 Å²	37	23 Å²	23	26%	0.259	14%	0.138	S	C	.	.	H	α-helix	trans	-62.8	-41.8	177.3	51.2	0	0	0	0	112	V861 S862	S858-V861 PolarHBondContact O-N 2.98Å; S858-S862 WeakPolarHBondContact O-CB 3.3Å; S858-S862 PolarHBondContact O-N 3.36Å; S858-S862 PolarHBondContact O-OG 2.97Å
859	A	93.1	Very high	91.6	Very high	4 Å²	4	21.8 Å²	21.8	3%	0.033	13%	0.133	C	C	.	.	H	α-helix	trans	-62.3	-42.6	174	0	0	0	0	0	111.7	A856 S862 H863 W906	A856-A859 PolarHBondContact O-N 2.88Å; A859-S862 WeakPolarHBondContact CA-OG 3.36Å; A859-S862 PolarHBondContact O-OG 3.35Å; A859-H863 WeakPolarHBondContact O-CB 3.47Å; A859-H863 PolarHBondContact O-N 3.43Å; A859-W906 HydrophobicContact CB-CH2 4.14Å
860	A	93.8	Very high	91.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.5	-43.7	178.3	0	0	0	0	0	112.5	Y848 L849 V852 A856 L857 F864 W906	Y848-A860 HydrophobicContact CE1-CB 4.02Å; Y848-A860 VanDerWaalsContact CE1-O 3.26Å; Y848-A860 WeakPolarHBondContact CE1-O 2.99Å; Y848-A860 PolarHBondContact OH-O 3.06Å; L849-A860 HydrophobicContact CD2-CB 4.33Å; V852-A860 HydrophobicContact CG1-CB 3.85Å; V852-A860 HydrophobicContact CG2-CB 4.28Å; A856-A860 WeakPolarHBondContact O-CB 3.44Å; A856-A860 PolarHBondContact O-N 3.21Å; L857-A860 PolarHBondContact O-N 2.85Å; A860-F864 WeakPolarHBondContact O-CB 3.44Å; A860-F864 PolarHBondContact O-N 3.37Å; A860-W906 HydrophobicContact CB-CD2 3.85Å; A860-W906 HydrophobicContact CB-CE3 3.72Å; A860-W906 HydrophobicContact CB-CH2 3.97Å; A860-W906 HydrophobicContact CB-CZ2 4.09Å; A860-W906 HydrophobicContact CB-CZ3 3.79Å
861	V	96	Very high	91.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.1	-48.7	177.8	176.6	0	0	0	0	111.2	F845 L849 L857 S858 H863 F864 L865 I959 I981 I984	F845-V861 HydrophobicContact CE2-CG2 4.28Å; F845-V861 HydrophobicContact CZ-CG1 4.46Å; F845-V861 HydrophobicContact CZ-CG2 3.99Å; L849-V861 HydrophobicContact CD1-CG2 4.47Å; L849-V861 HydrophobicContact CD2-CG2 4.07Å; L857-V861 WeakPolarHBondContact O-CG2 3.36Å; L857-V861 PolarHBondContact O-N 3.43Å; S858-V861 PolarHBondContact O-N 2.98Å; V861-H863 VanDerWaalsContact C-N 3.3Å; V861-H863 PolarHBondContact O-N 2.77Å; V861-F864 PolarHBondContact O-N 2.97Å; V861-L865 HydrophobicContact CG1-CD1 4.22Å; V861-L865 HydrophobicContact CG1-CG 4.44Å; V861-L865 WeakPolarHBondContact O-CG 3.48Å; V861-L865 PolarHBondContact O-N 3.37Å; V861-I959 HydrophobicContact CG1-CD1 3.76Å; V861-I959 HydrophobicContact CG1-CG1 3.99Å; V861-I959 HydrophobicContact CG1-CG2 3.96Å; V861-I981 HydrophobicContact CB-CD1 4.36Å; V861-I981 HydrophobicContact CB-CG1 4.12Å; V861-I981 HydrophobicContact CB-CG2 4.07Å; V861-I981 HydrophobicContact CG1-CD1 3.72Å; V861-I981 HydrophobicContact CG1-CG1 4.01Å; V861-I981 HydrophobicContact CG1-CG2 3.96Å; V861-I984 HydrophobicContact CG2-CD1 3.79Å
862	S	95.8	Very high	91.9	Very high	9 Å²	9	19.8 Å²	19.8	6%	0.063	11%	0.114	C	C	.	.	H	α-helix	trans	-61.4	-39.2	177.9	57.2	0	0	0	0	111.9	S858 A859 L865 N866 T977	S858-S862 WeakPolarHBondContact O-CB 3.3Å; S858-S862 PolarHBondContact O-N 3.36Å; S858-S862 PolarHBondContact O-OG 2.97Å; A859-S862 WeakPolarHBondContact CA-OG 3.36Å; A859-S862 PolarHBondContact O-OG 3.35Å; S862-L865 PolarHBondContact O-N 3.39Å; S862-N866 WeakPolarHBondContact O-CB 3.2Å; S862-N866 PolarHBondContact O-N 2.98Å; S862-N866 PolarHBondContact O-ND2 3.34Å; S862-T977 VanDerWaalsContact CB-O 3.26Å; S862-T977 WeakPolarHBondContact CB-O 3.37Å
863	H	95.3	Very high	91.3	Very high	4 Å²	4	23 Å²	23	2%	0.019	14%	0.135	C	C	.	.	H	α-helix	trans	-61.1	-46.6	173	178.7	-106.1	0	0	0	112.5	Y848 A859 V861 L865 N866 C867 A875 A877 W906 L909	Y848-H863 PolarHBondContact OH-ND1 3.1Å; A859-H863 WeakPolarHBondContact O-CB 3.47Å; A859-H863 PolarHBondContact O-N 3.43Å; V861-H863 VanDerWaalsContact C-N 3.3Å; V861-H863 PolarHBondContact O-N 2.77Å; H863-L865 PolarHBondContact O-N 3.34Å; H863-N866 PolarHBondContact O-N 2.72Å; H863-C867 PolarHBondContact O-N 3.44Å; H863-C867 PolarHBondContact O-SG 2.69Å; H863-C867 VanDerWaalsContact O-SG 3.34Å; H863-A875 PolarHBondContact NE2-O 3.05Å; H863-A877 HydrophobicContact CB-CB 4.43Å; H863-A877 PolarHBondContact CD2-N 2.87Å; H863-A877 VanDerWaalsContact CD2-N 3.29Å; H863-W906 HydrophobicContact CB-CZ3 4.24Å; H863-L909 PolarHBondContact CE1-O 2.82Å; H863-L909 PolarHBondContact NE2-O 3.13Å
864	F	96.4	Very high	91	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61	-45.3	176.9	-175.4	-87	0	0	0	111.8	A841 I844 F845 Y848 A860 V861 N866 C867 F868 L909 L914	A841-F864 HydrophobicContact CB-CZ 4.43Å; I844-F864 HydrophobicContact CG2-CE2 4.21Å; F845-F864 HydrophobicContact CB-CE1 4.03Å; F845-F864 HydrophobicContact CB-CE2 4.08Å; F845-F864 HydrophobicContact CB-CZ 3.71Å; F845-F864 HydrophobicContact CD2-CB 4.24Å; F845-F864 AromaticContact CD2-CD1 3.5Å; F845-F864 HydrophobicContact CD2-CD1 3.5Å; F845-F864 VanDerWaalsContact CD2-CD1 3.5Å; F845-F864 AromaticContact CD2-CD2 3.88Å; F845-F864 HydrophobicContact CD2-CD2 3.88Å; F845-F864 AromaticContact CD2-CE1 3.71Å; F845-F864 HydrophobicContact CD2-CE1 3.71Å; F845-F864 HydrophobicContact CD2-CE2 4.06Å; F845-F864 AromaticContact CD2-CG 3.6Å; F845-F864 HydrophobicContact CD2-CG 3.6Å; F845-F864 AromaticContact CD2-CZ 3.99Å; F845-F864 HydrophobicContact CD2-CZ 3.99Å; F845-F864 HydrophobicContact CE2-CB 4.25Å; F845-F864 HydrophobicContact CE2-CD1 4.01Å; F845-F864 HydrophobicContact CE2-CG 4.07Å; F845-F864 HydrophobicContact CG-CD1 4.44Å; F845-F864 HydrophobicContact CG-CE1 4.24Å; F845-F864 HydrophobicContact CG-CZ 4.33Å; Y848-F864 HydrophobicContact CD1-CB 4.35Å; Y848-F864 AromaticContact CD1-CD2 3.96Å; Y848-F864 HydrophobicContact CD1-CD2 3.96Å; Y848-F864 HydrophobicContact CD1-CG 4.47Å; Y848-F864 HydrophobicContact CD2-CD2 4.16Å; Y848-F864 HydrophobicContact CE1-CB 3.78Å; Y848-F864 HydrophobicContact CE1-CD2 4.13Å; Y848-F864 HydrophobicContact CE1-CG 4.36Å; Y848-F864 HydrophobicContact CE2-CD2 4.28Å; Y848-F864 AromaticContact CG-CD2 3.98Å; Y848-F864 HydrophobicContact CG-CD2 3.98Å; A860-F864 WeakPolarHBondContact O-CB 3.44Å; A860-F864 PolarHBondContact O-N 3.37Å; V861-F864 PolarHBondContact O-N 2.97Å; F864-N866 VanDerWaalsContact C-N 3.33Å; F864-N866 PolarHBondContact O-N 2.85Å; F864-C867 PolarHBondContact O-N 2.73Å; F864-F868 HydrophobicContact CE1-CB 4.41Å; F864-F868 WeakPolarHBondContact O-CB 3.41Å; F864-F868 PolarHBondContact O-N 3.35Å; F864-L909 HydrophobicContact CD2-CD2 4.02Å; F864-L909 HydrophobicContact CE2-CD2 4.39Å; F864-L914 HydrophobicContact CD2-CD2 4.48Å; F864-L914 HydrophobicContact CE2-CD1 3.77Å; F864-L914 HydrophobicContact CE2-CD2 4.17Å; F864-L914 HydrophobicContact CZ-CD1 4.04Å; F864-L914 HydrophobicContact CZ-CD2 4.25Å
865	L	97.1	Very high	90.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.1	-37.1	177.8	-68.4	179.4	0	0	0	112.2	V861 S862 H863 F868 L869 L950 I953 I959 I961 F976 I981	V861-L865 HydrophobicContact CG1-CD1 4.22Å; V861-L865 HydrophobicContact CG1-CG 4.44Å; V861-L865 WeakPolarHBondContact O-CG 3.48Å; V861-L865 PolarHBondContact O-N 3.37Å; S862-L865 PolarHBondContact O-N 3.39Å; H863-L865 PolarHBondContact O-N 3.34Å; L865-F868 PolarHBondContact O-N 3.15Å; L865-L869 HydrophobicContact CD2-CD1 4.48Å; L865-L869 WeakPolarHBondContact O-CB 3.32Å; L865-L869 PolarHBondContact O-N 3.08Å; L865-L950 HydrophobicContact CD1-CD1 4.4Å; L865-L950 HydrophobicContact CD2-CD1 4.31Å; L865-I953 HydrophobicContact CD2-CG2 3.99Å; L865-I959 HydrophobicContact CD2-CD1 4.39Å; L865-I961 HydrophobicContact CD1-CG2 4.34Å; L865-F976 HydrophobicContact CB-CD2 3.68Å; L865-F976 HydrophobicContact CB-CE2 3.79Å; L865-F976 HydrophobicContact CB-CG 4.07Å; L865-F976 HydrophobicContact CB-CZ 4.26Å; L865-F976 HydrophobicContact CD1-CD1 4.15Å; L865-F976 HydrophobicContact CD1-CE1 4.12Å; L865-F976 HydrophobicContact CD1-CG 4.44Å; L865-F976 HydrophobicContact CD1-CZ 4.36Å; L865-I981 HydrophobicContact CD1-CD1 3.89Å
866	N	95.8	Very high	89.8	Confident	9 Å²	9	21.6 Å²	21.6	5%	0.048	13%	0.13	C	C	.	.	H	α-helix	trans	-63.9	-43.7	172.3	-78.6	-50.5	0	0	0	111.7	S862 H863 F864 F868 S870 A875 P974 A975 F976	S862-N866 WeakPolarHBondContact O-CB 3.2Å; S862-N866 PolarHBondContact O-N 2.98Å; S862-N866 PolarHBondContact O-ND2 3.34Å; H863-N866 PolarHBondContact O-N 2.72Å; F864-N866 VanDerWaalsContact C-N 3.33Å; F864-N866 PolarHBondContact O-N 2.85Å; N866-F868 VanDerWaalsContact C-N 3.25Å; N866-F868 PolarHBondContact O-N 3.46Å; N866-S870 WeakPolarHBondContact O-CA 3.5Å; N866-S870 WeakPolarHBondContact O-CB 3.48Å; N866-S870 PolarHBondContact O-N 2.87Å; N866-A875 HydrophobicContact CB-CB 4.16Å; N866-P974 WeakPolarHBondContact OD1-CB 3.22Å; N866-A975 PolarHBondContact OD1-N 2.97Å; N866-F976 PolarHBondContact ND2-O 3.3Å; N866-F976 PolarHBondContact OD1-N 3.49Å
867	C	95.1	Very high	89	Confident	1 Å²	1	22 Å²	22	1%	0.007	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-33.6	174.8	-67.3	0	0	0	0	112.7	H863 F864 L909 P911 L914	H863-C867 PolarHBondContact O-N 3.44Å; H863-C867 PolarHBondContact O-SG 2.69Å; H863-C867 VanDerWaalsContact O-SG 3.34Å; F864-C867 PolarHBondContact O-N 2.73Å; C867-L909 PolarHBondContact SG-O 2.69Å; C867-L909 VanDerWaalsContact SG-O 3.33Å; C867-P911 HydrophobicContact CB-CG 4.48Å; C867-L914 HydrophobicContact CB-CB 4.37Å; C867-L914 HydrophobicContact CB-CD2 3.63Å
868	F	96.6	Very high	87.9	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-80.7	-42.1	-176.4	-176.2	-130.3	0	0	0	112.8	I837 T838 A841 F864 L865 N866 L914 W915 I918 L949 I953	I837-F868 HydrophobicContact CG2-CE2 3.77Å; I837-F868 HydrophobicContact CG2-CZ 3.94Å; T838-F868 HydrophobicContact CG2-CZ 4.47Å; A841-F868 HydrophobicContact CB-CD2 4.2Å; A841-F868 HydrophobicContact CB-CE2 3.77Å; A841-F868 HydrophobicContact CB-CZ 3.97Å; F864-F868 HydrophobicContact CE1-CB 4.41Å; F864-F868 WeakPolarHBondContact O-CB 3.41Å; F864-F868 PolarHBondContact O-N 3.35Å; L865-F868 PolarHBondContact O-N 3.15Å; N866-F868 VanDerWaalsContact C-N 3.25Å; N866-F868 PolarHBondContact O-N 3.46Å; F868-L914 HydrophobicContact CB-CD2 3.88Å; F868-W915 HydrophobicContact CD2-CZ2 4.02Å; F868-W915 HydrophobicContact CE2-CH2 4.15Å; F868-W915 HydrophobicContact CE2-CZ2 4.01Å; F868-W915 WeakPolarHBondContact O-CZ2 3.41Å; F868-W915 PolarHBondContact O-NE1 3.09Å; F868-I918 HydrophobicContact CD2-CD1 3.83Å; F868-I918 HydrophobicContact CE2-CD1 3.84Å; F868-L949 HydrophobicContact CE1-CB 4.34Å; F868-L949 HydrophobicContact CZ-CD2 4.47Å; F868-I953 HydrophobicContact CD1-CG2 4.26Å; F868-I953 HydrophobicContact CE1-CB 4.02Å; F868-I953 HydrophobicContact CE1-CG1 4.36Å; F868-I953 HydrophobicContact CE1-CG2 4.03Å
869	L	95.8	Very high	86.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-119.8	-21.8	-166.5	-62.6	169.2	0	0	0	115.1	L865 L949 L950 F968 F976	L865-L869 HydrophobicContact CD2-CD1 4.48Å; L865-L869 WeakPolarHBondContact O-CB 3.32Å; L865-L869 PolarHBondContact O-N 3.08Å; L869-L949 HydrophobicContact CD2-CB 3.61Å; L869-L949 HydrophobicContact CD2-CD1 4.25Å; L869-L950 HydrophobicContact CD1-CB 3.73Å; L869-L950 HydrophobicContact CD1-CD1 3.7Å; L869-L950 HydrophobicContact CD1-CG 4.22Å; L869-F968 HydrophobicContact CB-CD1 4.06Å; L869-F968 HydrophobicContact CB-CE1 4.31Å; L869-F968 HydrophobicContact CD1-CE1 4.39Å; L869-F976 HydrophobicContact CB-CE2 4.36Å; L869-F976 HydrophobicContact CD1-CE2 4.12Å; L869-F976 HydrophobicContact CD1-CZ 4.09Å
870	S	91.8	Very high	84.9	Confident	6 Å²	6	29.4 Å²	29.4	4%	0.042	17%	0.168	C	C	.	.			trans	-84.1	143.1	-175.1	-169.7	0	0	0	0	111.8	N866 F872	N866-S870 WeakPolarHBondContact O-CA 3.5Å; N866-S870 WeakPolarHBondContact O-CB 3.48Å; N866-S870 PolarHBondContact O-N 2.87Å; S870-F872 PolarHBondContact O-N 3.02Å; S870-F872 VanDerWaalsContact OG-CB 3.28Å; S870-F872 WeakPolarHBondContact OG-CB 3.33Å; S870-F872 PolarHBondContact OG-N 3.33Å
871	S	88.5	Confident	82.8	Confident	16 Å²	16	34.4 Å²	34.4	11%	0.112	20%	0.2	C	C	.	.			trans	-81.5	5.2	168.1	-60.4	0	0	0	0	112.9	P873 D936 K946 F968	S871-P873 WeakPolarHBondContact O-CD 3.32Å; S871-D936 WeakPolarHBondContact CB-OD2 3.38Å; S871-D936 VanDerWaalsContact OG-CG 3.22Å; S871-D936 PolarHBondContact OG-OD1 2.98Å; S871-D936 PolarHBondContact OG-OD2 2.95Å; S871-K946 PolarHBondContact OG-NZ 3.19Å; S871-F968 WeakPolarHBondContact CB-O 3.29Å; S871-F968 PolarHBondContact N-O 2.9Å; S871-F968 PolarHBondContact OG-O 3.33Å
872	F	84.8	Confident	80.9	Confident	37 Å²	37	41.6 Å²	41.6	16%	0.162	24%	0.239	C	C	.	.			trans	-73.5	118.4	175.5	-173.6	-119.3	0	0	0	110.8	S870 D874 R971 P974	S870-F872 PolarHBondContact O-N 3.02Å; S870-F872 VanDerWaalsContact OG-CB 3.28Å; S870-F872 WeakPolarHBondContact OG-CB 3.33Å; S870-F872 PolarHBondContact OG-N 3.33Å; F872-D874 VanDerWaalsContact CE1-C 3.41Å; F872-D874 HydrophobicContact CE1-CB 4.33Å; F872-D874 WeakPolarHBondContact CE1-O 3.22Å; F872-D874 HydrophobicContact CZ-CB 4.32Å; F872-R971 WeakPolarHBondContact CD2-O 3.29Å; F872-P974 HydrophobicContact CD1-CB 4.47Å
873	P	74.6	Confident	78.8	Confident	79 Å²	79	44.3 Å²	44.3	51%	0.513	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-32.4	-170.6	27	-33.8	0	0	0	113.8	S871	S871-P873 WeakPolarHBondContact O-CD 3.32Å
874	D	76.6	Confident	76.5	Confident	114 Å²	114	49.6 Å²	49.6	61%	0.61	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	55.5	-174.2	-63.3	-41.9	0	0	0	111.1	F872 V876	F872-D874 VanDerWaalsContact CE1-C 3.41Å; F872-D874 HydrophobicContact CE1-CB 4.33Å; F872-D874 WeakPolarHBondContact CE1-O 3.22Å; F872-D874 HydrophobicContact CZ-CB 4.32Å; D874-V876 WeakPolarHBondContact O-CG2 3.42Å; D874-V876 PolarHBondContact O-N 2.96Å
875	A	73.8	Confident	73.8	Confident	13 Å²	13	54.8 Å²	54.8	11%	0.107	31%	0.31	C	S	.	.			trans	-60	102.8	172.5	0	0	0	0	0	109.2	H863 N866 P911	H863-A875 PolarHBondContact NE2-O 3.05Å; N866-A875 HydrophobicContact CB-CB 4.16Å; A875-P911 HydrophobicContact CB-CG 4.15Å
876	V	73.1	Confident	71.2	Confident	99 Å²	99	59.7 Å²	59.7	60%	0.6	34%	0.344	S	S	*	.			trans	-103	130.9	176.9	177.9	0	0	0	0	108.1	D874 H878	D874-V876 WeakPolarHBondContact O-CG2 3.42Å; D874-V876 PolarHBondContact O-N 2.96Å; V876-H878 PolarHBondContact O-N 2.91Å
877	A	72	Confident	68.6	Low	13 Å²	13	69.8 Å²	69.8	11%	0.107	38%	0.381	C	S	.	.			trans	-64.2	118.2	170.3	0	0	0	0	0	110	H863 L879 W906 A907	H863-A877 HydrophobicContact CB-CB 4.43Å; H863-A877 PolarHBondContact CD2-N 2.87Å; H863-A877 VanDerWaalsContact CD2-N 3.29Å; A877-L879 PolarHBondContact O-N 3.17Å; A877-W906 HydrophobicContact CB-CE3 4.33Å; A877-W906 HydrophobicContact CB-CH2 3.99Å; A877-W906 HydrophobicContact CB-CZ3 3.49Å; A877-W906 VanDerWaalsContact CB-CZ3 3.49Å; A877-A907 HydrophobicContact CB-CB 3.45Å; A877-A907 VanDerWaalsContact CB-CB 3.45Å
878	H	67	Low	65.8	Low	134 Å²	134	81 Å²	81	62%	0.62	42%	0.423	S	S	*	.			trans	-78.1	102.9	172	-69.5	-70.9	0	0	0	108.6	V876	V876-H878 PolarHBondContact O-N 2.91Å
879	L	64.2	Low	63.2	Low	22 Å²	22	90.7 Å²	90.7	12%	0.115	47%	0.466	C	S	.	.			trans	-103.6	143.9	172.2	-73.8	170	0	0	0	109.9	A856 A877 L884 T904 W906 A907	A856-L879 HydrophobicContact CB-CD2 4.2Å; A877-L879 PolarHBondContact O-N 3.17Å; L879-L884 HydrophobicContact CB-CD1 4.35Å; L879-L884 HydrophobicContact CB-CD2 4.4Å; L879-L884 HydrophobicContact CB-CG 4.17Å; L879-L884 HydrophobicContact CD1-CD2 4.11Å; L879-T904 HydrophobicContact CD1-CG2 3.58Å; L879-W906 HydrophobicContact CD2-CH2 3.79Å; L879-W906 HydrophobicContact CD2-CZ2 3.67Å; L879-W906 HydrophobicContact CG-CH2 4.31Å; L879-W906 HydrophobicContact CG-CZ2 4.47Å; L879-A907 HydrophobicContact CD1-CB 4.29Å
880	P	58.3	Low	60.6	Low	61 Å²	61	96.4 Å²	96.4	40%	0.396	51%	0.506	S	S	.	.			trans	-54.5	140.4	170.1	-23.3	32.6	0	0	0	111	D882 E883	P880-D882 PolarHBondContact O-N 2.73Å; P880-E883 PolarHBondContact O-N 3.1Å
881	P	51.3	Low	58.3	Low	105 Å²	105	107.7 Å²	107.7	68%	0.682	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-30.8	-177.5	-25.5	32.3	0	0	0	114.2	E883 L884 V885	P881-E883 VanDerWaalsContact C-N 3.33Å; P881-E883 PolarHBondContact O-N 3.37Å; P881-L884 PolarHBondContact O-N 2.71Å; P881-V885 WeakPolarHBondContact O-CG2 3.39Å
882	D	54.6	Low	56.1	Low	152 Å²	152	116.7 Å²	116.7	81%	0.813	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-23.9	-179.2	-84.4	-19.6	0	0	0	113.9	P880	P880-D882 PolarHBondContact O-N 2.73Å
883	E	53.3	Low	54	Low	66 Å²	66	125.3 Å²	125.3	31%	0.308	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.9	-20.5	179.4	-70.6	-172.5	168.4	0	0	112.7	S855 P880 P881 V885	S855-E883 PolarHBondContact OG-OE1 3.13Å; S855-E883 VanDerWaalsContact OG-OE1 3.06Å; P880-E883 PolarHBondContact O-N 3.1Å; P881-E883 VanDerWaalsContact C-N 3.33Å; P881-E883 PolarHBondContact O-N 3.37Å; E883-V885 VanDerWaalsContact C-N 3.3Å; E883-V885 PolarHBondContact O-N 3.39Å
884	L	46.3	Very low	52.3	Low	114 Å²	114	133.4 Å²	133.4	60%	0.597	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-9.8	177.9	-70.8	162.5	0	0	0	113.7	L879 P881	L879-L884 HydrophobicContact CB-CD1 4.35Å; L879-L884 HydrophobicContact CB-CD2 4.4Å; L879-L884 HydrophobicContact CB-CG 4.17Å; L879-L884 HydrophobicContact CD1-CD2 4.11Å; P881-L884 PolarHBondContact O-N 2.71Å
885	V	40.3	Very low	50.5	Low	109 Å²	109	135.7 Å²	135.7	66%	0.661	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-0.2	-168.9	-173.2	0	0	0	0	114.1	P881 E883 R887	P881-V885 WeakPolarHBondContact O-CG2 3.39Å; E883-V885 VanDerWaalsContact C-N 3.3Å; E883-V885 PolarHBondContact O-N 3.39Å; V885-R887 PolarHBondContact O-N 3.3Å
886	S	41.4	Very low	49.1	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-72.7	3.4	-173.9	76.9	0	0	0	0	116	R888	S886-R888 PolarHBondContact O-N 2.72Å; S886-R888 VanDerWaalsContact O-N 3.1Å
887	R	40.9	Very low	47.3	Very low	221 Å²	221	142.5 Å²	142.5	83%	0.834	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-67.3	-4.6	176.8	-85.7	-173.1	163.3	-177.6	-3.1	115.8	V885	V885-R887 PolarHBondContact O-N 3.3Å
888	R	37.6	Very low	45.6	Very low	236 Å²	236	147.5 Å²	147.5	89%	0.891	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-123.6	0.1	-173.7	-86.5	-173.3	177.2	179.8	0.9	119.3	S886	S886-R888 PolarHBondContact O-N 2.72Å; S886-R888 VanDerWaalsContact O-N 3.1Å
889	K	41.2	Very low	44.2	Very low	205 Å²	205	144.5 Å²	144.5	89%	0.891	71%	0.709	S	S	*	*			trans	-142.4	65.2	177.7	-73.2	-173.4	179.8	172.2	0	114.5
890	S	41.7	Very low	42.8	Very low	120 Å²	120	146.1 Å²	146.1	84%	0.839	73%	0.731	S	S	*	*			trans	-85.6	103.3	161.5	176	0	0	0	0	109.8
891	R	43.3	Very low	42.1	Very low	243 Å²	243	146 Å²	146	92%	0.917	74%	0.741	S	S	*	*	S	Bend	trans	-164.5	-3.1	154.1	-114.5	172.1	-173.1	-175.3	2.1	118.1
892	K	42.9	Very low	42.1	Very low	204 Å²	204	146.5 Å²	146.5	89%	0.887	74%	0.738	S	S	*	*	S	Bend	trans	-150.8	78	177	-82.2	-172.5	174.4	176	0	113.8
893	R	38.8	Very low	42.4	Very low	219 Å²	219	143 Å²	143	83%	0.826	72%	0.719	S	S	*	*			trans	-153.5	103.8	152.9	-90.5	-172.1	-179.6	170.7	-1.7	107.8
894	R	40	Very low	43	Very low	249 Å²	249	142.3 Å²	142.3	94%	0.94	72%	0.719	S	S	*	*			trans	-102.4	11.2	-167.9	-150.3	176.8	172.6	-178.3	-3.4	114.4
895	N	39.1	Very low	44.4	Very low	161 Å²	161	139.5 Å²	139.5	86%	0.861	71%	0.713	S	S	*	*			trans	-127.5	63	176.5	-75.1	14.2	0	0	0	111.2
896	R	42.9	Very low	46.5	Very low	149 Å²	149	135.3 Å²	135.3	56%	0.562	69%	0.685	S	S	*	*	S	Bend	trans	-133	146.6	165.9	-85.5	-170.7	175.2	-160.3	-5.4	109.3	E853 P898	E853-R896 IonicContact OE1-CZ 3.89Å; E853-R896 IonicContact OE1-NH1 3.79Å; E853-R896 PolarHBondContact OE1-NH1 3.07Å; E853-R896 IonicContact OE2-NH1 3.13Å; R896-P898 VanDerWaalsContact O-CD 3.28Å; R896-P898 WeakPolarHBondContact O-CD 3.17Å
897	V	36.8	Very low	48.6	Very low	106 Å²	106	131.8 Å²	131.8	64%	0.642	66%	0.662	S	S	*	*			trans	-43.6	112.3	175.5	177.2	0	0	0	0	110.3	T408	T408-V897 HydrophobicContact CG2-CB 4.45Å; T408-V897 HydrophobicContact CG2-CG1 3.66Å; T408-V897 HydrophobicContact CG2-CG2 4.21Å
898	P	35.8	Very low	50.8	Low	119 Å²	119	125.4 Å²	125.4	77%	0.773	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	121.6	175.9	0.9	18.4	0	0	0	109.3	R896	R896-P898 VanDerWaalsContact O-CD 3.28Å; R896-P898 WeakPolarHBondContact O-CD 3.17Å
899	G	36.8	Very low	53.3	Low	71 Å²	71	115.1 Å²	115.1	73%	0.732	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.3	-12.4	-178.5	0	0	0	0	0	113.7	G901	G899-G901 PolarHBondContact O-N 3.05Å
900	G	36.4	Very low	55.7	Low	56 Å²	56	108 Å²	108	58%	0.577	59%	0.588	S	S	*	*			trans	-69.5	120.4	174.9	0	0	0	0	0	111.9
901	G	43.7	Very low	58.1	Low	59 Å²	59	103.3 Å²	103.3	61%	0.608	55%	0.554	S	S	*	*	S	Bend	trans	-54.7	176	139.1	0	0	0	0	0	109.8	G899 N903	G899-G901 PolarHBondContact O-N 3.05Å; G901-N903 PolarHBondContact O-N 3.4Å
902	D	51.2	Low	60.4	Low	114 Å²	114	95.4 Å²	95.4	61%	0.61	54%	0.536	S	S	*	.			trans	-40	118.3	176.2	-92.8	-22.5	0	0	0	109.8	T904 A905	D902-T904 PolarHBondContact O-N 3.46Å; D902-A905 HydrophobicContact CB-CB 4.5Å; D902-A905 VanDerWaalsContact O-CB 3.3Å; D902-A905 WeakPolarHBondContact O-CB 2.7Å; D902-A905 PolarHBondContact O-N 3.43Å
903	N	59.4	Low	62.8	Low	78 Å²	78	90.1 Å²	90.1	42%	0.417	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-4.7	-174.5	-78.6	3	0	0	0	113.3	E853 G901 W906	E853-N903 PolarHBondContact OE1-ND2 3.4Å; G901-N903 PolarHBondContact O-N 3.4Å; N903-W906 PolarHBondContact O-NE1 3.17Å
904	T	67.4	Low	65.5	Low	52 Å²	52	79.7 Å²	79.7	32%	0.319	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	12.4	178.5	57.2	0	0	0	0	112.7	L879 D902 W906 A907	L879-T904 HydrophobicContact CD1-CG2 3.58Å; D902-T904 PolarHBondContact O-N 3.46Å; T904-W906 PolarHBondContact O-N 3.21Å; T904-A907 WeakPolarHBondContact O-CB 3.47Å; T904-A907 PolarHBondContact O-N 3.13Å
905	A	74.8	Confident	68.2	Low	56 Å²	56	68 Å²	68	46%	0.463	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-58.1	-34.4	179.6	0	0	0	0	0	112.2	D902 A907 S908	D902-A905 HydrophobicContact CB-CB 4.5Å; D902-A905 VanDerWaalsContact O-CB 3.3Å; D902-A905 WeakPolarHBondContact O-CB 2.7Å; D902-A905 PolarHBondContact O-N 3.43Å; A905-A907 PolarHBondContact O-N 3.22Å; A905-S908 PolarHBondContact O-N 3.14Å; A905-S908 VanDerWaalsContact O-N 3.17Å; A905-S908 PolarHBondContact O-OG 2.98Å
906	W	84.8	Confident	70.9	Confident	21 Å²	21	67.2 Å²	67.2	8%	0.08	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-59.7	-28.9	173.9	62.8	-98.4	0	0	0	113	Y848 V852 A856 A859 A860 H863 A877 L879 N903 T904 S908 L909	Y848-W906 HydrophobicContact CD2-CB 3.92Å; Y848-W906 HydrophobicContact CE1-CB 4.4Å; Y848-W906 HydrophobicContact CE2-CB 3.55Å; Y848-W906 WeakPolarHBondContact CE2-O 3.34Å; V852-W906 HydrophobicContact CG2-CG 4.2Å; A856-W906 HydrophobicContact CB-CZ2 3.85Å; A859-W906 HydrophobicContact CB-CH2 4.14Å; A860-W906 HydrophobicContact CB-CD2 3.85Å; A860-W906 HydrophobicContact CB-CE3 3.72Å; A860-W906 HydrophobicContact CB-CH2 3.97Å; A860-W906 HydrophobicContact CB-CZ2 4.09Å; A860-W906 HydrophobicContact CB-CZ3 3.79Å; H863-W906 HydrophobicContact CB-CZ3 4.24Å; A877-W906 HydrophobicContact CB-CE3 4.33Å; A877-W906 HydrophobicContact CB-CH2 3.99Å; A877-W906 HydrophobicContact CB-CZ3 3.49Å; A877-W906 VanDerWaalsContact CB-CZ3 3.49Å; L879-W906 HydrophobicContact CD2-CH2 3.79Å; L879-W906 HydrophobicContact CD2-CZ2 3.67Å; L879-W906 HydrophobicContact CG-CH2 4.31Å; L879-W906 HydrophobicContact CG-CZ2 4.47Å; N903-W906 PolarHBondContact O-NE1 3.17Å; T904-W906 PolarHBondContact O-N 3.21Å; W906-S908 PolarHBondContact O-N 3.3Å; W906-L909 WeakPolarHBondContact O-CB 3.19Å; W906-L909 PolarHBondContact O-N 3.39Å
907	A	85.3	Confident	73.4	Confident	29 Å²	29	63.4 Å²	63.4	24%	0.24	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-71.3	-11	-180	0	0	0	0	0	113.5	A877 L879 T904 A905	A877-A907 HydrophobicContact CB-CB 3.45Å; A877-A907 VanDerWaalsContact CB-CB 3.45Å; L879-A907 HydrophobicContact CD1-CB 4.29Å; T904-A907 WeakPolarHBondContact O-CB 3.47Å; T904-A907 PolarHBondContact O-N 3.13Å; A905-A907 PolarHBondContact O-N 3.22Å
908	S	87.1	Confident	76.3	Confident	87 Å²	87	58.4 Å²	58.4	61%	0.608	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-88.2	-11.6	177.8	67.3	0	0	0	0	114	A905 W906 T910	A905-S908 PolarHBondContact O-N 3.14Å; A905-S908 VanDerWaalsContact O-N 3.17Å; A905-S908 PolarHBondContact O-OG 2.98Å; W906-S908 PolarHBondContact O-N 3.3Å; S908-T910 PolarHBondContact O-N 3.22Å
909	L	89.9	Confident	79.2	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.099	35%	0.351	C	S	.	.			trans	-63.2	120.1	-177.5	180	69.4	0	0	0	110.6	Y848 H863 F864 C867 W906 E913 L914	Y848-L909 HydrophobicContact CD2-CD2 3.81Å; Y848-L909 HydrophobicContact CE2-CB 4.15Å; Y848-L909 HydrophobicContact CE2-CD2 3.62Å; H863-L909 PolarHBondContact CE1-O 2.82Å; H863-L909 PolarHBondContact NE2-O 3.13Å; F864-L909 HydrophobicContact CD2-CD2 4.02Å; F864-L909 HydrophobicContact CE2-CD2 4.39Å; C867-L909 PolarHBondContact SG-O 2.69Å; C867-L909 VanDerWaalsContact SG-O 3.33Å; W906-L909 WeakPolarHBondContact O-CB 3.19Å; W906-L909 PolarHBondContact O-N 3.39Å; L909-E913 HydrophobicContact CD1-CB 4.26Å; L909-L914 HydrophobicContact CD1-CB 4.1Å; L909-L914 HydrophobicContact CD2-CB 4.29Å; L909-L914 HydrophobicContact CD2-CD1 4.27Å; L909-L914 HydrophobicContact CD2-CD2 4.47Å; L909-L914 HydrophobicContact CG-CB 4.27Å
910	T	91.7	Very high	82	Confident	56 Å²	56	54.1 Å²	54.1	34%	0.344	34%	0.341	S	S	.	.			trans	-95.8	160.6	175	62.7	0	0	0	0	112.2	S908 S912 E913 L914	S908-T910 PolarHBondContact O-N 3.22Å; T910-S912 VanDerWaalsContact C-N 3.3Å; T910-S912 PolarHBondContact O-N 3.02Å; T910-E913 PolarHBondContact N-OE2 3.09Å; T910-E913 VanDerWaalsContact N-OE2 3.08Å; T910-E913 PolarHBondContact O-N 2.96Å; T910-E913 WeakPolarHBondContact OG1-CB 3.06Å; T910-E913 VanDerWaalsContact OG1-CD 3.26Å; T910-E913 WeakPolarHBondContact OG1-CG 3.2Å; T910-E913 PolarHBondContact OG1-N 2.98Å; T910-E913 PolarHBondContact OG1-OE2 2.86Å; T910-E913 VanDerWaalsContact OG1-OE2 3.04Å; T910-L914 PolarHBondContact O-N 3.02Å
911	P	92.4	Very high	84.8	Confident	21 Å²	21	52.3 Å²	52.3	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-55.1	-42.9	173.9	-24.1	31.5	0	0	0	113	C867 A875 L914 W915	C867-P911 HydrophobicContact CB-CG 4.48Å; A875-P911 HydrophobicContact CB-CG 4.15Å; P911-L914 PolarHBondContact O-N 3.18Å; P911-W915 VanDerWaalsContact O-CD1 3.29Å; P911-W915 PolarHBondContact O-N 2.97Å
912	S	92.1	Very high	87.3	Confident	77 Å²	77	49.5 Å²	49.5	54%	0.538	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-42.5	179.8	-178.8	0	0	0	0	112.3	T910 K916	T910-S912 VanDerWaalsContact C-N 3.3Å; T910-S912 PolarHBondContact O-N 3.02Å; S912-K916 WeakPolarHBondContact O-CB 3.48Å; S912-K916 PolarHBondContact O-N 3.27Å
913	E	93.4	Very high	89.4	Confident	94 Å²	94	48.2 Å²	48.2	44%	0.439	28%	0.278	S	S	.	.	H	α-helix	trans	-65.6	-42	176	-73.6	167.6	160.8	0	0	111.9	L909 T910 K916 N917	L909-E913 HydrophobicContact CD1-CB 4.26Å; T910-E913 PolarHBondContact N-OE2 3.09Å; T910-E913 VanDerWaalsContact N-OE2 3.08Å; T910-E913 PolarHBondContact O-N 2.96Å; T910-E913 WeakPolarHBondContact OG1-CB 3.06Å; T910-E913 VanDerWaalsContact OG1-CD 3.26Å; T910-E913 WeakPolarHBondContact OG1-CG 3.2Å; T910-E913 PolarHBondContact OG1-N 2.98Å; T910-E913 PolarHBondContact OG1-OE2 2.86Å; T910-E913 VanDerWaalsContact OG1-OE2 3.04Å; E913-K916 PolarHBondContact O-N 3.5Å; E913-N917 WeakPolarHBondContact O-CB 3.26Å; E913-N917 PolarHBondContact O-N 2.96Å; E913-N917 PolarHBondContact O-ND2 3.32Å
914	L	95.3	Very high	91	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.1	-48.6	177	178.6	57.9	0	0	0	111.1	I844 F864 C867 F868 L909 T910 P911 K916 N917 I918	I844-L914 HydrophobicContact CD1-CD1 4.17Å; I844-L914 HydrophobicContact CG2-CD1 3.9Å; F864-L914 HydrophobicContact CD2-CD2 4.48Å; F864-L914 HydrophobicContact CE2-CD1 3.77Å; F864-L914 HydrophobicContact CE2-CD2 4.17Å; F864-L914 HydrophobicContact CZ-CD1 4.04Å; F864-L914 HydrophobicContact CZ-CD2 4.25Å; C867-L914 HydrophobicContact CB-CB 4.37Å; C867-L914 HydrophobicContact CB-CD2 3.63Å; F868-L914 HydrophobicContact CB-CD2 3.88Å; L909-L914 HydrophobicContact CD1-CB 4.1Å; L909-L914 HydrophobicContact CD2-CB 4.29Å; L909-L914 HydrophobicContact CD2-CD1 4.27Å; L909-L914 HydrophobicContact CD2-CD2 4.47Å; L909-L914 HydrophobicContact CG-CB 4.27Å; T910-L914 PolarHBondContact O-N 3.02Å; P911-L914 PolarHBondContact O-N 3.18Å; L914-K916 VanDerWaalsContact C-N 3.35Å; L914-K916 PolarHBondContact O-N 2.98Å; L914-N917 CarbonylContact O-C 3.28Å; L914-N917 WeakPolarHBondContact O-CB 3.48Å; L914-N917 PolarHBondContact O-N 3.44Å; L914-N917 VanDerWaalsContact O-N 3.14Å; L914-I918 HydrophobicContact CD1-CD1 4.25Å; L914-I918 HydrophobicContact CD1-CG1 4.32Å; L914-I918 HydrophobicContact CG-CD1 4.05Å; L914-I918 WeakPolarHBondContact O-CG1 3.27Å; L914-I918 PolarHBondContact O-N 2.95Å
915	W	95.8	Very high	92.3	Very high	3 Å²	3	46.1 Å²	46.1	1%	0.011	27%	0.266	C	S	.	.	H	α-helix	trans	-67.5	-33.8	180	-82.2	98.6	0	0	0	113	I837 F868 P911 I918 A919 M930 E933 V935 V938	I837-W915 HydrophobicContact CD1-CZ3 4.36Å; I837-W915 HydrophobicContact CG2-CH2 3.83Å; I837-W915 HydrophobicContact CG2-CZ3 4.04Å; F868-W915 HydrophobicContact CD2-CZ2 4.02Å; F868-W915 HydrophobicContact CE2-CH2 4.15Å; F868-W915 HydrophobicContact CE2-CZ2 4.01Å; F868-W915 WeakPolarHBondContact O-CZ2 3.41Å; F868-W915 PolarHBondContact O-NE1 3.09Å; P911-W915 VanDerWaalsContact O-CD1 3.29Å; P911-W915 PolarHBondContact O-N 2.97Å; W915-I918 HydrophobicContact CD2-CD1 4.23Å; W915-I918 HydrophobicContact CE3-CD1 4.16Å; W915-I918 HydrophobicContact CE3-CG2 4.4Å; W915-I918 HydrophobicContact CZ3-CD1 4.38Å; W915-I918 HydrophobicContact CZ3-CG2 4.37Å; W915-I918 PolarHBondContact O-N 3.41Å; W915-A919 PolarHBondContact O-N 3.22Å; W915-M930 HydrophobicContact CE3-CE 4.07Å; W915-M930 HydrophobicContact CZ3-CE 4.13Å; W915-E933 WeakPolarHBondContact CB-O 3.33Å; W915-V935 VanDerWaalsContact CE2-N 3.3Å; W915-V935 HydrophobicContact CH2-CB 4.35Å; W915-V935 VanDerWaalsContact CZ2-CA 3.41Å; W915-V935 HydrophobicContact CZ2-CB 3.46Å; W915-V935 VanDerWaalsContact CZ2-CB 3.46Å; W915-V935 HydrophobicContact CZ2-CG2 3.89Å; W915-V938 HydrophobicContact CE3-CG2 4.27Å; W915-V938 HydrophobicContact CH2-CB 4.47Å; W915-V938 HydrophobicContact CH2-CG2 4.08Å; W915-V938 HydrophobicContact CZ3-CB 4.48Å; W915-V938 HydrophobicContact CZ3-CG2 3.63Å
916	K	95.3	Very high	93.3	Very high	144 Å²	144	43.5 Å²	43.5	63%	0.626	25%	0.245	S	C	*	.	H	α-helix	trans	-63.2	-41.4	169.2	-176.1	-178.8	178.8	-177.9	0	112	S912 E913 L914 A919 T920	S912-K916 WeakPolarHBondContact O-CB 3.48Å; S912-K916 PolarHBondContact O-N 3.27Å; E913-K916 PolarHBondContact O-N 3.5Å; L914-K916 VanDerWaalsContact C-N 3.35Å; L914-K916 PolarHBondContact O-N 2.98Å; K916-A919 PolarHBondContact O-N 3.02Å; K916-T920 WeakPolarHBondContact O-CB 3.28Å; K916-T920 PolarHBondContact O-N 3.24Å; K916-T920 PolarHBondContact O-OG1 2.76Å
917	N	96.1	Very high	93.7	Very high	70 Å²	70	43.9 Å²	43.9	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-65.3	-40.9	175.7	-69.2	-19.9	0	0	0	111	I844 E913 L914 T920 E921	I844-N917 HydrophobicContact CD1-CB 3.74Å; I844-N917 HydrophobicContact CG1-CB 4.49Å; E913-N917 WeakPolarHBondContact O-CB 3.26Å; E913-N917 PolarHBondContact O-N 2.96Å; E913-N917 PolarHBondContact O-ND2 3.32Å; L914-N917 CarbonylContact O-C 3.28Å; L914-N917 WeakPolarHBondContact O-CB 3.48Å; L914-N917 PolarHBondContact O-N 3.44Å; L914-N917 VanDerWaalsContact O-N 3.14Å; N917-T920 PolarHBondContact O-N 3.3Å; N917-E921 VanDerWaalsContact O-CB 3.24Å; N917-E921 WeakPolarHBondContact O-CB 3.38Å; N917-E921 PolarHBondContact O-N 3.42Å
918	I	97.4	Very high	94.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.1	-45.5	174.5	-68.8	168.6	0	0	0	110.7	I837 C840 A841 I844 F868 L914 W915 T920 E921 A922 M930	I837-I918 HydrophobicContact CG2-CG2 4.41Å; C840-I918 HydrophobicContact CB-CG2 3.92Å; A841-I918 HydrophobicContact CB-CD1 4.26Å; I844-I918 HydrophobicContact CD1-CB 4.44Å; I844-I918 HydrophobicContact CD1-CG1 3.67Å; F868-I918 HydrophobicContact CD2-CD1 3.83Å; F868-I918 HydrophobicContact CE2-CD1 3.84Å; L914-I918 HydrophobicContact CD1-CD1 4.25Å; L914-I918 HydrophobicContact CD1-CG1 4.32Å; L914-I918 HydrophobicContact CG-CD1 4.05Å; L914-I918 WeakPolarHBondContact O-CG1 3.27Å; L914-I918 PolarHBondContact O-N 2.95Å; W915-I918 HydrophobicContact CD2-CD1 4.23Å; W915-I918 HydrophobicContact CE3-CD1 4.16Å; W915-I918 HydrophobicContact CE3-CG2 4.4Å; W915-I918 HydrophobicContact CZ3-CD1 4.38Å; W915-I918 HydrophobicContact CZ3-CG2 4.37Å; W915-I918 PolarHBondContact O-N 3.41Å; I918-T920 VanDerWaalsContact C-N 3.34Å; I918-T920 PolarHBondContact O-N 3.3Å; I918-E921 PolarHBondContact O-N 3.3Å; I918-A922 WeakPolarHBondContact O-CB 3.4Å; I918-A922 PolarHBondContact O-N 2.97Å; I918-M930 HydrophobicContact CB-CE 4.46Å; I918-M930 HydrophobicContact CG2-CE 3.71Å
919	A	96.8	Very high	94.5	Very high	19 Å²	19	45.9 Å²	45.9	16%	0.157	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-39.2	177	0	0	0	0	0	112.3	W915 K916 A922 Q923 M930	W915-A919 PolarHBondContact O-N 3.22Å; K916-A919 PolarHBondContact O-N 3.02Å; A919-A922 PolarHBondContact O-N 3.34Å; A919-Q923 WeakPolarHBondContact O-CB 3.32Å; A919-Q923 PolarHBondContact O-N 2.94Å; A919-M930 HydrophobicContact CB-CB 4.49Å; A919-M930 HydrophobicContact CB-CE 3.98Å
920	T	96	Very high	94.5	Very high	82 Å²	82	45.8 Å²	45.8	50%	0.503	24%	0.239	S	C	.	.	H	α-helix	trans	-67.6	-39.9	176.1	-55.2	0	0	0	0	111.5	K916 N917 I918 Q923 S924	K916-T920 WeakPolarHBondContact O-CB 3.28Å; K916-T920 PolarHBondContact O-N 3.24Å; K916-T920 PolarHBondContact O-OG1 2.76Å; N917-T920 PolarHBondContact O-N 3.3Å; I918-T920 VanDerWaalsContact C-N 3.34Å; I918-T920 PolarHBondContact O-N 3.3Å; T920-Q923 PolarHBondContact O-N 3.39Å; T920-S924 VanDerWaalsContact O-CB 3.26Å; T920-S924 WeakPolarHBondContact O-CB 3.14Å; T920-S924 PolarHBondContact O-N 2.77Å; T920-S924 PolarHBondContact O-OG 3.41Å
921	E	95.6	Very high	94.1	Very high	17 Å²	17	49.6 Å²	49.6	8%	0.079	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-46.7	174.7	-175.9	68.8	-147.4	0	0	110.8	R592 C840 H843 N917 I918 Q923 S924 Y925	R592-E921 VanDerWaalsContact CZ-CD 3.48Å; R592-E921 IonicContact CZ-OE1 2.85Å; R592-E921 IonicContact CZ-OE2 2.86Å; R592-E921 VanDerWaalsContact NH1-CD 3.26Å; R592-E921 IonicContact NH1-OE1 3.08Å; R592-E921 PolarHBondContact NH1-OE1 3.46Å; R592-E921 IonicContact NH1-OE2 2.96Å; R592-E921 PolarHBondContact NH1-OE2 3.15Å; R592-E921 IonicContact NH2-OE1 3.11Å; R592-E921 PolarHBondContact NH2-OE1 3.44Å; R592-E921 VanDerWaalsContact NH2-OE1 3.08Å; R592-E921 IonicContact NH2-OE2 3.53Å; R592-E921 PolarHBondContact NH2-OE2 3.18Å; C840-E921 HydrophobicContact CB-CB 3.98Å; C840-E921 HydrophobicContact CB-CG 3.66Å; H843-E921 HydrophobicContact CB-CG 4.36Å; H843-E921 IonicContact CE1-OE1 2.8Å; H843-E921 IonicContact CG-OE1 2.65Å; H843-E921 IonicContact ND1-OE1 3.11Å; H843-E921 PolarHBondContact ND1-OE1 3.48Å; N917-E921 VanDerWaalsContact O-CB 3.24Å; N917-E921 WeakPolarHBondContact O-CB 3.38Å; N917-E921 PolarHBondContact O-N 3.42Å; I918-E921 PolarHBondContact O-N 3.3Å; E921-Q923 VanDerWaalsContact C-N 3.32Å; E921-Q923 PolarHBondContact O-N 3.26Å; E921-S924 PolarHBondContact O-N 2.92Å; E921-S924 PolarHBondContact O-OG 3.17Å; E921-Y925 WeakPolarHBondContact O-CB 3.31Å; E921-Y925 PolarHBondContact O-N 3.09Å
922	A	96.4	Very high	94	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-58.7	-43.1	176.6	0	0	0	0	0	112	L836 I918 A919 Y926 H927 F928	L836-A922 HydrophobicContact CD2-CB 4.37Å; I918-A922 WeakPolarHBondContact O-CB 3.4Å; I918-A922 PolarHBondContact O-N 2.97Å; A919-A922 PolarHBondContact O-N 3.34Å; A922-Y926 CarbonylContact O-C 3.5Å; A922-Y926 WeakPolarHBondContact O-CA 3.38Å; A922-Y926 WeakPolarHBondContact O-CB 3.26Å; A922-Y926 PolarHBondContact O-N 3.21Å; A922-Y926 VanDerWaalsContact O-N 3.16Å; A922-H927 PolarHBondContact O-N 3.49Å; A922-F928 CarbonylContact C-O 3.55Å; A922-F928 PolarHBondContact O-N 3.14Å
923	Q	95	Very high	93.8	Very high	86 Å²	86	51.7 Å²	51.7	40%	0.402	25%	0.252	S	S	.	.	H	α-helix	trans	-73.1	-36.5	178.3	-176.2	60.8	58.5	0	0	113.2	A919 T920 E921 H927 F928 K929	A919-Q923 WeakPolarHBondContact O-CB 3.32Å; A919-Q923 PolarHBondContact O-N 2.94Å; T920-Q923 PolarHBondContact O-N 3.39Å; E921-Q923 VanDerWaalsContact C-N 3.32Å; E921-Q923 PolarHBondContact O-N 3.26Å; Q923-H927 VanDerWaalsContact O-CA 3.22Å; Q923-H927 WeakPolarHBondContact O-CA 3.4Å; Q923-H927 PolarHBondContact O-N 3.33Å; Q923-F928 WeakPolarHBondContact CA-O 3.35Å; Q923-F928 PolarHBondContact N-O 2.87Å; Q923-K929 VanDerWaalsContact OE1-CA 3.24Å; Q923-K929 VanDerWaalsContact OE1-CB 3.28Å
924	S	93.5	Very high	93.7	Very high	47 Å²	47	48.8 Å²	48.8	33%	0.329	24%	0.243	S	C	.	.	H	α-helix	trans	-83.4	-36.5	-175.6	60.2	0	0	0	0	113.5	R592 T920 E921	R592-S924 PolarHBondContact NH2-OG 3.35Å; T920-S924 VanDerWaalsContact O-CB 3.26Å; T920-S924 WeakPolarHBondContact O-CB 3.14Å; T920-S924 PolarHBondContact O-N 2.77Å; T920-S924 PolarHBondContact O-OG 3.41Å; E921-S924 PolarHBondContact O-N 2.92Å; E921-S924 PolarHBondContact O-OG 3.17Å
925	Y	93.8	Very high	93.6	Very high	39 Å²	39	49 Å²	49	15%	0.153	24%	0.244	C	C	.	.	H	α-helix	trans	-95.3	-45	-176.1	-168.8	-84.6	0	0	0	112.6	H591 R592 R807 H843 E921	H591-Y925 AromaticContact CE1-CE2 3.82Å; H591-Y925 AromaticContact NE2-CE2 3.44Å; H591-Y925 WeakPolarHBondContact NE2-CE2 3.22Å; H591-Y925 AromaticContact NE2-CZ 3.58Å; R592-Y925 HydrophobicContact CG-CD2 4.42Å; R807-Y925 HydrophobicContact CB-CE1 4.48Å; H843-Y925 AromaticContact CE1-CE1 3.97Å; H843-Y925 AromaticContact CE1-CZ 3.99Å; E921-Y925 WeakPolarHBondContact O-CB 3.31Å; E921-Y925 PolarHBondContact O-N 3.09Å
926	Y	95.1	Very high	93.5	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.008	26%	0.256	C	S	.	.	S	Bend	trans	-103.5	-4.9	-176.8	-60.7	-80.5	0	0	0	113.2	V806 L809 G810 L836 R839 A922 F928	V806-Y926 HydrophobicContact CG1-CE1 4.3Å; V806-Y926 WeakPolarHBondContact O-CE1 3.01Å; L809-Y926 HydrophobicContact CB-CD1 4.06Å; L809-Y926 HydrophobicContact CB-CE1 4.39Å; G810-Y926 WeakPolarHBondContact CA-O 3.11Å; L836-Y926 VanDerWaalsContact CD1-CB 3.48Å; L836-Y926 HydrophobicContact CD1-CD1 3.95Å; L836-Y926 HydrophobicContact CD1-CD2 3.37Å; L836-Y926 HydrophobicContact CD1-CE2 4.05Å; L836-Y926 HydrophobicContact CD1-CG 3.3Å; R839-Y926 HydrophobicContact CB-CE2 4.41Å; R839-Y926 VanDerWaalsContact CB-OH 3.25Å; R839-Y926 WeakPolarHBondContact CB-OH 2.99Å; R839-Y926 VanDerWaalsContact CD-OH 3.23Å; R839-Y926 WeakPolarHBondContact CD-OH 3.43Å; A922-Y926 CarbonylContact O-C 3.5Å; A922-Y926 WeakPolarHBondContact O-CA 3.38Å; A922-Y926 WeakPolarHBondContact O-CB 3.26Å; A922-Y926 PolarHBondContact O-N 3.21Å; A922-Y926 VanDerWaalsContact O-N 3.16Å; Y926-F928 PolarHBondContact O-N 3.38Å
927	H	94.1	Very high	93.4	Very high	29 Å²	29	48.4 Å²	48.4	13%	0.134	25%	0.245	C	C	.	.			trans	57.3	30.1	-178.5	-49.9	87.6	0	0	0	113.5	F570 R589 Q590 A922 Q923	F570-H927 AromaticContact CE1-CE1 3.58Å; F570-H927 AromaticContact CE1-ND1 3.79Å; R589-H927 VanDerWaalsContact CD-CG 3.5Å; Q590-H927 PolarHBondContact O-NE2 3.28Å; A922-H927 PolarHBondContact O-N 3.49Å; Q923-H927 VanDerWaalsContact O-CA 3.22Å; Q923-H927 WeakPolarHBondContact O-CA 3.4Å; Q923-H927 PolarHBondContact O-N 3.33Å
928	F	94.6	Very high	93.3	Very high	13 Å²	13	45 Å²	45	6%	0.057	23%	0.227	C	C	.	.			trans	-106.8	126.5	179.4	-174.1	-93.4	0	0	0	111	L813 E814 I833 L836 A922 Q923 Y926 M930	L813-F928 HydrophobicContact CB-CD2 4.05Å; L813-F928 HydrophobicContact CB-CE2 3.78Å; L813-F928 HydrophobicContact CD1-CD2 4.35Å; L813-F928 HydrophobicContact CD1-CE2 4.31Å; E814-F928 HydrophobicContact CG-CD2 4.32Å; I833-F928 HydrophobicContact CD1-CE1 3.81Å; I833-F928 HydrophobicContact CD1-CE2 4.49Å; I833-F928 HydrophobicContact CD1-CZ 3.64Å; L836-F928 HydrophobicContact CD2-CB 4Å; L836-F928 HydrophobicContact CD2-CD1 3.38Å; L836-F928 HydrophobicContact CD2-CE1 3.99Å; L836-F928 HydrophobicContact CD2-CG 3.77Å; A922-F928 CarbonylContact C-O 3.55Å; A922-F928 PolarHBondContact O-N 3.14Å; Q923-F928 WeakPolarHBondContact CA-O 3.35Å; Q923-F928 PolarHBondContact N-O 2.87Å; Y926-F928 PolarHBondContact O-N 3.38Å; F928-M930 PolarHBondContact O-N 2.86Å
929	K	93.4	Very high	93.1	Very high	145 Å²	145	46.9 Å²	46.9	63%	0.63	24%	0.238	S	C	*	.			trans	-87.3	99.4	-177.9	-168.6	174.8	-179.2	176.7	0	111.8	Q923	Q923-K929 VanDerWaalsContact OE1-CA 3.24Å; Q923-K929 VanDerWaalsContact OE1-CB 3.28Å
930	M	90.4	Very high	93	Very high	17 Å²	17	54 Å²	54	8%	0.084	27%	0.269	C	S	.	.			trans	-88.2	125.8	173.7	-166.1	171.9	68.4	0	0	111.3	I837 W915 I918 A919 F928 C932 V938	I837-M930 HydrophobicContact CD1-SD 4.05Å; I837-M930 HydrophobicContact CG1-SD 4.01Å; W915-M930 HydrophobicContact CE3-CE 4.07Å; W915-M930 HydrophobicContact CZ3-CE 4.13Å; I918-M930 HydrophobicContact CB-CE 4.46Å; I918-M930 HydrophobicContact CG2-CE 3.71Å; A919-M930 HydrophobicContact CB-CB 4.49Å; A919-M930 HydrophobicContact CB-CE 3.98Å; F928-M930 PolarHBondContact O-N 2.86Å; M930-C932 HydrophobicContact CG-CB 4.22Å; M930-V938 HydrophobicContact SD-CG2 4.32Å
931	Q	84.3	Confident	92.9	Very high	136 Å²	136	55.1 Å²	55.1	64%	0.636	27%	0.266	S	S	*	.			trans	-106.3	50.4	178.5	-61.6	177.9	-7.1	0	0	111.3
932	C	89.5	Confident	92.8	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.034	27%	0.268	C	S	.	.			trans	-137.5	136.3	179.9	-58.7	0	0	0	0	109.3	M930 Q937 V938	M930-C932 HydrophobicContact CG-CB 4.22Å; C932-Q937 HydrophobicContact CB-CB 4.21Å; C932-V938 HydrophobicContact CB-CB 4.49Å; C932-V938 HydrophobicContact CB-CG2 3.3Å
933	E	87.1	Confident	92.6	Very high	136 Å²	136	57.9 Å²	57.9	64%	0.636	29%	0.291	S	S	*	.	S	Bend	trans	-113.5	0.3	-176	-62	-175.9	167.7	0	0	113.2	W915	W915-E933 WeakPolarHBondContact CB-O 3.33Å
934	S	91.7	Very high	92.5	Very high	34 Å²	34	54.2 Å²	54.2	24%	0.238	27%	0.273	C	S	.	.	S	Bend	trans	-150.8	161.9	175.3	73.9	0	0	0	0	112	D936 Q937 V938	S934-D936 VanDerWaalsContact C-N 3.27Å; S934-D936 PolarHBondContact O-N 3.46Å; S934-Q937 PolarHBondContact O-N 3.37Å; S934-Q937 WeakPolarHBondContact OG-CG 3.19Å; S934-Q937 PolarHBondContact OG-N 3.38Å; S934-V938 PolarHBondContact O-N 2.72Å
935	V	93.4	Very high	92.4	Very high	3 Å²	3	54 Å²	54	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-58.2	-39.4	175.2	65.6	0	0	0	0	112.1	W915 Q937 V938 V939 K946 L949	W915-V935 VanDerWaalsContact CE2-N 3.3Å; W915-V935 HydrophobicContact CH2-CB 4.35Å; W915-V935 VanDerWaalsContact CZ2-CA 3.41Å; W915-V935 HydrophobicContact CZ2-CB 3.46Å; W915-V935 VanDerWaalsContact CZ2-CB 3.46Å; W915-V935 HydrophobicContact CZ2-CG2 3.89Å; V935-Q937 PolarHBondContact O-N 3.04Å; V935-V938 PolarHBondContact O-N 2.94Å; V935-V939 HydrophobicContact CG2-CG2 4.21Å; V935-V939 WeakPolarHBondContact O-CB 3.33Å; V935-V939 VanDerWaalsContact O-CG2 3.3Å; V935-V939 WeakPolarHBondContact O-CG2 3.48Å; V935-V939 PolarHBondContact O-N 3.4Å; V935-K946 HydrophobicContact CG2-CD 4.4Å; V935-K946 HydrophobicContact CG2-CG 4.08Å; V935-L949 HydrophobicContact CG2-CD1 4.18Å
936	D	93.5	Very high	92.5	Very high	51 Å²	51	52.9 Å²	52.9	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-64.3	-42.3	-177.9	-65.2	-29.6	0	0	0	111.4	S871 S934 V938 V939 E940 K946	S871-D936 WeakPolarHBondContact CB-OD2 3.38Å; S871-D936 VanDerWaalsContact OG-CG 3.22Å; S871-D936 PolarHBondContact OG-OD1 2.98Å; S871-D936 PolarHBondContact OG-OD2 2.95Å; S934-D936 VanDerWaalsContact C-N 3.27Å; S934-D936 PolarHBondContact O-N 3.46Å; D936-V938 VanDerWaalsContact C-N 3.34Å; D936-V938 PolarHBondContact O-N 2.73Å; D936-V939 PolarHBondContact O-N 3.29Å; D936-E940 WeakPolarHBondContact O-CB 3.39Å; D936-E940 PolarHBondContact O-N 3.01Å; D936-K946 WeakPolarHBondContact OD1-CE 3.4Å; D936-K946 IonicContact OD1-NZ 2.76Å; D936-K946 PolarHBondContact OD1-NZ 2.73Å
937	Q	94.4	Very high	92.4	Very high	84 Å²	84	53.4 Å²	53.4	39%	0.393	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-39	176.5	-69.3	175.2	14.4	0	0	112	C932 S934 V935 K941	C932-Q937 HydrophobicContact CB-CB 4.21Å; S934-Q937 PolarHBondContact O-N 3.37Å; S934-Q937 WeakPolarHBondContact OG-CG 3.19Å; S934-Q937 PolarHBondContact OG-N 3.38Å; V935-Q937 PolarHBondContact O-N 3.04Å; Q937-K941 WeakPolarHBondContact O-CB 3.43Å; Q937-K941 PolarHBondContact O-N 2.89Å
938	V	93.4	Very high	92.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68	-45.9	177.7	173.3	0	0	0	0	110.7	I837 W915 M930 C932 S934 V935 D936 E940 K941 Y942 L944	I837-V938 HydrophobicContact CD1-CB 4.49Å; I837-V938 HydrophobicContact CD1-CG1 3.36Å; I837-V938 HydrophobicContact CD1-CG2 4.34Å; W915-V938 HydrophobicContact CE3-CG2 4.27Å; W915-V938 HydrophobicContact CH2-CB 4.47Å; W915-V938 HydrophobicContact CH2-CG2 4.08Å; W915-V938 HydrophobicContact CZ3-CB 4.48Å; W915-V938 HydrophobicContact CZ3-CG2 3.63Å; M930-V938 HydrophobicContact SD-CG2 4.32Å; C932-V938 HydrophobicContact CB-CB 4.49Å; C932-V938 HydrophobicContact CB-CG2 3.3Å; S934-V938 PolarHBondContact O-N 2.72Å; V935-V938 PolarHBondContact O-N 2.94Å; D936-V938 VanDerWaalsContact C-N 3.34Å; D936-V938 PolarHBondContact O-N 2.73Å; V938-E940 VanDerWaalsContact C-N 3.32Å; V938-E940 PolarHBondContact O-N 2.8Å; V938-K941 PolarHBondContact O-N 2.88Å; V938-Y942 HydrophobicContact CG1-CD2 3.84Å; V938-Y942 HydrophobicContact CG1-CE2 4.44Å; V938-Y942 WeakPolarHBondContact O-CD2 3.39Å; V938-Y942 PolarHBondContact O-N 3.02Å; V938-L944 HydrophobicContact CG1-CD1 3.36Å; V938-L944 HydrophobicContact CG1-CG 4.07Å
939	V	93.5	Very high	92.6	Very high	39 Å²	39	51.8 Å²	51.8	24%	0.236	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-46.7	177.9	161.7	0	0	0	0	110.5	V935 D936 G943 L944 K946	V935-V939 HydrophobicContact CG2-CG2 4.21Å; V935-V939 WeakPolarHBondContact O-CB 3.33Å; V935-V939 VanDerWaalsContact O-CG2 3.3Å; V935-V939 WeakPolarHBondContact O-CG2 3.48Å; V935-V939 PolarHBondContact O-N 3.4Å; D936-V939 PolarHBondContact O-N 3.29Å; V939-G943 WeakPolarHBondContact O-CA 3.39Å; V939-G943 PolarHBondContact O-N 3.25Å; V939-L944 WeakPolarHBondContact CG1-O 3.47Å; V939-L944 HydrophobicContact CG2-CB 4.21Å; V939-L944 PolarHBondContact O-N 2.69Å; V939-K946 HydrophobicContact CG2-CG 3.95Å
940	E	93.9	Very high	92.7	Very high	169 Å²	169	44.9 Å²	44.9	79%	0.79	23%	0.23	S	C	*	.	H	α-helix	trans	-66.3	-45.9	177.7	-174.2	176.4	-169.4	0	0	112.2	D936 V938	D936-E940 WeakPolarHBondContact O-CB 3.39Å; D936-E940 PolarHBondContact O-N 3.01Å; V938-E940 VanDerWaalsContact C-N 3.32Å; V938-E940 PolarHBondContact O-N 2.8Å
941	K	94	Very high	93	Very high	104 Å²	104	44.6 Å²	44.6	45%	0.452	23%	0.228	S	C	.	.	H	α-helix	trans	-69.3	-38.2	-174.9	-175.5	174.8	-173.2	177.6	0	113.7	Q937 V938	Q937-K941 WeakPolarHBondContact O-CB 3.43Å; Q937-K941 PolarHBondContact O-N 2.89Å; V938-K941 PolarHBondContact O-N 2.88Å
942	Y	93.1	Very high	93.6	Very high	30 Å²	30	38.3 Å²	38.3	12%	0.118	20%	0.199	C	C	.	.	H	α-helix	trans	-114.4	2.4	-172.7	-56.8	-67.5	0	0	0	113.6	Y829 I833 V938 L944	Y829-Y942 AromaticContact CE1-CD1 3.85Å; Y829-Y942 HydrophobicContact CE1-CD1 3.85Å; Y829-Y942 AromaticContact CE1-CE1 3.99Å; Y829-Y942 HydrophobicContact CE1-CE1 3.99Å; I833-Y942 HydrophobicContact CD1-CE1 4.37Å; I833-Y942 HydrophobicContact CG1-CD1 4.36Å; I833-Y942 HydrophobicContact CG2-CD2 3.91Å; I833-Y942 HydrophobicContact CG2-CE2 4.28Å; I833-Y942 HydrophobicContact CG2-CG 4.07Å; V938-Y942 HydrophobicContact CG1-CD2 3.84Å; V938-Y942 HydrophobicContact CG1-CE2 4.44Å; V938-Y942 WeakPolarHBondContact O-CD2 3.39Å; V938-Y942 PolarHBondContact O-N 3.02Å; Y942-L944 PolarHBondContact O-N 2.98Å
943	G	92	Very high	94	Very high	47 Å²	47	38.1 Å²	38.1	49%	0.485	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	35.7	-179.3	0	0	0	0	0	113.4	R830 V939	R830-G943 VanDerWaalsContact CD-O 3.22Å; R830-G943 WeakPolarHBondContact CD-O 3.24Å; V939-G943 WeakPolarHBondContact O-CA 3.39Å; V939-G943 PolarHBondContact O-N 3.25Å
944	L	93.3	Very high	94.5	Very high	8 Å²	8	31.6 Å²	31.6	4%	0.042	17%	0.167	C	C	.	.			trans	-80.2	163.6	-177.8	-49.9	-164.8	0	0	0	112.1	R830 I833 V834 I837 V938 V939 Y942 L949	R830-L944 HydrophobicContact CG-CD2 3.4Å; I833-L944 HydrophobicContact CG2-CD1 4.11Å; V834-L944 HydrophobicContact CG2-CD1 3.99Å; V834-L944 HydrophobicContact CG2-CD2 3.83Å; V834-L944 HydrophobicContact CG2-CG 4.39Å; I837-L944 HydrophobicContact CD1-CD1 4.07Å; V938-L944 HydrophobicContact CG1-CD1 3.36Å; V938-L944 HydrophobicContact CG1-CG 4.07Å; V939-L944 WeakPolarHBondContact CG1-O 3.47Å; V939-L944 HydrophobicContact CG2-CB 4.21Å; V939-L944 PolarHBondContact O-N 2.69Å; Y942-L944 PolarHBondContact O-N 2.98Å; L944-L949 HydrophobicContact CD1-CD2 4.39Å
945	Q	92.1	Very high	94.7	Very high	42 Å²	42	33.5 Å²	33.5	20%	0.196	18%	0.177	C	C	.	.			trans	-114	132.3	170.8	-61.5	-179.7	7.9	0	0	110.4	T947 T948 L949 L1113	Q945-T947 VanDerWaalsContact C-N 3.25Å; Q945-T947 PolarHBondContact O-N 3.5Å; Q945-T948 PolarHBondContact O-N 2.9Å; Q945-L949 PolarHBondContact O-N 2.72Å; Q945-L949 VanDerWaalsContact O-N 3.09Å; Q945-L1113 PolarHBondContact OE1-O 3.21Å; Q945-L1113 VanDerWaalsContact OE1-O 3.11Å
946	K	94.8	Very high	94.8	Very high	16 Å²	16	34.7 Å²	34.7	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-33.5	177.3	-63.9	-178.1	178.6	175.4	0	111.9	S871 V935 D936 V939 L949 L950 F968 D969	S871-K946 PolarHBondContact OG-NZ 3.19Å; V935-K946 HydrophobicContact CG2-CD 4.4Å; V935-K946 HydrophobicContact CG2-CG 4.08Å; D936-K946 WeakPolarHBondContact OD1-CE 3.4Å; D936-K946 IonicContact OD1-NZ 2.76Å; D936-K946 PolarHBondContact OD1-NZ 2.73Å; V939-K946 HydrophobicContact CG2-CG 3.95Å; K946-L949 PolarHBondContact O-N 2.92Å; K946-L950 WeakPolarHBondContact O-CB 3.19Å; K946-L950 PolarHBondContact O-N 3.47Å; K946-F968 HydrophobicContact CB-CB 4.47Å; K946-F968 HydrophobicContact CB-CD2 3.86Å; K946-F968 HydrophobicContact CB-CE2 4.25Å; K946-F968 HydrophobicContact CB-CG 4.04Å; K946-F968 HydrophobicContact CD-CB 3.41Å; K946-F968 VanDerWaalsContact CD-CB 3.41Å; K946-F968 HydrophobicContact CD-CD2 4.3Å; K946-F968 HydrophobicContact CD-CG 3.92Å; K946-D969 IonicContact NZ-OD1 3.7Å; K946-D969 PolarHBondContact NZ-OD1 3.4Å
947	T	94.6	Very high	94.9	Very high	14 Å²	14	33.1 Å²	33.1	9%	0.086	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-43.1	173.5	45.9	0	0	0	0	112.4	R191 L193 Q945 L950 R951 F968	R191-T947 HydrophobicContact CB-CG2 4.12Å; L193-T947 HydrophobicContact CD2-CG2 4.42Å; Q945-T947 VanDerWaalsContact C-N 3.25Å; Q945-T947 PolarHBondContact O-N 3.5Å; T947-L950 WeakPolarHBondContact O-CB 3.46Å; T947-L950 PolarHBondContact O-N 3.12Å; T947-R951 PolarHBondContact O-N 2.86Å; T947-F968 HydrophobicContact CG2-CE2 3.92Å
948	T	94.7	Very high	95	Very high	8 Å²	8	29.5 Å²	29.5	5%	0.049	16%	0.16	C	C	.	.	H	α-helix	trans	-64.3	-42.9	174.6	-54.8	0	0	0	0	111.3	V834 Q945 L950 R951 E952 L1114 V1115	V834-T948 HydrophobicContact CG1-CG2 4.23Å; Q945-T948 PolarHBondContact O-N 2.9Å; T948-L950 VanDerWaalsContact C-N 3.3Å; T948-L950 PolarHBondContact O-N 3.2Å; T948-R951 PolarHBondContact O-N 3.37Å; T948-E952 HydrophobicContact CG2-CG 4.45Å; T948-E952 WeakPolarHBondContact O-CB 3.43Å; T948-E952 WeakPolarHBondContact O-CG 3.34Å; T948-E952 PolarHBondContact O-N 2.94Å; T948-L1114 PolarHBondContact OG1-O 2.84Å; T948-V1115 WeakPolarHBondContact CG2-O 3.16Å
949	L	96.7	Very high	95.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-39.8	174.8	-69.8	171.2	0	0	0	112.1	V834 I837 T838 F868 L869 V935 L944 Q945 K946 I953	V834-L949 HydrophobicContact CG1-CD2 4.2Å; V834-L949 HydrophobicContact CG2-CD2 4.4Å; I837-L949 HydrophobicContact CG2-CD2 4.29Å; T838-L949 HydrophobicContact CG2-CD2 3.85Å; F868-L949 HydrophobicContact CE1-CB 4.34Å; F868-L949 HydrophobicContact CZ-CD2 4.47Å; L869-L949 HydrophobicContact CD2-CB 3.61Å; L869-L949 HydrophobicContact CD2-CD1 4.25Å; V935-L949 HydrophobicContact CG2-CD1 4.18Å; L944-L949 HydrophobicContact CD1-CD2 4.39Å; Q945-L949 PolarHBondContact O-N 2.72Å; Q945-L949 VanDerWaalsContact O-N 3.09Å; K946-L949 PolarHBondContact O-N 2.92Å; L949-I953 WeakPolarHBondContact O-CG2 3.49Å; L949-I953 PolarHBondContact O-N 3.49Å
950	L	97.3	Very high	95.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.6	-49.3	174.8	179.4	57.6	0	0	0	111.9	L193 W316 L865 L869 K946 T947 T948 E952 I953 S954 I961 F968 F976	L193-L950 HydrophobicContact CD1-CD2 4.42Å; W316-L950 HydrophobicContact CZ3-CD2 4.25Å; W316-L950 HydrophobicContact CZ3-CG 4Å; L865-L950 HydrophobicContact CD1-CD1 4.4Å; L865-L950 HydrophobicContact CD2-CD1 4.31Å; L869-L950 HydrophobicContact CD1-CB 3.73Å; L869-L950 HydrophobicContact CD1-CD1 3.7Å; L869-L950 HydrophobicContact CD1-CG 4.22Å; K946-L950 WeakPolarHBondContact O-CB 3.19Å; K946-L950 PolarHBondContact O-N 3.47Å; T947-L950 WeakPolarHBondContact O-CB 3.46Å; T947-L950 PolarHBondContact O-N 3.12Å; T948-L950 VanDerWaalsContact C-N 3.3Å; T948-L950 PolarHBondContact O-N 3.2Å; L950-E952 PolarHBondContact O-N 3.49Å; L950-I953 WeakPolarHBondContact O-CG2 3.24Å; L950-S954 VanDerWaalsContact O-CB 3.29Å; L950-S954 WeakPolarHBondContact O-CB 3.18Å; L950-S954 PolarHBondContact O-N 2.88Å; L950-S954 PolarHBondContact O-OG 3.04Å; L950-I961 HydrophobicContact CD1-CD1 4.15Å; L950-I961 HydrophobicContact CD2-CD1 3.6Å; L950-I961 HydrophobicContact CG-CD1 4.02Å; L950-F968 HydrophobicContact CD2-CE1 4.24Å; L950-F968 HydrophobicContact CD2-CZ 3.85Å; L950-F976 HydrophobicContact CD1-CE1 4.05Å; L950-F976 HydrophobicContact CD1-CZ 3.73Å; L950-F976 HydrophobicContact CD2-CE1 4.14Å; L950-F976 HydrophobicContact CD2-CZ 3.88Å; L950-F976 HydrophobicContact CG-CZ 4.43Å
951	R	96.4	Very high	95.6	Very high	11 Å²	11	19.8 Å²	19.8	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-54.8	-52.6	175.4	177.8	-170.2	177.8	-98	10.6	110.6	W316 D791 T947 T948 I953 S954 V955 E1077	W316-R951 HydrophobicContact CH2-CB 4.28Å; W316-R951 HydrophobicContact CZ2-CB 4.03Å; W316-R951 HydrophobicContact CZ2-CG 4.15Å; D791-R951 IonicContact OD2-CZ 3.8Å; D791-R951 IonicContact OD2-NH1 2.97Å; D791-R951 PolarHBondContact OD2-NH1 3.23Å; D791-R951 IonicContact OD2-NH2 3.71Å; D791-R951 PolarHBondContact OD2-NH2 2.85Å; T947-R951 PolarHBondContact O-N 2.86Å; T948-R951 PolarHBondContact O-N 3.37Å; R951-I953 PolarHBondContact O-N 3.01Å; R951-S954 PolarHBondContact O-N 3.35Å; R951-V955 HydrophobicContact CG-CG2 4.41Å; R951-V955 WeakPolarHBondContact O-CG2 3.23Å; R951-V955 PolarHBondContact O-N 3.26Å; R951-E1077 PolarHBondContact NH2-O 3.28Å; R951-E1077 VanDerWaalsContact NH2-O 3.08Å
952	E	96.8	Very high	95.7	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.019	10%	0.095	C	C	.	.	H	α-helix	trans	-64.9	-41.9	-174.9	-74.2	-60	134.4	0	0	113	V834 T838 T948 L950 K956	V834-E952 HydrophobicContact CG1-CB 4.41Å; V834-E952 HydrophobicContact CG1-CG 3.81Å; T838-E952 HydrophobicContact CG2-CB 3.61Å; T948-E952 HydrophobicContact CG2-CG 4.45Å; T948-E952 WeakPolarHBondContact O-CB 3.43Å; T948-E952 WeakPolarHBondContact O-CG 3.34Å; T948-E952 PolarHBondContact O-N 2.94Å; L950-E952 PolarHBondContact O-N 3.49Å; E952-K956 WeakPolarHBondContact O-CB 3.28Å; E952-K956 WeakPolarHBondContact O-CG 3.35Å; E952-K956 PolarHBondContact O-N 3.45Å; E952-K956 VanDerWaalsContact O-N 3.13Å; E952-K956 WeakPolarHBondContact OE2-CE 3.49Å; E952-K956 IonicContact OE2-NZ 3.91Å; E952-K956 PolarHBondContact OE2-NZ 3.28Å
953	I	97.5	Very high	95.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.1	-40.8	176.6	-168	61.1	0	0	0	110.9	A841 K842 L865 F868 L949 L950 R951 K956 T957	A841-I953 HydrophobicContact CB-CD1 3.97Å; K842-I953 HydrophobicContact CB-CD1 4.33Å; L865-I953 HydrophobicContact CD2-CG2 3.99Å; F868-I953 HydrophobicContact CD1-CG2 4.26Å; F868-I953 HydrophobicContact CE1-CB 4.02Å; F868-I953 HydrophobicContact CE1-CG1 4.36Å; F868-I953 HydrophobicContact CE1-CG2 4.03Å; L949-I953 WeakPolarHBondContact O-CG2 3.49Å; L949-I953 PolarHBondContact O-N 3.49Å; L950-I953 WeakPolarHBondContact O-CG2 3.24Å; R951-I953 PolarHBondContact O-N 3.01Å; I953-K956 PolarHBondContact O-N 3.39Å; I953-T957 HydrophobicContact CD1-CG2 3.79Å; I953-T957 HydrophobicContact CG1-CG2 4.25Å; I953-T957 WeakPolarHBondContact O-CB 3.48Å; I953-T957 WeakPolarHBondContact O-CG2 3.39Å; I953-T957 PolarHBondContact O-N 2.92Å; I953-T957 PolarHBondContact O-OG1 3.19Å
954	S	97.4	Very high	95.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.5	-48.5	179.6	-67.3	0	0	0	0	112	L950 R951 K956 T957 G958 I959	L950-S954 VanDerWaalsContact O-CB 3.29Å; L950-S954 WeakPolarHBondContact O-CB 3.18Å; L950-S954 PolarHBondContact O-N 2.88Å; L950-S954 PolarHBondContact O-OG 3.04Å; R951-S954 PolarHBondContact O-N 3.35Å; S954-K956 VanDerWaalsContact C-N 3.35Å; S954-K956 PolarHBondContact O-N 3.04Å; S954-T957 PolarHBondContact O-N 3.07Å; S954-G958 CarbonylContact O-C 3.58Å; S954-G958 WeakPolarHBondContact O-CA 3.11Å; S954-G958 PolarHBondContact O-N 3.39Å; S954-I959 WeakPolarHBondContact CB-O 3.16Å; S954-I959 PolarHBondContact O-N 3.2Å; S954-I959 VanDerWaalsContact O-N 3.08Å
955	V	95.3	Very high	96	Very high	73 Å²	73	20.7 Å²	20.7	44%	0.442	11%	0.106	S	C	.	.	H	α-helix	trans	-61.2	-41.8	177.1	171.8	0	0	0	0	111.7	W316 R951 T957	W316-V955 HydrophobicContact CB-CG2 4.34Å; W316-V955 HydrophobicContact CG-CG2 4.34Å; R951-V955 HydrophobicContact CG-CG2 4.41Å; R951-V955 WeakPolarHBondContact O-CG2 3.23Å; R951-V955 PolarHBondContact O-N 3.26Å; V955-T957 VanDerWaalsContact C-N 3.34Å; V955-T957 PolarHBondContact O-N 3Å
956	K	95.6	Very high	96	Very high	28 Å²	28	19.7 Å²	19.7	12%	0.122	10%	0.1	C	C	.	.	H	α-helix	trans	-75.8	-19.2	-177.2	-68.3	-179.5	-146.4	-58.7	0	114.5	E835 T838 R839 K842 E952 I953 S954	E835-K956 IonicContact OE1-NZ 2.64Å; E835-K956 PolarHBondContact OE1-NZ 3.41Å; E835-K956 WeakPolarHBondContact OE2-CE 3.32Å; E835-K956 IonicContact OE2-NZ 2.91Å; E835-K956 PolarHBondContact OE2-NZ 3.19Å; T838-K956 VanDerWaalsContact OG1-CE 3.24Å; T838-K956 WeakPolarHBondContact OG1-CE 3.21Å; R839-K956 HydrophobicContact CG-CD 4.44Å; K842-K956 HydrophobicContact CD-CB 3.97Å; K842-K956 WeakPolarHBondContact CD-O 3.38Å; E952-K956 WeakPolarHBondContact O-CB 3.28Å; E952-K956 WeakPolarHBondContact O-CG 3.35Å; E952-K956 PolarHBondContact O-N 3.45Å; E952-K956 VanDerWaalsContact O-N 3.13Å; E952-K956 WeakPolarHBondContact OE2-CE 3.49Å; E952-K956 IonicContact OE2-NZ 3.91Å; E952-K956 PolarHBondContact OE2-NZ 3.28Å; I953-K956 PolarHBondContact O-N 3.39Å; S954-K956 VanDerWaalsContact C-N 3.35Å; S954-K956 PolarHBondContact O-N 3.04Å
957	T	96.7	Very high	96	Very high	18 Å²	18	23.1 Å²	23.1	11%	0.11	12%	0.119	C	C	.	.	H	α-helix	trans	-112.3	-8.9	-178	58.5	0	0	0	0	113.3	K842 F845 I953 S954 V955 I959	K842-T957 HydrophobicContact CB-CG2 4.37Å; K842-T957 HydrophobicContact CG-CG2 4Å; F845-T957 HydrophobicContact CD1-CG2 3.5Å; F845-T957 HydrophobicContact CE1-CG2 3.89Å; F845-T957 HydrophobicContact CG-CG2 4.27Å; I953-T957 HydrophobicContact CD1-CG2 3.79Å; I953-T957 HydrophobicContact CG1-CG2 4.25Å; I953-T957 WeakPolarHBondContact O-CB 3.48Å; I953-T957 WeakPolarHBondContact O-CG2 3.39Å; I953-T957 PolarHBondContact O-N 2.92Å; I953-T957 PolarHBondContact O-OG1 3.19Å; S954-T957 PolarHBondContact O-N 3.07Å; V955-T957 VanDerWaalsContact C-N 3.34Å; V955-T957 PolarHBondContact O-N 3Å; T957-I959 VanDerWaalsContact C-N 3.34Å; T957-I959 WeakPolarHBondContact OG1-CD1 3.36Å; T957-I959 VanDerWaalsContact OG1-CG1 3.29Å; T957-I959 WeakPolarHBondContact OG1-CG1 3.41Å
958	G	96.4	Very high	95.9	Very high	9 Å²	9	23.2 Å²	23.2	9%	0.093	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	8.1	-176.6	0	0	0	0	0	114.5	S954 Q960 I984 F985	S954-G958 CarbonylContact O-C 3.58Å; S954-G958 WeakPolarHBondContact O-CA 3.11Å; S954-G958 PolarHBondContact O-N 3.39Å; G958-Q960 PolarHBondContact O-N 2.87Å; G958-I984 CarbonylContact O-C 3.54Å; G958-I984 WeakPolarHBondContact O-CA 3.36Å; G958-F985 WeakPolarHBondContact CA-O 3.33Å; G958-F985 PolarHBondContact O-N 2.93Å
959	I	97.9	Very high	95.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	129.7	-179.7	-60.5	160.4	0	0	0	109.6	F845 V861 L865 S954 T957 I961	F845-I959 HydrophobicContact CE1-CD1 4.11Å; F845-I959 HydrophobicContact CE1-CG1 4.39Å; F845-I959 HydrophobicContact CE2-CD1 4.2Å; F845-I959 HydrophobicContact CZ-CD1 3.63Å; F845-I959 HydrophobicContact CZ-CG1 4.07Å; V861-I959 HydrophobicContact CG1-CD1 3.76Å; V861-I959 HydrophobicContact CG1-CG1 3.99Å; V861-I959 HydrophobicContact CG1-CG2 3.96Å; L865-I959 HydrophobicContact CD2-CD1 4.39Å; S954-I959 WeakPolarHBondContact CB-O 3.16Å; S954-I959 PolarHBondContact O-N 3.2Å; S954-I959 VanDerWaalsContact O-N 3.08Å; T957-I959 VanDerWaalsContact C-N 3.34Å; T957-I959 WeakPolarHBondContact OG1-CD1 3.36Å; T957-I959 VanDerWaalsContact OG1-CG1 3.29Å; T957-I959 WeakPolarHBondContact OG1-CG1 3.41Å; I959-I961 HydrophobicContact CG2-CG2 3.79Å
960	Q	97.6	Very high	95.4	Very high	3 Å²	3	28.7 Å²	28.7	1%	0.014	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.2	166.2	-176	177.7	66.7	0	0	109.8	Y141 S315 W316 A318 G958 L982 N983 F985	Y141-Q960 PolarHBondContact O-NE2 3.37Å; S315-Q960 PolarHBondContact O-NE2 3.16Å; W316-Q960 WeakPolarHBondContact O-CA 3.36Å; A318-Q960 HydrophobicContact CB-CG 4.24Å; G958-Q960 PolarHBondContact O-N 2.87Å; Q960-L982 HydrophobicContact CG-CB 4.28Å; Q960-L982 PolarHBondContact O-N 2.83Å; Q960-N983 HydrophobicContact CB-CB 3.93Å; Q960-N983 PolarHBondContact N-O 2.98Å; Q960-N983 PolarHBondContact O-N 2.97Å; Q960-F985 HydrophobicContact CB-CD2 4.26Å; Q960-F985 HydrophobicContact CB-CE2 3.82Å; Q960-F985 HydrophobicContact CG-CE2 4.23Å
961	I	97.4	Very high	94.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	159.1	178.2	69.6	173.6	0	0	0	112	W316 T317 A318 L865 L950 I959 Y966 D980 I981	W316-I961 HydrophobicContact CE3-CD1 4.02Å; W316-I961 HydrophobicContact CE3-CG1 4.09Å; W316-I961 HydrophobicContact CZ3-CD1 3.59Å; W316-I961 HydrophobicContact CZ3-CG1 4.12Å; W316-I961 PolarHBondContact O-N 3.44Å; T317-I961 VanDerWaalsContact CA-O 3.31Å; T317-I961 WeakPolarHBondContact CA-O 3.29Å; T317-I961 HydrophobicContact CG2-CD1 4.43Å; T317-I961 HydrophobicContact CG2-CG1 3.97Å; A318-I961 PolarHBondContact N-O 2.98Å; L865-I961 HydrophobicContact CD1-CG2 4.34Å; L950-I961 HydrophobicContact CD1-CD1 4.15Å; L950-I961 HydrophobicContact CD2-CD1 3.6Å; L950-I961 HydrophobicContact CG-CD1 4.02Å; I959-I961 HydrophobicContact CG2-CG2 3.79Å; I961-Y966 HydrophobicContact CD1-CE2 3.75Å; I961-D980 CarbonylContact C-O 3.4Å; I961-D980 VanDerWaalsContact CA-O 3.24Å; I961-D980 WeakPolarHBondContact CA-O 3.36Å; I961-I981 HydrophobicContact CG2-CD1 4.3Å
962	L	96.6	Very high	94.5	Very high	20 Å²	20	44.4 Å²	44.4	11%	0.105	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.8	171.5	178.8	61.3	0	0	0	111.3	A318 Q320 K964 Y966 D980 L982	A318-L962 CarbonylContact O-C 3.58Å; Q320-L962 HydrophobicContact CB-CD1 3.81Å; L962-K964 HydrophobicContact CD2-CD 4.18Å; L962-K964 PolarHBondContact O-N 2.9Å; L962-Y966 WeakPolarHBondContact O-CE2 3.36Å; L962-Y966 PolarHBondContact O-OH 3.07Å; L962-D980 PolarHBondContact N-O 3.14Å; L962-L982 HydrophobicContact CB-CD1 4.26Å; L962-L982 HydrophobicContact CB-CD2 4.37Å; L962-L982 HydrophobicContact CB-CG 4.28Å; L962-L982 HydrophobicContact CD1-CD1 4.3Å
963	L	95	Very high	94	Very high	24 Å²	24	50.4 Å²	50.4	13%	0.126	24%	0.241	C	C	.	.	S	Bend	trans	-72.5	99.6	173.3	-171.9	81	0	0	0	110	L193 L196 Q197 T317 A318	L193-L963 HydrophobicContact CB-CD1 4.31Å; L193-L963 WeakPolarHBondContact O-CD1 3.49Å; L196-L963 HydrophobicContact CB-CD1 4.2Å; Q197-L963 HydrophobicContact CB-CD2 3.96Å; Q197-L963 VanDerWaalsContact CD-CD2 3.49Å; Q197-L963 HydrophobicContact CG-CD2 3.87Å; T317-L963 HydrophobicContact CG2-CD1 4.22Å; A318-L963 WeakPolarHBondContact O-CB 3.25Å; A318-L963 PolarHBondContact O-N 2.98Å
964	K	94.3	Very high	93.7	Very high	68 Å²	68	52.1 Å²	52.1	30%	0.296	25%	0.253	S	S	.	.	S	Bend	trans	-153.4	175.2	170.4	70.1	176.9	-170.4	-171.5	0	110.5	L962 Y966 D980	L962-K964 HydrophobicContact CD2-CD 4.18Å; L962-K964 PolarHBondContact O-N 2.9Å; K964-Y966 HydrophobicContact CD-CE1 4.45Å; K964-Y966 HydrophobicContact CG-CD2 4.33Å; K964-Y966 HydrophobicContact CG-CE1 4.2Å; K964-Y966 HydrophobicContact CG-CE2 3.88Å; K964-Y966 VanDerWaalsContact O-CD2 3.27Å; K964-Y966 WeakPolarHBondContact O-CD2 3.38Å; K964-Y966 WeakPolarHBondContact O-CE2 3.21Å; K964-D980 WeakPolarHBondContact CE-OD1 3.21Å; K964-D980 WeakPolarHBondContact CE-OD2 3.4Å; K964-D980 IonicContact NZ-OD1 2.6Å; K964-D980 PolarHBondContact NZ-OD1 3.26Å; K964-D980 IonicContact NZ-OD2 3.1Å; K964-D980 PolarHBondContact NZ-OD2 3.44Å
965	E	94.3	Very high	93.5	Very high	97 Å²	97	52.6 Å²	52.6	45%	0.453	26%	0.256	S	S	.	.			trans	-81.3	122.5	172.7	-57.8	-53.8	156.8	0	0	111.5	P192 L193 V194	P192-E965 WeakPolarHBondContact CA-OE1 2.93Å; P192-E965 WeakPolarHBondContact CA-OE2 3.37Å; P192-E965 WeakPolarHBondContact CB-OE1 3.24Å; L193-E965 PolarHBondContact N-OE1 3.49Å; L193-E965 PolarHBondContact N-OE2 3.43Å; V194-E965 WeakPolarHBondContact CB-OE1 3.38Å; V194-E965 HydrophobicContact CG2-CG 4.12Å; V194-E965 VanDerWaalsContact CG2-OE1 3.23Å; V194-E965 WeakPolarHBondContact CG2-OE1 3.16Å; V194-E965 PolarHBondContact N-OE1 3.39Å
966	Y	93.8	Very high	93.5	Very high	21 Å²	21	49.2 Å²	49.2	8%	0.082	24%	0.236	C	C	.	.			trans	-101.3	129.5	178.6	-67.7	-85.8	0	0	0	110.4	L193 I961 L962 K964 F968 A975 F976 D980	L193-Y966 HydrophobicContact CD1-CD2 3.72Å; L193-Y966 HydrophobicContact CD1-CE2 4.03Å; I961-Y966 HydrophobicContact CD1-CE2 3.75Å; L962-Y966 WeakPolarHBondContact O-CE2 3.36Å; L962-Y966 PolarHBondContact O-OH 3.07Å; K964-Y966 HydrophobicContact CD-CE1 4.45Å; K964-Y966 HydrophobicContact CG-CD2 4.33Å; K964-Y966 HydrophobicContact CG-CE1 4.2Å; K964-Y966 HydrophobicContact CG-CE2 3.88Å; K964-Y966 VanDerWaalsContact O-CD2 3.27Å; K964-Y966 WeakPolarHBondContact O-CD2 3.38Å; K964-Y966 WeakPolarHBondContact O-CE2 3.21Å; Y966-F968 HydrophobicContact CG-CZ 4.49Å; Y966-A975 WeakPolarHBondContact CD1-O 3.37Å; Y966-F976 AromaticContact CD1-CD1 3.76Å; Y966-F976 HydrophobicContact CD1-CD1 3.76Å; Y966-F976 AromaticContact CD1-CE1 3.66Å; Y966-F976 HydrophobicContact CD1-CE1 3.66Å; Y966-F976 HydrophobicContact CD1-CG 4.44Å; Y966-F976 HydrophobicContact CD1-CZ 4.28Å; Y966-F976 AromaticContact CE1-CD1 3.35Å; Y966-F976 HydrophobicContact CE1-CD1 3.35Å; Y966-F976 AromaticContact CE1-CE1 3.5Å; Y966-F976 HydrophobicContact CE1-CE1 3.5Å; Y966-F976 VanDerWaalsContact CE1-CE1 3.5Å; Y966-F976 HydrophobicContact CE1-CG 4.29Å; Y966-F976 HydrophobicContact CE2-CE1 4.42Å; Y966-F976 HydrophobicContact CG-CE1 4.2Å; Y966-F976 AromaticContact CZ-CE1 3.9Å; Y966-D980 HydrophobicContact CE1-CB 4.21Å
967	N	92.9	Very high	93.4	Very high	87 Å²	87	50.8 Å²	50.8	47%	0.465	25%	0.248	S	C	.	.			trans	-99.4	95.9	173.6	-175.9	-12.9	0	0	0	109.9	D969 S970	N967-D969 VanDerWaalsContact C-N 3.32Å; N967-D969 PolarHBondContact OD1-N 3.01Å; N967-D969 VanDerWaalsContact OD1-N 3.12Å; N967-S970 PolarHBondContact OD1-N 3.31Å
968	F	93.3	Very high	93.1	Very high	17 Å²	17	54.3 Å²	54.3	8%	0.075	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-21.3	-179.7	-55	-70.4	0	0	0	114.1	L869 S871 K946 T947 L950 Y966 A975 F976	L869-F968 HydrophobicContact CB-CD1 4.06Å; L869-F968 HydrophobicContact CB-CE1 4.31Å; L869-F968 HydrophobicContact CD1-CE1 4.39Å; S871-F968 WeakPolarHBondContact CB-O 3.29Å; S871-F968 PolarHBondContact N-O 2.9Å; S871-F968 PolarHBondContact OG-O 3.33Å; K946-F968 HydrophobicContact CB-CB 4.47Å; K946-F968 HydrophobicContact CB-CD2 3.86Å; K946-F968 HydrophobicContact CB-CE2 4.25Å; K946-F968 HydrophobicContact CB-CG 4.04Å; K946-F968 HydrophobicContact CD-CB 3.41Å; K946-F968 VanDerWaalsContact CD-CB 3.41Å; K946-F968 HydrophobicContact CD-CD2 4.3Å; K946-F968 HydrophobicContact CD-CG 3.92Å; T947-F968 HydrophobicContact CG2-CE2 3.92Å; L950-F968 HydrophobicContact CD2-CE1 4.24Å; L950-F968 HydrophobicContact CD2-CZ 3.85Å; Y966-F968 HydrophobicContact CG-CZ 4.49Å; F968-A975 HydrophobicContact CD1-CB 4.18Å; F968-F976 HydrophobicContact CD1-CE2 4.36Å; F968-F976 AromaticContact CE1-CE2 3.9Å; F968-F976 HydrophobicContact CE1-CE2 3.9Å; F968-F976 AromaticContact CE1-CZ 3.71Å; F968-F976 HydrophobicContact CE1-CZ 3.71Å
969	D	91.6	Very high	92.9	Very high	106 Å²	106	61.2 Å²	61.2	57%	0.567	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-0.4	-172.6	-56.8	-38.8	0	0	0	112.2	K946 N967 R971	K946-D969 IonicContact NZ-OD1 3.7Å; K946-D969 PolarHBondContact NZ-OD1 3.4Å; N967-D969 VanDerWaalsContact C-N 3.32Å; N967-D969 PolarHBondContact OD1-N 3.01Å; N967-D969 VanDerWaalsContact OD1-N 3.12Å; D969-R971 PolarHBondContact O-N 3.44Å
970	S	89.6	Confident	92.8	Very high	17 Å²	17	61.3 Å²	61.3	12%	0.119	29%	0.293	C	S	.	.			trans	-66.5	125.2	177.7	-162.9	0	0	0	0	111.4	N967 K973	N967-S970 PolarHBondContact OD1-N 3.31Å; S970-K973 WeakPolarHBondContact OG-CG 3.37Å
971	R	87.2	Confident	92.8	Very high	167 Å²	167	62.1 Å²	62.1	63%	0.63	30%	0.297	S	S	*	.	S	Bend	trans	-93.6	-1	173.8	-63.8	-176.7	-179	-108.9	-1.9	113.7	F872 D969	F872-R971 WeakPolarHBondContact CD2-O 3.29Å; D969-R971 PolarHBondContact O-N 3.44Å
972	H	86.7	Confident	92.7	Very high	173 Å²	173	65.6 Å²	65.6	80%	0.801	32%	0.316	S	S	*	.	S	Bend	trans	-110.8	-20	-173.5	-59.3	-56.2	0	0	0	113.7
973	K	87.8	Confident	92.5	Very high	131 Å²	131	67.1 Å²	67.1	57%	0.57	32%	0.324	S	S	*	.	S	Bend	trans	-144.5	150	179.5	60.8	176.3	-175.8	175.3	0	110.4	S970	S970-K973 WeakPolarHBondContact OG-CG 3.37Å
974	P	89.5	Confident	92.6	Very high	36 Å²	36	66.3 Å²	66.3	23%	0.234	32%	0.32	C	S	.	.			trans	-62.1	150.9	170.9	26.6	-33.8	0	0	0	110.9	N866 F872	N866-P974 WeakPolarHBondContact OD1-CB 3.22Å; F872-P974 HydrophobicContact CD1-CB 4.47Å
975	A	93.4	Very high	92.7	Very high	10 Å²	10	63.5 Å²	63.5	8%	0.083	31%	0.307	C	S	.	.	S	Bend	trans	-74	-38.4	176.9	0	0	0	0	0	110.9	N866 Y966 F968	N866-A975 PolarHBondContact OD1-N 2.97Å; Y966-A975 WeakPolarHBondContact CD1-O 3.37Å; F968-A975 HydrophobicContact CD1-CB 4.18Å
976	F	95.3	Very high	92.8	Very high	2 Å²	2	59 Å²	59	1%	0.009	29%	0.287	C	S	.	.			trans	-111.5	142	-178.2	-57.4	-87.7	0	0	0	111.8	L865 N866 L869 L950 Y966 F968 D980	L865-F976 HydrophobicContact CB-CD2 3.68Å; L865-F976 HydrophobicContact CB-CE2 3.79Å; L865-F976 HydrophobicContact CB-CG 4.07Å; L865-F976 HydrophobicContact CB-CZ 4.26Å; L865-F976 HydrophobicContact CD1-CD1 4.15Å; L865-F976 HydrophobicContact CD1-CE1 4.12Å; L865-F976 HydrophobicContact CD1-CG 4.44Å; L865-F976 HydrophobicContact CD1-CZ 4.36Å; N866-F976 PolarHBondContact ND2-O 3.3Å; N866-F976 PolarHBondContact OD1-N 3.49Å; L869-F976 HydrophobicContact CB-CE2 4.36Å; L869-F976 HydrophobicContact CD1-CE2 4.12Å; L869-F976 HydrophobicContact CD1-CZ 4.09Å; L950-F976 HydrophobicContact CD1-CE1 4.05Å; L950-F976 HydrophobicContact CD1-CZ 3.73Å; L950-F976 HydrophobicContact CD2-CE1 4.14Å; L950-F976 HydrophobicContact CD2-CZ 3.88Å; L950-F976 HydrophobicContact CG-CZ 4.43Å; Y966-F976 AromaticContact CD1-CD1 3.76Å; Y966-F976 HydrophobicContact CD1-CD1 3.76Å; Y966-F976 AromaticContact CD1-CE1 3.66Å; Y966-F976 HydrophobicContact CD1-CE1 3.66Å; Y966-F976 HydrophobicContact CD1-CG 4.44Å; Y966-F976 HydrophobicContact CD1-CZ 4.28Å; Y966-F976 AromaticContact CE1-CD1 3.35Å; Y966-F976 HydrophobicContact CE1-CD1 3.35Å; Y966-F976 AromaticContact CE1-CE1 3.5Å; Y966-F976 HydrophobicContact CE1-CE1 3.5Å; Y966-F976 VanDerWaalsContact CE1-CE1 3.5Å; Y966-F976 HydrophobicContact CE1-CG 4.29Å; Y966-F976 HydrophobicContact CE2-CE1 4.42Å; Y966-F976 HydrophobicContact CG-CE1 4.2Å; Y966-F976 AromaticContact CZ-CE1 3.9Å; F968-F976 HydrophobicContact CD1-CE2 4.36Å; F968-F976 AromaticContact CE1-CE2 3.9Å; F968-F976 HydrophobicContact CE1-CE2 3.9Å; F968-F976 AromaticContact CE1-CZ 3.71Å; F968-F976 HydrophobicContact CE1-CZ 3.71Å; F976-D980 WeakPolarHBondContact CA-OD2 3.21Å
977	T	93.4	Very high	92.9	Very high	60 Å²	60	60.1 Å²	60.1	37%	0.368	30%	0.295	S	S	.	.			trans	-112.1	171.8	165.7	63	0	0	0	0	110.5	S862 E979 D980	S862-T977 VanDerWaalsContact CB-O 3.26Å; S862-T977 WeakPolarHBondContact CB-O 3.37Å; T977-E979 PolarHBondContact O-N 2.89Å; T977-D980 PolarHBondContact N-OD2 2.9Å; T977-D980 WeakPolarHBondContact O-CB 3.33Å; T977-D980 PolarHBondContact O-N 3.31Å; T977-D980 VanDerWaalsContact O-N 3.16Å; T977-D980 PolarHBondContact OG1-OD2 3.07Å
978	E	91.8	Very high	93.1	Very high	92 Å²	92	58 Å²	58	43%	0.43	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-63.7	-29.9	176	63	-176.1	178	0	0	113.1	D980 I981	E978-D980 PolarHBondContact O-N 2.88Å; E978-I981 PolarHBondContact O-N 2.82Å
979	E	92.6	Very high	93.2	Very high	154 Å²	154	60 Å²	60	72%	0.72	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-68	-18.7	176.1	-60.8	-178.6	163.9	0	0	112.7	T977 I981	T977-E979 PolarHBondContact O-N 2.89Å; E979-I981 VanDerWaalsContact C-N 3.28Å
980	D	95.7	Very high	93.3	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-79	-13.4	179	-65.7	-31.1	0	0	0	113	I961 L962 K964 Y966 F976 T977 E978	I961-D980 CarbonylContact C-O 3.4Å; I961-D980 VanDerWaalsContact CA-O 3.24Å; I961-D980 WeakPolarHBondContact CA-O 3.36Å; L962-D980 PolarHBondContact N-O 3.14Å; K964-D980 WeakPolarHBondContact CE-OD1 3.21Å; K964-D980 WeakPolarHBondContact CE-OD2 3.4Å; K964-D980 IonicContact NZ-OD1 2.6Å; K964-D980 PolarHBondContact NZ-OD1 3.26Å; K964-D980 IonicContact NZ-OD2 3.1Å; K964-D980 PolarHBondContact NZ-OD2 3.44Å; Y966-D980 HydrophobicContact CE1-CB 4.21Å; F976-D980 WeakPolarHBondContact CA-OD2 3.21Å; T977-D980 PolarHBondContact N-OD2 2.9Å; T977-D980 WeakPolarHBondContact O-CB 3.33Å; T977-D980 PolarHBondContact O-N 3.31Å; T977-D980 VanDerWaalsContact O-N 3.16Å; T977-D980 PolarHBondContact OG1-OD2 3.07Å; E978-D980 PolarHBondContact O-N 2.88Å
981	I	96.3	Very high	93.4	Very high	19 Å²	19	56.9 Å²	56.9	10%	0.097	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	105.6	-179.9	-50.3	-52.5	0	0	0	108.4	V861 L865 I961 E978 E979	V861-I981 HydrophobicContact CB-CD1 4.36Å; V861-I981 HydrophobicContact CB-CG1 4.12Å; V861-I981 HydrophobicContact CB-CG2 4.07Å; V861-I981 HydrophobicContact CG1-CD1 3.72Å; V861-I981 HydrophobicContact CG1-CG1 4.01Å; V861-I981 HydrophobicContact CG1-CG2 3.96Å; L865-I981 HydrophobicContact CD1-CD1 3.89Å; I961-I981 HydrophobicContact CG2-CD1 4.3Å; E978-I981 PolarHBondContact O-N 2.82Å; E979-I981 VanDerWaalsContact C-N 3.28Å
982	L	94.9	Very high	93.4	Very high	74 Å²	74	52 Å²	52	39%	0.387	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-41.4	-174	-59.6	-177.5	0	0	0	112.2	A318 Q960 L962	A318-L982 HydrophobicContact CB-CD1 3.76Å; Q960-L982 HydrophobicContact CG-CB 4.28Å; Q960-L982 PolarHBondContact O-N 2.83Å; L962-L982 HydrophobicContact CB-CD1 4.26Å; L962-L982 HydrophobicContact CB-CD2 4.37Å; L962-L982 HydrophobicContact CB-CG 4.28Å; L962-L982 HydrophobicContact CD1-CD1 4.3Å
983	N	94.3	Very high	93.6	Very high	51 Å²	51	44.6 Å²	44.6	27%	0.273	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	167.2	-177.7	-147.2	-24	0	0	0	112.2	Q960 F985	Q960-N983 HydrophobicContact CB-CB 3.93Å; Q960-N983 PolarHBondContact N-O 2.98Å; Q960-N983 PolarHBondContact O-N 2.97Å; N983-F985 HydrophobicContact CB-CE1 4.31Å; N983-F985 HydrophobicContact CB-CE2 4.31Å; N983-F985 HydrophobicContact CB-CZ 4.06Å; N983-F985 VanDerWaalsContact ND2-CE1 3.28Å; N983-F985 WeakPolarHBondContact ND2-CE1 3.45Å
984	I	95.8	Very high	93.6	Very high	7 Å²	7	45.5 Å²	45.5	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.2	162.2	-56.5	179.7	0	0	0	105.8	Y471 R472 L849 L857 V861 G958	Y471-I984 WeakPolarHBondContact CE2-O 3.46Å; R472-I984 HydrophobicContact CG-CG2 4.42Å; L849-I984 HydrophobicContact CD1-CD1 4.11Å; L857-I984 HydrophobicContact CD1-CD1 4.01Å; L857-I984 HydrophobicContact CD2-CD1 3.91Å; L857-I984 HydrophobicContact CG-CD1 3.95Å; V861-I984 HydrophobicContact CG2-CD1 3.79Å; G958-I984 CarbonylContact O-C 3.54Å; G958-I984 WeakPolarHBondContact O-CA 3.36Å
985	F	96.3	Very high	93.7	Very high	9 Å²	9	43.9 Å²	43.9	4%	0.039	22%	0.223	C	C	.	.			trans	-91.9	154.7	177.4	-65.6	-59.4	0	0	0	112.2	Y141 N142 Y314 G958 Q960 N983	Y141-F985 WeakPolarHBondContact O-CZ 3.1Å; N142-F985 VanDerWaalsContact O-CE1 3.31Å; N142-F985 WeakPolarHBondContact O-CE1 3.34Å; Y314-F985 HydrophobicContact CD1-CB 3.76Å; Y314-F985 AromaticContact CD1-CD1 3.37Å; Y314-F985 HydrophobicContact CD1-CD1 3.37Å; Y314-F985 AromaticContact CD1-CD2 3.7Å; Y314-F985 HydrophobicContact CD1-CD2 3.7Å; Y314-F985 AromaticContact CD1-CE1 3.79Å; Y314-F985 HydrophobicContact CD1-CE1 3.79Å; Y314-F985 HydrophobicContact CD1-CE2 4.06Å; Y314-F985 AromaticContact CD1-CG 3.32Å; Y314-F985 HydrophobicContact CD1-CG 3.32Å; Y314-F985 HydrophobicContact CD1-CZ 4.12Å; Y314-F985 HydrophobicContact CD2-CB 3.85Å; Y314-F985 HydrophobicContact CD2-CG 4.32Å; Y314-F985 HydrophobicContact CE1-CB 4.04Å; Y314-F985 AromaticContact CE1-CD1 3.43Å; Y314-F985 HydrophobicContact CE1-CD1 3.43Å; Y314-F985 VanDerWaalsContact CE1-CD1 3.43Å; Y314-F985 AromaticContact CE1-CE1 3.98Å; Y314-F985 HydrophobicContact CE1-CE1 3.98Å; Y314-F985 AromaticContact CE1-CG 3.78Å; Y314-F985 HydrophobicContact CE1-CG 3.78Å; Y314-F985 HydrophobicContact CE2-CB 4.13Å; Y314-F985 HydrophobicContact CG-CB 3.66Å; Y314-F985 HydrophobicContact CG-CD1 4.16Å; Y314-F985 AromaticContact CG-CD2 3.85Å; Y314-F985 HydrophobicContact CG-CD2 3.85Å; Y314-F985 AromaticContact CG-CG 3.63Å; Y314-F985 HydrophobicContact CG-CG 3.63Å; G958-F985 WeakPolarHBondContact CA-O 3.33Å; G958-F985 PolarHBondContact O-N 2.93Å; Q960-F985 HydrophobicContact CB-CD2 4.26Å; Q960-F985 HydrophobicContact CB-CE2 3.82Å; Q960-F985 HydrophobicContact CG-CE2 4.23Å; N983-F985 HydrophobicContact CB-CE1 4.31Å; N983-F985 HydrophobicContact CB-CE2 4.31Å; N983-F985 HydrophobicContact CB-CZ 4.06Å; N983-F985 VanDerWaalsContact ND2-CE1 3.28Å; N983-F985 WeakPolarHBondContact ND2-CE1 3.45Å
986	P	96.5	Very high	93.5	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.019	24%	0.243	C	C	.	.			trans	-70.8	141.3	173.1	29.7	-35	0	0	0	111.7	Y314 T388 M392 V469 D470 Y471 V988	Y314-P986 HydrophobicContact CE2-CG 4.09Å; Y314-P986 WeakPolarHBondContact CE2-O 3.48Å; Y314-P986 WeakPolarHBondContact OH-CG 3.28Å; T388-P986 HydrophobicContact CG2-CB 4.08Å; T388-P986 HydrophobicContact CG2-CG 3.46Å; T388-P986 VanDerWaalsContact CG2-CG 3.46Å; M392-P986 HydrophobicContact CG-CB 4.45Å; M392-P986 HydrophobicContact CG-CG 4.24Å; M392-P986 HydrophobicContact SD-CG 3.73Å; V469-P986 HydrophobicContact CG1-CB 3.58Å; D470-P986 WeakPolarHBondContact O-CA 3.5Å; Y471-P986 HydrophobicContact CD2-CB 4.08Å; P986-V988 HydrophobicContact CB-CG2 4.17Å; P986-V988 HydrophobicContact CG-CG2 4.35Å
987	V	96.4	Very high	93.3	Very high	44 Å²	44	48 Å²	48	27%	0.267	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	110.6	167.4	179.3	0	0	0	0	108.3	D470	D470-V987 HydrophobicContact CB-CB 4.29Å; D470-V987 PolarHBondContact N-O 3.49Å; D470-V987 PolarHBondContact O-N 2.95Å
988	V	96.3	Very high	93.2	Very high	42 Å²	42	45.1 Å²	45.1	26%	0.255	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	135.9	-168.5	-171.9	0	0	0	0	111	T388 V467 V469 P986	T388-V988 HydrophobicContact CG2-CG2 3.7Å; T388-V988 WeakPolarHBondContact OG1-CG2 3.41Å; V467-V988 HydrophobicContact CG1-CG1 3.66Å; V469-V988 HydrophobicContact CG1-CG2 4.49Å; V469-V988 HydrophobicContact CG2-CG1 4.4Å; P986-V988 HydrophobicContact CB-CG2 4.17Å; P986-V988 HydrophobicContact CG-CG2 4.35Å
989	K	95.8	Very high	93.3	Very high	59 Å²	59	44.6 Å²	44.6	26%	0.257	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.6	171.3	-59.8	170	-178.3	166.4	0	108.9	T444 L447 V467 V468 D470	T444-K989 PolarHBondContact OG1-NZ 2.98Å; L447-K989 HydrophobicContact CD2-CB 3.74Å; L447-K989 WeakPolarHBondContact CD2-O 3.21Å; V467-K989 WeakPolarHBondContact CA-O 3.39Å; V468-K989 HydrophobicContact CB-CB 4.32Å; V468-K989 PolarHBondContact N-O 2.65Å; V468-K989 PolarHBondContact O-N 3.43Å; D470-K989 IonicContact OD2-NZ 2.76Å
990	H	94.6	Very high	93.3	Very high	38 Å²	38	43 Å²	43	18%	0.176	22%	0.22	C	C	.	.			trans	-141	170.7	-176	57.2	85.6	0	0	0	111.3	F311 A384 R451 V467	F311-H990 AromaticContact CD1-CE1 3.51Å; F311-H990 AromaticContact CD1-NE2 3.62Å; F311-H990 AromaticContact CE1-CE1 3.22Å; F311-H990 WeakPolarHBondContact CE1-CE1 3.48Å; F311-H990 AromaticContact CE1-ND1 3.58Å; F311-H990 AromaticContact CE1-NE2 3.8Å; F311-H990 AromaticContact CE2-CE1 3.77Å; F311-H990 AromaticContact CG-CE1 3.91Å; F311-H990 AromaticContact CG-NE2 3.95Å; F311-H990 AromaticContact CZ-CE1 3.37Å; F311-H990 WeakPolarHBondContact CZ-CE1 3.4Å; F311-H990 AromaticContact CZ-ND1 3.83Å; A384-H990 HydrophobicContact CB-CB 4.15Å; R451-H990 PolarHBondContact NE-O 2.86Å; R451-H990 VanDerWaalsContact NE-O 3.15Å; R451-H990 PolarHBondContact NH2-O 3.4Å; V467-H990 HydrophobicContact CG1-CB 4.47Å; V467-H990 HydrophobicContact CG2-CB 4.02Å
991	V	91.1	Very high	93.2	Very high	21 Å²	21	45.8 Å²	45.8	13%	0.127	23%	0.232	C	C	.	.			trans	-69.2	136.4	167	-177.9	0	0	0	0	108.4	L447 V450 R451	L447-V991 HydrophobicContact CD1-CG2 3.93Å; V450-V991 HydrophobicContact CG1-CG2 4.05Å; R451-V991 HydrophobicContact CG-CB 4.38Å; R451-V991 HydrophobicContact CG-CG1 4.32Å; R451-V991 HydrophobicContact CG-CG2 3.94Å
992	N	87.8	Confident	93.1	Very high	64 Å²	64	45.8 Å²	45.8	34%	0.342	23%	0.232	S	C	.	.			trans	-111.2	98.2	170	-168.5	23.6	0	0	0	108.2	K994	N992-K994 PolarHBondContact O-N 3.16Å
993	P	90.6	Very high	93.1	Very high	17 Å²	17	46.8 Å²	46.8	11%	0.11	24%	0.235	C	C	.	.			trans	-58.2	136	178.4	-24.8	36.3	0	0	0	111.1	I376 H380 Y1032	I376-P993 HydrophobicContact CG2-CB 3.78Å; I376-P993 HydrophobicContact CG2-CG 3.89Å; H380-P993 HydrophobicContact CB-CG 3.73Å; P993-Y1032 PolarHBondContact O-OH 2.95Å
994	K	87.9	Confident	93.1	Very high	151 Å²	151	46.3 Å²	46.3	66%	0.657	24%	0.235	S	C	*	.			trans	-100	132.1	-179.5	-65.6	-175.1	178.5	-177.8	0	110.4	N992 S996	N992-K994 PolarHBondContact O-N 3.16Å; K994-S996 PolarHBondContact O-N 3.05Å; K994-S996 VanDerWaalsContact O-N 3.15Å
995	A	91.8	Very high	93	Very high	1 Å²	1	46 Å²	46	1%	0.008	23%	0.233	C	C	.	.			trans	-74.9	91.5	165.5	0	0	0	0	0	109.3	E373 A998 F999 F1028 V1031 Y1032	E373-A995 VanDerWaalsContact OE2-CA 3.29Å; E373-A995 WeakPolarHBondContact OE2-CA 3.39Å; A995-A998 HydrophobicContact CB-CB 3.92Å; A995-F999 VanDerWaalsContact O-CB 3.3Å; A995-F999 WeakPolarHBondContact O-CB 3.34Å; A995-F999 PolarHBondContact O-N 2.7Å; A995-F1028 HydrophobicContact CB-CD1 3.93Å; A995-F1028 HydrophobicContact CB-CE1 3.98Å; A995-V1031 HydrophobicContact CB-CB 4.02Å; A995-V1031 HydrophobicContact CB-CG1 3.8Å; A995-V1031 HydrophobicContact CB-CG2 4.12Å; A995-Y1032 HydrophobicContact CB-CE1 4.25Å; A995-Y1032 HydrophobicContact CB-CE2 4.05Å; A995-Y1032 PolarHBondContact N-OH 3.4Å
996	S	89.5	Confident	92.8	Very high	73 Å²	73	48.9 Å²	48.9	51%	0.51	25%	0.247	S	C	.	.	H	α-helix	trans	-71.3	-42.1	-164.4	-60.8	0	0	0	0	111.7	E373 K994 F999 H1000	E373-S996 WeakPolarHBondContact OE1-CB 3.48Å; E373-S996 PolarHBondContact OE1-N 3.26Å; E373-S996 PolarHBondContact OE2-N 3.19Å; K994-S996 PolarHBondContact O-N 3.05Å; K994-S996 VanDerWaalsContact O-N 3.15Å; S996-F999 PolarHBondContact O-N 3.26Å; S996-H1000 PolarHBondContact O-N 2.75Å
997	D	89.6	Confident	92.6	Very high	25 Å²	25	50.6 Å²	50.6	13%	0.134	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-49.5	177.5	-72.8	-45.7	0	0	0	110.6	L366 R369 F999 H1000 F1001	L366-D997 HydrophobicContact CD1-CB 4.05Å; R369-D997 IonicContact CZ-OD1 3.63Å; R369-D997 IonicContact CZ-OD2 2.94Å; R369-D997 IonicContact NE-OD2 2.8Å; R369-D997 PolarHBondContact NE-OD2 3.43Å; R369-D997 VanDerWaalsContact NH1-CG 3.34Å; R369-D997 IonicContact NH1-OD1 2.86Å; R369-D997 PolarHBondContact NH1-OD1 3.28Å; R369-D997 IonicContact NH1-OD2 3.29Å; R369-D997 PolarHBondContact NH1-OD2 2.92Å; R369-D997 VanDerWaalsContact NH1-OD2 3.1Å; R369-D997 IonicContact NH2-OD1 2.69Å; R369-D997 PolarHBondContact NH2-OD1 3.14Å; R369-D997 IonicContact NH2-OD2 2.78Å; R369-D997 PolarHBondContact NH2-OD2 3.16Å; D997-F999 VanDerWaalsContact C-N 3.28Å; D997-F999 PolarHBondContact O-N 3.06Å; D997-H1000 WeakPolarHBondContact O-CB 3.49Å; D997-H1000 PolarHBondContact O-N 2.89Å; D997-F1001 WeakPolarHBondContact O-CD2 3.48Å; D997-F1001 PolarHBondContact O-N 3.12Å
998	A	92.1	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57	-41.4	177.3	0	0	0	0	0	112.2	A995 H1000 F1001 F1002 L1027 F1028	A995-A998 HydrophobicContact CB-CB 3.92Å; A998-H1000 VanDerWaalsContact C-N 3.35Å; A998-H1000 PolarHBondContact O-N 3.38Å; A998-F1001 PolarHBondContact O-N 3.37Å; A998-F1002 WeakPolarHBondContact O-CB 3.09Å; A998-F1002 PolarHBondContact O-N 2.83Å; A998-L1027 HydrophobicContact CB-CB 3.59Å; A998-L1027 HydrophobicContact CB-CD1 4.47Å; A998-F1028 HydrophobicContact CB-CD1 3.45Å; A998-F1028 VanDerWaalsContact CB-CD1 3.45Å; A998-F1028 HydrophobicContact CB-CD2 4.24Å; A998-F1028 HydrophobicContact CB-CE1 3.45Å; A998-F1028 VanDerWaalsContact CB-CE1 3.45Å; A998-F1028 HydrophobicContact CB-CE2 4.23Å; A998-F1028 HydrophobicContact CB-CG 3.87Å; A998-F1028 HydrophobicContact CB-CZ 3.86Å
999	F	92.9	Very high	92.1	Very high	82 Å²	82	50 Å²	50	36%	0.36	25%	0.253	S	S	.	.	H	α-helix	trans	-66.5	-35.1	177.3	-168.5	-114.5	0	0	0	112.8	A995 S996 D997 F1002 Q1003 F1028	A995-F999 VanDerWaalsContact O-CB 3.3Å; A995-F999 WeakPolarHBondContact O-CB 3.34Å; A995-F999 PolarHBondContact O-N 2.7Å; S996-F999 PolarHBondContact O-N 3.26Å; D997-F999 VanDerWaalsContact C-N 3.28Å; D997-F999 PolarHBondContact O-N 3.06Å; F999-F1002 PolarHBondContact O-N 2.81Å; F999-Q1003 HydrophobicContact CE1-CG 4.33Å; F999-Q1003 HydrophobicContact CZ-CG 4.44Å; F999-Q1003 WeakPolarHBondContact O-CG 3.08Å; F999-Q1003 PolarHBondContact O-N 3.16Å; F999-F1028 HydrophobicContact CB-CZ 4.31Å; F999-F1028 HydrophobicContact CD2-CZ 4.43Å
1000	H	93.4	Very high	91.7	Very high	119 Å²	119	51.3 Å²	51.3	55%	0.551	26%	0.259	S	S	*	.	H	α-helix	trans	-66.1	-43	174.3	-177.2	-89.2	0	0	0	112	S996 D997 A998 F1002 Q1003 S1004	S996-H1000 PolarHBondContact O-N 2.75Å; D997-H1000 WeakPolarHBondContact O-CB 3.49Å; D997-H1000 PolarHBondContact O-N 2.89Å; A998-H1000 VanDerWaalsContact C-N 3.35Å; A998-H1000 PolarHBondContact O-N 3.38Å; H1000-F1002 VanDerWaalsContact C-N 3.33Å; H1000-Q1003 PolarHBondContact O-N 2.55Å; H1000-S1004 WeakPolarHBondContact O-CB 3.37Å; H1000-S1004 PolarHBondContact O-N 2.98Å; H1000-S1004 PolarHBondContact O-OG 2.86Å
1001	F	93.6	Very high	91.4	Very high	63 Å²	63	55 Å²	55	28%	0.276	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-43.9	172.7	-84.4	-84.9	0	0	0	111.6	D997 A998 S1004 G1005 L1020 E1023 A1024 L1027	D997-F1001 WeakPolarHBondContact O-CD2 3.48Å; D997-F1001 PolarHBondContact O-N 3.12Å; A998-F1001 PolarHBondContact O-N 3.37Å; F1001-S1004 PolarHBondContact O-N 2.89Å; F1001-G1005 PolarHBondContact O-N 2.81Å; F1001-L1020 HydrophobicContact CD1-CD2 3.8Å; F1001-L1020 HydrophobicContact CE1-CD2 4.14Å; F1001-E1023 HydrophobicContact CD1-CB 4.42Å; F1001-E1023 HydrophobicContact CD1-CG 4.17Å; F1001-E1023 HydrophobicContact CE1-CG 4.17Å; F1001-A1024 HydrophobicContact CB-CB 3.92Å; F1001-L1027 HydrophobicContact CD2-CD1 3.58Å; F1001-L1027 HydrophobicContact CE2-CD1 3.94Å; F1001-L1027 HydrophobicContact CG-CD1 4.23Å
1002	F	94.8	Very high	91.2	Very high	18 Å²	18	56.2 Å²	56.2	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-48.4	177.4	-177.8	-110.2	0	0	0	112.4	A998 F999 H1000 G1005 Q1006 I1021 A1024 F1028 A1041 C1042 L1045	A998-F1002 WeakPolarHBondContact O-CB 3.09Å; A998-F1002 PolarHBondContact O-N 2.83Å; F999-F1002 PolarHBondContact O-N 2.81Å; H1000-F1002 VanDerWaalsContact C-N 3.33Å; F1002-G1005 PolarHBondContact O-N 2.91Å; F1002-Q1006 HydrophobicContact CE1-CG 4.41Å; F1002-Q1006 HydrophobicContact CZ-CG 4.37Å; F1002-Q1006 WeakPolarHBondContact O-CG 3.34Å; F1002-Q1006 PolarHBondContact O-N 2.8Å; F1002-I1021 HydrophobicContact CD2-CD1 3.59Å; F1002-I1021 HydrophobicContact CE2-CD1 4.04Å; F1002-I1021 HydrophobicContact CG-CD1 4.4Å; F1002-I1021 WeakPolarHBondContact O-CD1 3.02Å; F1002-A1024 HydrophobicContact CB-CB 3.95Å; F1002-F1028 HydrophobicContact CB-CE2 4.1Å; F1002-F1028 HydrophobicContact CB-CZ 4.45Å; F1002-F1028 HydrophobicContact CG-CE2 4.43Å; F1002-A1041 HydrophobicContact CE2-CB 4.36Å; F1002-A1041 HydrophobicContact CZ-CB 3.79Å; F1002-C1042 WeakPolarHBondContact CD2-SG 3.37Å; F1002-C1042 HydrophobicContact CE2-CB 4.49Å; F1002-L1045 HydrophobicContact CE2-CD2 4.34Å
1003	Q	94	Very high	91.3	Very high	96 Å²	96	57.9 Å²	57.9	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.4	-75.5	-177.1	53.9	0	0	112.4	F999 H1000 G1005 Q1006 A1007	F999-Q1003 HydrophobicContact CE1-CG 4.33Å; F999-Q1003 HydrophobicContact CZ-CG 4.44Å; F999-Q1003 WeakPolarHBondContact O-CG 3.08Å; F999-Q1003 PolarHBondContact O-N 3.16Å; H1000-Q1003 PolarHBondContact O-N 2.55Å; Q1003-G1005 VanDerWaalsContact C-N 3.34Å; Q1003-G1005 PolarHBondContact O-N 2.75Å; Q1003-Q1006 PolarHBondContact O-N 3.2Å; Q1003-A1007 PolarHBondContact O-N 3.28Å
1004	S	94.2	Very high	91.3	Very high	40 Å²	40	59 Å²	59	28%	0.28	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-43.4	177.7	-60.9	0	0	0	0	111.2	H1000 F1001 A1007 K1008	H1000-S1004 WeakPolarHBondContact O-CB 3.37Å; H1000-S1004 PolarHBondContact O-N 2.98Å; H1000-S1004 PolarHBondContact O-OG 2.86Å; F1001-S1004 PolarHBondContact O-N 2.89Å; S1004-A1007 PolarHBondContact O-N 2.75Å; S1004-K1008 WeakPolarHBondContact O-CG 3.42Å; S1004-K1008 PolarHBondContact O-N 3.07Å
1005	G	93.8	Very high	91.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-45.9	174	0	0	0	0	0	111.9	F1001 F1002 Q1003 A1007 K1008 V1009	F1001-G1005 PolarHBondContact O-N 2.81Å; F1002-G1005 PolarHBondContact O-N 2.91Å; Q1003-G1005 VanDerWaalsContact C-N 3.34Å; Q1003-G1005 PolarHBondContact O-N 2.75Å; G1005-A1007 PolarHBondContact O-N 2.73Å; G1005-K1008 PolarHBondContact O-N 3.27Å; G1005-V1009 VanDerWaalsContact O-CG2 3.29Å; G1005-V1009 WeakPolarHBondContact O-CG2 3.2Å; G1005-V1009 PolarHBondContact O-N 2.87Å
1006	Q	92.4	Very high	91.5	Very high	71 Å²	71	63.1 Å²	63.1	33%	0.332	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-44.8	175	-75.2	-172	-11.7	0	0	112.7	F1002 Q1003 K1008 V1009 Q1010 L1045	F1002-Q1006 HydrophobicContact CE1-CG 4.41Å; F1002-Q1006 HydrophobicContact CZ-CG 4.37Å; F1002-Q1006 WeakPolarHBondContact O-CG 3.34Å; F1002-Q1006 PolarHBondContact O-N 2.8Å; Q1003-Q1006 PolarHBondContact O-N 3.2Å; Q1006-K1008 VanDerWaalsContact C-N 3.34Å; Q1006-K1008 PolarHBondContact O-N 2.8Å; Q1006-V1009 PolarHBondContact O-N 2.9Å; Q1006-Q1010 WeakPolarHBondContact O-CG 3.16Å; Q1006-Q1010 PolarHBondContact O-N 2.81Å; Q1006-L1045 HydrophobicContact CG-CD2 3.77Å
1007	A	92.3	Very high	91.6	Very high	38 Å²	38	59.7 Å²	59.7	31%	0.314	30%	0.298	S	S	.	.	H	α-helix	trans	-62.5	-40.8	178	0	0	0	0	0	111.8	Q1003 S1004 G1005 Q1010 Q1011	Q1003-A1007 PolarHBondContact O-N 3.28Å; S1004-A1007 PolarHBondContact O-N 2.75Å; G1005-A1007 PolarHBondContact O-N 2.73Å; A1007-Q1010 PolarHBondContact O-N 2.89Å; A1007-Q1011 VanDerWaalsContact O-CG 3.29Å; A1007-Q1011 WeakPolarHBondContact O-CG 3.31Å; A1007-Q1011 PolarHBondContact O-N 2.93Å
1008	K	91.6	Very high	91.8	Very high	65 Å²	65	59 Å²	59	28%	0.283	30%	0.295	S	S	.	.	H	α-helix	trans	-65	-41.8	175.4	-74	-70.2	-169.3	150	0	112.8	S1004 G1005 Q1006 Q1010 Q1011 G1012 F1013 E1016 L1020	S1004-K1008 WeakPolarHBondContact O-CG 3.42Å; S1004-K1008 PolarHBondContact O-N 3.07Å; G1005-K1008 PolarHBondContact O-N 3.27Å; Q1006-K1008 VanDerWaalsContact C-N 3.34Å; Q1006-K1008 PolarHBondContact O-N 2.8Å; K1008-Q1010 VanDerWaalsContact C-N 3.33Å; K1008-Q1010 PolarHBondContact O-N 2.8Å; K1008-Q1011 PolarHBondContact O-N 3.02Å; K1008-G1012 PolarHBondContact O-N 2.64Å; K1008-F1013 HydrophobicContact CB-CB 4.47Å; K1008-F1013 HydrophobicContact CD-CB 4.42Å; K1008-F1013 HydrophobicContact CD-CD2 4.11Å; K1008-F1013 PolarHBondContact O-N 2.93Å; K1008-E1016 IonicContact NZ-OE2 3.19Å; K1008-E1016 PolarHBondContact NZ-OE2 3.19Å; K1008-L1020 HydrophobicContact CB-CD1 4.46Å; K1008-L1020 HydrophobicContact CG-CD1 3.92Å
1009	V	89.6	Confident	91.9	Very high	10 Å²	10	65.3 Å²	65.3	6%	0.061	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-45.2	173.4	172	0	0	0	0	110.5	G1005 Q1006 Q1011 G1012 L1014 L1049 I1266	G1005-V1009 VanDerWaalsContact O-CG2 3.29Å; G1005-V1009 WeakPolarHBondContact O-CG2 3.2Å; G1005-V1009 PolarHBondContact O-N 2.87Å; Q1006-V1009 PolarHBondContact O-N 2.9Å; V1009-Q1011 VanDerWaalsContact C-N 3.28Å; V1009-Q1011 PolarHBondContact O-N 3.01Å; V1009-G1012 PolarHBondContact O-N 3.37Å; V1009-L1014 HydrophobicContact CG1-CD2 4.33Å; V1009-L1049 HydrophobicContact CG1-CD2 3.92Å; V1009-L1049 HydrophobicContact CG2-CD1 3.9Å; V1009-L1049 HydrophobicContact CG2-CD2 3.75Å; V1009-L1049 HydrophobicContact CG2-CG 4.39Å; V1009-I1266 HydrophobicContact CG1-CD1 4.01Å; V1009-I1266 HydrophobicContact CG1-CG2 4.37Å
1010	Q	87.6	Confident	92.1	Very high	85 Å²	85	63.4 Å²	63.4	40%	0.397	32%	0.318	S	S	.	.	H	α-helix	trans	-60.6	-36.8	177	-73.1	171.9	6.1	0	0	112.3	Q1006 A1007 K1008 G1012 L1268	Q1006-Q1010 WeakPolarHBondContact O-CG 3.16Å; Q1006-Q1010 PolarHBondContact O-N 2.81Å; A1007-Q1010 PolarHBondContact O-N 2.89Å; K1008-Q1010 VanDerWaalsContact C-N 3.33Å; K1008-Q1010 PolarHBondContact O-N 2.8Å; Q1010-G1012 PolarHBondContact O-N 3.44Å; Q1010-L1268 WeakPolarHBondContact O-CD2 3.36Å
1011	Q	88.3	Confident	92.2	Very high	115 Å²	115	57.8 Å²	57.8	54%	0.537	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-7.2	175.2	-68.6	167.6	20.4	0	0	114	A1007 K1008 V1009 F1013	A1007-Q1011 VanDerWaalsContact O-CG 3.29Å; A1007-Q1011 WeakPolarHBondContact O-CG 3.31Å; A1007-Q1011 PolarHBondContact O-N 2.93Å; K1008-Q1011 PolarHBondContact O-N 3.02Å; V1009-Q1011 VanDerWaalsContact C-N 3.28Å; V1009-Q1011 PolarHBondContact O-N 3.01Å; Q1011-F1013 HydrophobicContact CB-CD2 3.67Å; Q1011-F1013 HydrophobicContact CB-CE2 3.89Å
1012	G	87.4	Confident	92.2	Very high	47 Å²	47	57.7 Å²	57.7	49%	0.485	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	0.7	-179.2	0	0	0	0	0	115	K1008 V1009 Q1010 L1014	K1008-G1012 PolarHBondContact O-N 2.64Å; V1009-G1012 PolarHBondContact O-N 3.37Å; Q1010-G1012 PolarHBondContact O-N 3.44Å; G1012-L1014 VanDerWaalsContact C-N 3.34Å; G1012-L1014 PolarHBondContact O-N 3.16Å
1013	F	90.1	Very high	92.2	Very high	100 Å²	100	59.8 Å²	59.8	44%	0.439	30%	0.304	S	S	.	.			trans	-83.3	73.3	178	-59.6	-69.7	0	0	0	111.2	K1008 Q1011 K1015 E1016 G1017	K1008-F1013 HydrophobicContact CB-CB 4.47Å; K1008-F1013 HydrophobicContact CD-CB 4.42Å; K1008-F1013 HydrophobicContact CD-CD2 4.11Å; K1008-F1013 PolarHBondContact O-N 2.93Å; Q1011-F1013 HydrophobicContact CB-CD2 3.67Å; Q1011-F1013 HydrophobicContact CB-CE2 3.89Å; F1013-K1015 PolarHBondContact O-N 3.19Å; F1013-E1016 HydrophobicContact CB-CB 4.31Å; F1013-G1017 PolarHBondContact O-N 3.17Å
1014	L	89.8	Confident	92.2	Very high	41 Å²	41	55.2 Å²	55.2	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-65.2	-38.4	-169.6	-53.3	-174.3	0	0	0	114.5	V1009 G1012 C1018 L1049 I1052 I1266	V1009-L1014 HydrophobicContact CG1-CD2 4.33Å; G1012-L1014 VanDerWaalsContact C-N 3.34Å; G1012-L1014 PolarHBondContact O-N 3.16Å; L1014-C1018 WeakPolarHBondContact O-CB 3.15Å; L1014-C1018 PolarHBondContact O-N 2.61Å; L1014-L1049 HydrophobicContact CB-CD2 4.42Å; L1014-L1049 HydrophobicContact CD2-CD2 4.12Å; L1014-I1052 HydrophobicContact CD1-CG2 3.6Å; L1014-I1266 HydrophobicContact CD2-CD1 3.31Å
1015	K	91.3	Very high	92.2	Very high	155 Å²	155	54.1 Å²	54.1	67%	0.674	27%	0.274	S	S	*	.	H	α-helix	trans	-69.6	-52	-179	-68.4	-174.5	178.6	-176.3	0	111.7	F1013 G1017 C1018 E1019 M1053	F1013-K1015 PolarHBondContact O-N 3.19Å; K1015-G1017 PolarHBondContact O-N 2.89Å; K1015-C1018 WeakPolarHBondContact O-CB 3.25Å; K1015-C1018 PolarHBondContact O-N 3.33Å; K1015-E1019 WeakPolarHBondContact O-CG 3.44Å; K1015-E1019 PolarHBondContact O-N 3.08Å; K1015-M1053 HydrophobicContact CG-SD 4.31Å
1016	E	92.2	Very high	92.1	Very high	83 Å²	83	57.9 Å²	57.9	39%	0.388	29%	0.294	S	S	.	.	H	α-helix	trans	-56.4	-42.6	173.1	-69.1	174.9	-140	0	0	111	K1008 F1013 E1019 L1020	K1008-E1016 IonicContact NZ-OE2 3.19Å; K1008-E1016 PolarHBondContact NZ-OE2 3.19Å; F1013-E1016 HydrophobicContact CB-CB 4.31Å; E1016-E1019 PolarHBondContact O-N 2.99Å; E1016-L1020 WeakPolarHBondContact O-CG 3.4Å; E1016-L1020 PolarHBondContact O-N 3.49Å
1017	G	92.9	Very high	92.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-47.8	173.4	0	0	0	0	0	112.1	F1013 K1015 E1019 L1020 I1021	F1013-G1017 PolarHBondContact O-N 3.17Å; K1015-G1017 PolarHBondContact O-N 2.89Å; G1017-E1019 PolarHBondContact O-N 3.02Å; G1017-L1020 PolarHBondContact O-N 3.03Å; G1017-I1021 WeakPolarHBondContact O-CG1 3.26Å; G1017-I1021 PolarHBondContact O-N 2.83Å
1018	C	93.9	Very high	92.2	Very high	11 Å²	11	52.9 Å²	52.9	7%	0.074	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-42.8	178.4	-167.2	0	0	0	0	112.3	L1014 K1015 I1021 N1022 L1049 M1053	L1014-C1018 WeakPolarHBondContact O-CB 3.15Å; L1014-C1018 PolarHBondContact O-N 2.61Å; K1015-C1018 WeakPolarHBondContact O-CB 3.25Å; K1015-C1018 PolarHBondContact O-N 3.33Å; C1018-I1021 PolarHBondContact O-N 3Å; C1018-N1022 WeakPolarHBondContact O-CB 3.49Å; C1018-N1022 PolarHBondContact O-N 3.38Å; C1018-N1022 PolarHBondContact O-ND2 3.06Å; C1018-N1022 PolarHBondContact SG-ND2 2.94Å; C1018-L1049 HydrophobicContact CB-CD1 3.99Å; C1018-M1053 HydrophobicContact CB-CE 4.18Å
1019	E	94.3	Very high	92.1	Very high	132 Å²	132	52.4 Å²	52.4	62%	0.617	26%	0.264	S	S	*	.	H	α-helix	trans	-60.6	-48.4	175.9	-70.4	165.6	-169.8	0	0	111.3	K1015 E1016 G1017 I1021 N1022 E1023	K1015-E1019 WeakPolarHBondContact O-CG 3.44Å; K1015-E1019 PolarHBondContact O-N 3.08Å; E1016-E1019 PolarHBondContact O-N 2.99Å; G1017-E1019 PolarHBondContact O-N 3.02Å; E1019-I1021 VanDerWaalsContact C-N 3.35Å; E1019-I1021 PolarHBondContact O-N 3.43Å; E1019-N1022 PolarHBondContact O-N 3.29Å; E1019-E1023 PolarHBondContact O-N 3.26Å
1020	L	95.7	Very high	92	Very high	43 Å²	43	56.3 Å²	56.3	23%	0.225	29%	0.285	C	S	.	.	H	α-helix	trans	-63.5	-37.3	177.9	-70.9	171.8	0	0	0	113	F1001 K1008 E1016 G1017 A1024	F1001-L1020 HydrophobicContact CD1-CD2 3.8Å; F1001-L1020 HydrophobicContact CE1-CD2 4.14Å; K1008-L1020 HydrophobicContact CB-CD1 4.46Å; K1008-L1020 HydrophobicContact CG-CD1 3.92Å; E1016-L1020 WeakPolarHBondContact O-CG 3.4Å; E1016-L1020 PolarHBondContact O-N 3.49Å; G1017-L1020 PolarHBondContact O-N 3.03Å; L1020-A1024 WeakPolarHBondContact O-CB 3.49Å; L1020-A1024 PolarHBondContact O-N 2.87Å
1021	I	95.9	Very high	92.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-73.8	-35.7	177.7	-61	-60	0	0	0	111.4	F1002 G1017 C1018 E1019 E1023 A1024 L1025 C1042 L1045 L1046	F1002-I1021 HydrophobicContact CD2-CD1 3.59Å; F1002-I1021 HydrophobicContact CE2-CD1 4.04Å; F1002-I1021 HydrophobicContact CG-CD1 4.4Å; F1002-I1021 WeakPolarHBondContact O-CD1 3.02Å; G1017-I1021 WeakPolarHBondContact O-CG1 3.26Å; G1017-I1021 PolarHBondContact O-N 2.83Å; C1018-I1021 PolarHBondContact O-N 3Å; E1019-I1021 VanDerWaalsContact C-N 3.35Å; E1019-I1021 PolarHBondContact O-N 3.43Å; I1021-E1023 VanDerWaalsContact C-N 3.34Å; I1021-A1024 PolarHBondContact O-N 2.88Å; I1021-L1025 WeakPolarHBondContact O-CB 3.2Å; I1021-L1025 PolarHBondContact O-N 3.13Å; I1021-C1042 HydrophobicContact CG2-CB 4.08Å; I1021-L1045 HydrophobicContact CD1-CD2 3.59Å; I1021-L1045 HydrophobicContact CG1-CD2 3.7Å; I1021-L1045 HydrophobicContact CG1-CG 4.29Å; I1021-L1045 HydrophobicContact CG2-CB 4.47Å; I1021-L1045 HydrophobicContact CG2-CD2 4.47Å; I1021-L1046 HydrophobicContact CB-CD2 3.95Å; I1021-L1046 HydrophobicContact CB-CG 4.35Å; I1021-L1046 HydrophobicContact CG2-CD1 4.18Å; I1021-L1046 HydrophobicContact CG2-CD2 3.79Å; I1021-L1046 HydrophobicContact CG2-CG 3.61Å
1022	N	94.2	Very high	92.3	Very high	62 Å²	62	47.7 Å²	47.7	33%	0.332	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-41.2	171.7	-82.5	-54.4	0	0	0	111.2	C1018 E1019 L1025 N1026 L1046	C1018-N1022 WeakPolarHBondContact O-CB 3.49Å; C1018-N1022 PolarHBondContact O-N 3.38Å; C1018-N1022 PolarHBondContact O-ND2 3.06Å; C1018-N1022 PolarHBondContact SG-ND2 2.94Å; E1019-N1022 PolarHBondContact O-N 3.29Å; N1022-L1025 WeakPolarHBondContact O-CB 3.18Å; N1022-L1025 PolarHBondContact O-N 3.37Å; N1022-N1026 VanDerWaalsContact O-CG 3.32Å; N1022-N1026 PolarHBondContact O-N 3.33Å; N1022-N1026 PolarHBondContact O-ND2 3Å; N1022-L1046 WeakPolarHBondContact OD1-CD1 3.44Å
1023	E	93.7	Very high	92.2	Very high	62 Å²	62	47 Å²	47	29%	0.29	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-46.4	174.8	-169.2	56.5	-147.6	0	0	110.9	F1001 E1019 I1021 L1025 N1026 L1027	F1001-E1023 HydrophobicContact CD1-CB 4.42Å; F1001-E1023 HydrophobicContact CD1-CG 4.17Å; F1001-E1023 HydrophobicContact CE1-CG 4.17Å; E1019-E1023 PolarHBondContact O-N 3.26Å; I1021-E1023 VanDerWaalsContact C-N 3.34Å; E1023-L1025 VanDerWaalsContact C-N 3.28Å; E1023-L1025 PolarHBondContact O-N 3.3Å; E1023-N1026 PolarHBondContact O-N 3.28Å; E1023-N1026 VanDerWaalsContact O-N 3.15Å; E1023-L1027 HydrophobicContact CG-CD1 4.38Å; E1023-L1027 VanDerWaalsContact O-CG 3.3Å; E1023-L1027 WeakPolarHBondContact O-CG 3.37Å; E1023-L1027 PolarHBondContact O-N 2.85Å
1024	A	95.3	Very high	92	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.1	-41.6	174.1	0	0	0	0	0	112.4	F1001 F1002 L1020 I1021 L1027 F1028	F1001-A1024 HydrophobicContact CB-CB 3.92Å; F1002-A1024 HydrophobicContact CB-CB 3.95Å; L1020-A1024 WeakPolarHBondContact O-CB 3.49Å; L1020-A1024 PolarHBondContact O-N 2.87Å; I1021-A1024 PolarHBondContact O-N 2.88Å; A1024-L1027 PolarHBondContact O-N 3.17Å; A1024-F1028 HydrophobicContact CB-CD2 4.48Å; A1024-F1028 HydrophobicContact CB-CE2 4.33Å; A1024-F1028 WeakPolarHBondContact O-CB 3.43Å; A1024-F1028 WeakPolarHBondContact O-CD2 3.47Å; A1024-F1028 WeakPolarHBondContact O-CG 3.23Å; A1024-F1028 PolarHBondContact O-N 3.12Å
1025	L	94.4	Very high	92	Very high	17 Å²	17	42.3 Å²	42.3	9%	0.089	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-45.9	176.3	176.6	65.3	0	0	0	111.5	I1021 N1022 E1023 F1028 N1029 I1039 C1042 L1043 L1046	I1021-L1025 WeakPolarHBondContact O-CB 3.2Å; I1021-L1025 PolarHBondContact O-N 3.13Å; N1022-L1025 WeakPolarHBondContact O-CB 3.18Å; N1022-L1025 PolarHBondContact O-N 3.37Å; E1023-L1025 VanDerWaalsContact C-N 3.28Å; E1023-L1025 PolarHBondContact O-N 3.3Å; L1025-F1028 PolarHBondContact O-N 3.2Å; L1025-N1029 WeakPolarHBondContact O-CB 3Å; L1025-N1029 PolarHBondContact O-N 3.46Å; L1025-N1029 PolarHBondContact O-ND2 2.85Å; L1025-I1039 HydrophobicContact CD1-CB 4.31Å; L1025-I1039 HydrophobicContact CD1-CG2 3.37Å; L1025-C1042 HydrophobicContact CB-CB 4.09Å; L1025-C1042 HydrophobicContact CD1-CB 4.05Å; L1025-L1043 HydrophobicContact CD1-CD2 4.33Å; L1025-L1043 HydrophobicContact CD1-CG 4.19Å; L1025-L1043 HydrophobicContact CD2-CD2 3.93Å; L1025-L1046 HydrophobicContact CB-CD1 4.47Å; L1025-L1046 HydrophobicContact CD2-CD1 3.69Å
1026	N	91.4	Very high	92	Very high	79 Å²	79	35.1 Å²	35.1	42%	0.422	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-46.3	177.3	-67.9	-24.5	0	0	0	111.3	N1022 E1023 F1028 N1029 N1030	N1022-N1026 VanDerWaalsContact O-CG 3.32Å; N1022-N1026 PolarHBondContact O-N 3.33Å; N1022-N1026 PolarHBondContact O-ND2 3Å; E1023-N1026 PolarHBondContact O-N 3.28Å; E1023-N1026 VanDerWaalsContact O-N 3.15Å; N1026-F1028 PolarHBondContact O-N 3.33Å; N1026-N1029 PolarHBondContact O-N 3.44Å; N1026-N1030 VanDerWaalsContact O-CG 3.24Å; N1026-N1030 PolarHBondContact O-N 3.08Å; N1026-N1030 PolarHBondContact O-ND2 3.26Å
1027	L	91.5	Very high	92	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-41.9	177.9	-63.2	178.6	0	0	0	112.1	L370 A998 F1001 E1023 A1024 N1030 V1031	L370-L1027 HydrophobicContact CD1-CD2 3.49Å; L370-L1027 VanDerWaalsContact CD1-CD2 3.49Å; L370-L1027 HydrophobicContact CD2-CB 4.49Å; L370-L1027 HydrophobicContact CD2-CD2 3.89Å; L370-L1027 HydrophobicContact CG-CD2 4.33Å; A998-L1027 HydrophobicContact CB-CB 3.59Å; A998-L1027 HydrophobicContact CB-CD1 4.47Å; F1001-L1027 HydrophobicContact CD2-CD1 3.58Å; F1001-L1027 HydrophobicContact CE2-CD1 3.94Å; F1001-L1027 HydrophobicContact CG-CD1 4.23Å; E1023-L1027 HydrophobicContact CG-CD1 4.38Å; E1023-L1027 VanDerWaalsContact O-CG 3.3Å; E1023-L1027 WeakPolarHBondContact O-CG 3.37Å; E1023-L1027 PolarHBondContact O-N 2.85Å; A1024-L1027 PolarHBondContact O-N 3.17Å; L1027-N1030 PolarHBondContact O-N 3.21Å; L1027-V1031 WeakPolarHBondContact O-CG2 3.3Å; L1027-V1031 PolarHBondContact O-N 3.34Å
1028	F	94.3	Very high	92	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-64.5	-41.1	174.6	-75.1	-51.1	0	0	0	112.4	A995 A998 F999 F1002 A1024 L1025 N1026 N1030 V1031 Y1032 E1038 I1039 C1042	A995-F1028 HydrophobicContact CB-CD1 3.93Å; A995-F1028 HydrophobicContact CB-CE1 3.98Å; A998-F1028 HydrophobicContact CB-CD1 3.45Å; A998-F1028 VanDerWaalsContact CB-CD1 3.45Å; A998-F1028 HydrophobicContact CB-CD2 4.24Å; A998-F1028 HydrophobicContact CB-CE1 3.45Å; A998-F1028 VanDerWaalsContact CB-CE1 3.45Å; A998-F1028 HydrophobicContact CB-CE2 4.23Å; A998-F1028 HydrophobicContact CB-CG 3.87Å; A998-F1028 HydrophobicContact CB-CZ 3.86Å; F999-F1028 HydrophobicContact CB-CZ 4.31Å; F999-F1028 HydrophobicContact CD2-CZ 4.43Å; F1002-F1028 HydrophobicContact CB-CE2 4.1Å; F1002-F1028 HydrophobicContact CB-CZ 4.45Å; F1002-F1028 HydrophobicContact CG-CE2 4.43Å; A1024-F1028 HydrophobicContact CB-CD2 4.48Å; A1024-F1028 HydrophobicContact CB-CE2 4.33Å; A1024-F1028 WeakPolarHBondContact O-CB 3.43Å; A1024-F1028 WeakPolarHBondContact O-CD2 3.47Å; A1024-F1028 WeakPolarHBondContact O-CG 3.23Å; A1024-F1028 PolarHBondContact O-N 3.12Å; L1025-F1028 PolarHBondContact O-N 3.2Å; N1026-F1028 PolarHBondContact O-N 3.33Å; F1028-N1030 VanDerWaalsContact C-N 3.28Å; F1028-N1030 PolarHBondContact O-N 3.24Å; F1028-V1031 PolarHBondContact O-N 2.89Å; F1028-Y1032 HydrophobicContact CB-CD2 4.22Å; F1028-Y1032 AromaticContact CD1-CD2 3.77Å; F1028-Y1032 HydrophobicContact CD1-CD2 3.77Å; F1028-Y1032 AromaticContact CD1-CE2 3.37Å; F1028-Y1032 HydrophobicContact CD1-CE2 3.37Å; F1028-Y1032 AromaticContact CE1-CE2 3.82Å; F1028-Y1032 HydrophobicContact CE1-CE2 3.82Å; F1028-Y1032 HydrophobicContact CG-CD2 4.38Å; F1028-Y1032 HydrophobicContact CG-CE2 4.34Å; F1028-Y1032 WeakPolarHBondContact O-CB 3.39Å; F1028-Y1032 PolarHBondContact O-N 3.2Å; F1028-E1038 HydrophobicContact CD1-CB 4.09Å; F1028-E1038 HydrophobicContact CD2-CB 4.17Å; F1028-E1038 HydrophobicContact CE1-CB 3.83Å; F1028-E1038 HydrophobicContact CE1-CG 4.05Å; F1028-E1038 HydrophobicContact CE2-CB 3.93Å; F1028-E1038 HydrophobicContact CG-CB 4.25Å; F1028-E1038 HydrophobicContact CZ-CB 3.75Å; F1028-E1038 HydrophobicContact CZ-CG 4Å; F1028-I1039 HydrophobicContact CB-CD1 4.42Å; F1028-I1039 HydrophobicContact CB-CG1 3.65Å; F1028-C1042 VanDerWaalsContact CD2-SG 3.57Å
1029	N	90.8	Very high	92	Very high	54 Å²	54	35.2 Å²	35.2	29%	0.289	19%	0.194	S	C	.	.	H	α-helix	trans	-60.9	-39.3	174.5	-77.6	-34.9	0	0	0	111.6	L1025 N1026 G1033 I1039	L1025-N1029 WeakPolarHBondContact O-CB 3Å; L1025-N1029 PolarHBondContact O-N 3.46Å; L1025-N1029 PolarHBondContact O-ND2 2.85Å; N1026-N1029 PolarHBondContact O-N 3.44Å; N1029-G1033 CarbonylContact O-C 3.55Å; N1029-G1033 WeakPolarHBondContact O-CA 3.33Å; N1029-G1033 PolarHBondContact O-N 3.04Å; N1029-I1039 WeakPolarHBondContact OD1-CD1 3.41Å
1030	N	87.1	Confident	92	Very high	93 Å²	93	29.2 Å²	29.2	50%	0.497	17%	0.167	S	C	.	.	H	α-helix	trans	-66.2	-37.9	178.1	-72	-20.9	0	0	0	112.6	R374 N1026 L1027 F1028	R374-N1030 VanDerWaalsContact CD-O 3.29Å; R374-N1030 WeakPolarHBondContact CD-O 3.45Å; R374-N1030 WeakPolarHBondContact CG-O 3.44Å; N1026-N1030 VanDerWaalsContact O-CG 3.24Å; N1026-N1030 PolarHBondContact O-N 3.08Å; N1026-N1030 PolarHBondContact O-ND2 3.26Å; L1027-N1030 PolarHBondContact O-N 3.21Å; F1028-N1030 VanDerWaalsContact C-N 3.28Å; F1028-N1030 PolarHBondContact O-N 3.24Å
1031	V	89.6	Confident	91.8	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.024	17%	0.165	C	C	.	.	H	α-helix	trans	-83.9	-51.7	-178	174.7	0	0	0	0	112.4	L370 E373 F377 A995 L1027 F1028	L370-V1031 HydrophobicContact CD2-CG2 4.03Å; E373-V1031 HydrophobicContact CB-CG1 3.86Å; E373-V1031 HydrophobicContact CB-CG2 3.96Å; F377-V1031 HydrophobicContact CB-CG1 4.44Å; A995-V1031 HydrophobicContact CB-CB 4.02Å; A995-V1031 HydrophobicContact CB-CG1 3.8Å; A995-V1031 HydrophobicContact CB-CG2 4.12Å; L1027-V1031 WeakPolarHBondContact O-CG2 3.3Å; L1027-V1031 PolarHBondContact O-N 3.34Å; F1028-V1031 PolarHBondContact O-N 2.89Å
1032	Y	91.3	Very high	91.8	Very high	14 Å²	14	28.2 Å²	28.2	6%	0.055	17%	0.165	C	C	.	.	H	α-helix	trans	-93	-14	-172.5	-58	-45.4	0	0	0	113.9	F377 P993 A995 F1028 H1036 E1038	F377-Y1032 HydrophobicContact CB-CD1 4.33Å; F377-Y1032 AromaticContact CD1-CD1 3.88Å; F377-Y1032 HydrophobicContact CD1-CD1 3.88Å; F377-Y1032 AromaticContact CD2-CD1 3.4Å; F377-Y1032 HydrophobicContact CD2-CD1 3.4Å; F377-Y1032 AromaticContact CD2-CE1 3.59Å; F377-Y1032 HydrophobicContact CD2-CE1 3.59Å; F377-Y1032 AromaticContact CE1-CD1 3.96Å; F377-Y1032 HydrophobicContact CE1-CD1 3.96Å; F377-Y1032 HydrophobicContact CE1-CG 4.49Å; F377-Y1032 AromaticContact CE2-CD1 3.48Å; F377-Y1032 HydrophobicContact CE2-CD1 3.48Å; F377-Y1032 VanDerWaalsContact CE2-CD1 3.48Å; F377-Y1032 AromaticContact CE2-CE1 3.84Å; F377-Y1032 HydrophobicContact CE2-CE1 3.84Å; F377-Y1032 HydrophobicContact CE2-CG 4.42Å; F377-Y1032 AromaticContact CG-CD1 3.59Å; F377-Y1032 HydrophobicContact CG-CD1 3.59Å; F377-Y1032 HydrophobicContact CG-CE1 4.1Å; F377-Y1032 AromaticContact CZ-CD1 3.76Å; F377-Y1032 HydrophobicContact CZ-CD1 3.76Å; F377-Y1032 HydrophobicContact CZ-CG 4.35Å; P993-Y1032 PolarHBondContact O-OH 2.95Å; A995-Y1032 HydrophobicContact CB-CE1 4.25Å; A995-Y1032 HydrophobicContact CB-CE2 4.05Å; A995-Y1032 PolarHBondContact N-OH 3.4Å; F1028-Y1032 HydrophobicContact CB-CD2 4.22Å; F1028-Y1032 AromaticContact CD1-CD2 3.77Å; F1028-Y1032 HydrophobicContact CD1-CD2 3.77Å; F1028-Y1032 AromaticContact CD1-CE2 3.37Å; F1028-Y1032 HydrophobicContact CD1-CE2 3.37Å; F1028-Y1032 AromaticContact CE1-CE2 3.82Å; F1028-Y1032 HydrophobicContact CE1-CE2 3.82Å; F1028-Y1032 HydrophobicContact CG-CD2 4.38Å; F1028-Y1032 HydrophobicContact CG-CE2 4.34Å; F1028-Y1032 WeakPolarHBondContact O-CB 3.39Å; F1028-Y1032 PolarHBondContact O-N 3.2Å; Y1032-H1036 HydrophobicContact CD2-CB 3.79Å; Y1032-H1036 AromaticContact CD2-CE1 3.83Å; Y1032-H1036 AromaticContact CD2-CG 3.44Å; Y1032-H1036 VanDerWaalsContact CD2-CG 3.44Å; Y1032-H1036 AromaticContact CD2-ND1 3.28Å; Y1032-H1036 VanDerWaalsContact CD2-ND1 3.28Å; Y1032-H1036 WeakPolarHBondContact CD2-ND1 3.45Å; Y1032-H1036 AromaticContact CE2-CE1 3.57Å; Y1032-H1036 AromaticContact CE2-CG 3.97Å; Y1032-H1036 AromaticContact CE2-ND1 3.32Å; Y1032-H1036 VanDerWaalsContact CE2-ND1 3.32Å; Y1032-H1036 WeakPolarHBondContact CE2-ND1 3.38Å; Y1032-H1036 HydrophobicContact CG-CB 3.96Å; Y1032-H1036 AromaticContact CG-CD2 3.77Å; Y1032-H1036 AromaticContact CG-CG 3.57Å; Y1032-H1036 AromaticContact CG-ND1 3.8Å; Y1032-H1036 AromaticContact CZ-CE1 3.67Å; Y1032-H1036 AromaticContact CZ-ND1 3.92Å; Y1032-E1038 HydrophobicContact CE2-CB 4.34Å
1033	G	87.4	Confident	91.9	Very high	32 Å²	32	25.6 Å²	25.6	33%	0.33	15%	0.151	S	C	.	.			trans	81.5	-162.5	-168.3	0	0	0	0	0	112.2	N1029 M1035 I1039	N1029-G1033 CarbonylContact O-C 3.55Å; N1029-G1033 WeakPolarHBondContact O-CA 3.33Å; N1029-G1033 PolarHBondContact O-N 3.04Å; G1033-M1035 VanDerWaalsContact C-N 3.26Å; G1033-M1035 PolarHBondContact O-N 3.24Å; G1033-I1039 WeakPolarHBondContact O-CD1 3.45Å
1034	A	84.8	Confident	91.9	Very high	40 Å²	40	26.4 Å²	26.4	33%	0.331	15%	0.151	S	C	.	.	S	Bend	trans	-72.5	-10	-169.3	0	0	0	0	0	115.6	F304 I307	F304-A1034 HydrophobicContact CE1-CB 4.44Å; I307-A1034 HydrophobicContact CD1-CB 3.97Å
1035	M	89.3	Confident	91.8	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.015	16%	0.157	C	C	.	.			trans	-140.6	107.3	-169.2	-170.5	110.7	65.1	0	0	112.2	I307 T309 P310 G1033 M1069 R1072 V1073	I307-M1035 HydrophobicContact CB-CE 3.95Å; I307-M1035 HydrophobicContact CG2-CE 4.2Å; I307-M1035 WeakPolarHBondContact O-CE 3.32Å; T309-M1035 HydrophobicContact CG2-CE 4.09Å; T309-M1035 HydrophobicContact CG2-CG 4.15Å; T309-M1035 HydrophobicContact CG2-SD 4.41Å; P310-M1035 WeakPolarHBondContact CD-O 3.27Å; P310-M1035 WeakPolarHBondContact CG-O 3.45Å; G1033-M1035 VanDerWaalsContact C-N 3.26Å; G1033-M1035 PolarHBondContact O-N 3.24Å; M1035-M1069 HydrophobicContact CG-CG 4.13Å; M1035-M1069 HydrophobicContact CG-SD 4.48Å; M1035-M1069 HydrophobicContact SD-CB 4.36Å; M1035-M1069 HydrophobicContact SD-CG 3.96Å; M1035-R1072 HydrophobicContact CE-CB 4.01Å; M1035-R1072 HydrophobicContact CE-CG 4.21Å; M1035-R1072 HydrophobicContact SD-CB 3.62Å; M1035-R1072 HydrophobicContact SD-CG 4.19Å; M1035-V1073 HydrophobicContact CG-CG2 3.28Å; M1035-V1073 HydrophobicContact SD-CG2 4.02Å
1036	H	92.9	Very high	91.9	Very high	5 Å²	5	26.8 Å²	26.8	2%	0.023	15%	0.153	C	C	.	.			trans	-160.4	156.8	177.2	-157.6	-98.9	0	0	0	111.8	F377 Y1032 E1038 I1039 C1040 M1069	F377-H1036 AromaticContact CE2-CD2 3.87Å; F377-H1036 AromaticContact CE2-NE2 3.61Å; F377-H1036 AromaticContact CZ-CD2 3.6Å; F377-H1036 AromaticContact CZ-NE2 3.85Å; Y1032-H1036 HydrophobicContact CD2-CB 3.79Å; Y1032-H1036 AromaticContact CD2-CE1 3.83Å; Y1032-H1036 AromaticContact CD2-CG 3.44Å; Y1032-H1036 VanDerWaalsContact CD2-CG 3.44Å; Y1032-H1036 AromaticContact CD2-ND1 3.28Å; Y1032-H1036 VanDerWaalsContact CD2-ND1 3.28Å; Y1032-H1036 WeakPolarHBondContact CD2-ND1 3.45Å; Y1032-H1036 AromaticContact CE2-CE1 3.57Å; Y1032-H1036 AromaticContact CE2-CG 3.97Å; Y1032-H1036 AromaticContact CE2-ND1 3.32Å; Y1032-H1036 VanDerWaalsContact CE2-ND1 3.32Å; Y1032-H1036 WeakPolarHBondContact CE2-ND1 3.38Å; Y1032-H1036 HydrophobicContact CG-CB 3.96Å; Y1032-H1036 AromaticContact CG-CD2 3.77Å; Y1032-H1036 AromaticContact CG-CG 3.57Å; Y1032-H1036 AromaticContact CG-ND1 3.8Å; Y1032-H1036 AromaticContact CZ-CE1 3.67Å; Y1032-H1036 AromaticContact CZ-ND1 3.92Å; H1036-E1038 IonicContact CE1-OE1 3.94Å; H1036-E1038 IonicContact CE1-OE2 3.77Å; H1036-E1038 PolarHBondContact CE1-OE2 3.01Å; H1036-E1038 IonicContact CG-OE2 2.75Å; H1036-E1038 IonicContact ND1-OE2 3.47Å; H1036-E1038 PolarHBondContact ND1-OE2 2.86Å; H1036-E1038 PolarHBondContact O-N 2.79Å; H1036-I1039 HydrophobicContact CB-CD1 3.79Å; H1036-I1039 HydrophobicContact CB-CG1 4.11Å; H1036-I1039 PolarHBondContact O-N 3.12Å; H1036-C1040 PolarHBondContact O-N 2.97Å; H1036-M1069 PolarHBondContact N-SD 2.63Å; H1036-M1069 VanDerWaalsContact N-SD 3.41Å
1037	V	91.4	Very high	92.1	Very high	51 Å²	51	23 Å²	23	31%	0.309	13%	0.133	S	C	.	.	H	α-helix	trans	-66.6	-34.4	-174.4	62.9	0	0	0	0	113.2	I1039 C1040 A1041 V1073 L1074	V1037-I1039 PolarHBondContact O-N 3.26Å; V1037-C1040 VanDerWaalsContact O-CB 3.24Å; V1037-C1040 WeakPolarHBondContact O-CB 3.29Å; V1037-C1040 PolarHBondContact O-N 2.7Å; V1037-A1041 PolarHBondContact O-N 3.02Å; V1037-V1073 HydrophobicContact CB-CG1 4.21Å; V1037-L1074 HydrophobicContact CB-CD2 4.5Å; V1037-L1074 HydrophobicContact CG2-CD1 4.16Å; V1037-L1074 HydrophobicContact CG2-CD2 4.05Å; V1037-L1074 HydrophobicContact CG2-CG 4.42Å
1038	E	92.5	Very high	92.2	Very high	42 Å²	42	25.9 Å²	25.9	20%	0.196	14%	0.144	C	C	.	.	H	α-helix	trans	-68.6	-33.1	177.4	-76.3	79.5	166.9	0	0	112.3	F1028 Y1032 H1036 C1040 A1041 C1042	F1028-E1038 HydrophobicContact CD1-CB 4.09Å; F1028-E1038 HydrophobicContact CD2-CB 4.17Å; F1028-E1038 HydrophobicContact CE1-CB 3.83Å; F1028-E1038 HydrophobicContact CE1-CG 4.05Å; F1028-E1038 HydrophobicContact CE2-CB 3.93Å; F1028-E1038 HydrophobicContact CG-CB 4.25Å; F1028-E1038 HydrophobicContact CZ-CB 3.75Å; F1028-E1038 HydrophobicContact CZ-CG 4Å; Y1032-E1038 HydrophobicContact CE2-CB 4.34Å; H1036-E1038 IonicContact CE1-OE1 3.94Å; H1036-E1038 IonicContact CE1-OE2 3.77Å; H1036-E1038 PolarHBondContact CE1-OE2 3.01Å; H1036-E1038 IonicContact CG-OE2 2.75Å; H1036-E1038 IonicContact ND1-OE2 3.47Å; H1036-E1038 PolarHBondContact ND1-OE2 2.86Å; H1036-E1038 PolarHBondContact O-N 2.79Å; E1038-C1040 VanDerWaalsContact C-N 3.28Å; E1038-C1040 PolarHBondContact O-N 3.2Å; E1038-A1041 WeakPolarHBondContact O-CB 3.43Å; E1038-A1041 PolarHBondContact O-N 2.9Å; E1038-C1042 PolarHBondContact O-N 2.78Å; E1038-C1042 PolarHBondContact O-SG 3.37Å
1039	I	94.2	Very high	92.1	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-38.9	174	-58.4	169.5	0	0	0	109	L1025 F1028 N1029 G1033 H1036 V1037 A1041 C1042 L1043 M1069	L1025-I1039 HydrophobicContact CD1-CB 4.31Å; L1025-I1039 HydrophobicContact CD1-CG2 3.37Å; F1028-I1039 HydrophobicContact CB-CD1 4.42Å; F1028-I1039 HydrophobicContact CB-CG1 3.65Å; N1029-I1039 WeakPolarHBondContact OD1-CD1 3.41Å; G1033-I1039 WeakPolarHBondContact O-CD1 3.45Å; H1036-I1039 HydrophobicContact CB-CD1 3.79Å; H1036-I1039 HydrophobicContact CB-CG1 4.11Å; H1036-I1039 PolarHBondContact O-N 3.12Å; V1037-I1039 PolarHBondContact O-N 3.26Å; I1039-A1041 VanDerWaalsContact C-N 3.34Å; I1039-A1041 PolarHBondContact O-N 3.33Å; I1039-C1042 PolarHBondContact O-N 2.65Å; I1039-L1043 HydrophobicContact CG2-CD1 4.16Å; I1039-L1043 HydrophobicContact CG2-CG 4.49Å; I1039-L1043 WeakPolarHBondContact O-CG 3.41Å; I1039-L1043 PolarHBondContact O-N 3.32Å; I1039-M1069 HydrophobicContact CB-CE 3.74Å; I1039-M1069 HydrophobicContact CB-SD 3.89Å; I1039-M1069 HydrophobicContact CG2-CE 3.49Å; I1039-M1069 VanDerWaalsContact CG2-CE 3.49Å; I1039-M1069 HydrophobicContact CG2-SD 3.95Å
1040	C	93.5	Very high	92.3	Very high	7 Å²	7	24.1 Å²	24.1	5%	0.047	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-44.4	174.2	-175	0	0	0	0	111.5	H1036 V1037 E1038 C1042 L1043 R1044 A1066 M1069	H1036-C1040 PolarHBondContact O-N 2.97Å; V1037-C1040 VanDerWaalsContact O-CB 3.24Å; V1037-C1040 WeakPolarHBondContact O-CB 3.29Å; V1037-C1040 PolarHBondContact O-N 2.7Å; E1038-C1040 VanDerWaalsContact C-N 3.28Å; E1038-C1040 PolarHBondContact O-N 3.2Å; C1040-C1042 VanDerWaalsContact C-N 3.33Å; C1040-C1042 PolarHBondContact O-N 3.11Å; C1040-L1043 PolarHBondContact O-N 3.13Å; C1040-R1044 WeakPolarHBondContact O-CB 3.47Å; C1040-R1044 PolarHBondContact O-N 3.07Å; C1040-A1066 PolarHBondContact SG-O 3.41Å; C1040-A1066 VanDerWaalsContact SG-O 3.36Å; C1040-M1069 VanDerWaalsContact CA-CE 3.47Å; C1040-M1069 HydrophobicContact CB-CE 3.84Å; C1040-M1069 HydrophobicContact CB-CG 4.47Å
1041	A	92.4	Very high	92.5	Very high	22 Å²	22	20.3 Å²	20.3	18%	0.182	11%	0.113	C	C	.	.	H	α-helix	trans	-62.8	-38.1	177.5	0	0	0	0	0	112.8	F1002 V1037 E1038 I1039 L1045	F1002-A1041 HydrophobicContact CE2-CB 4.36Å; F1002-A1041 HydrophobicContact CZ-CB 3.79Å; V1037-A1041 PolarHBondContact O-N 3.02Å; E1038-A1041 WeakPolarHBondContact O-CB 3.43Å; E1038-A1041 PolarHBondContact O-N 2.9Å; I1039-A1041 VanDerWaalsContact C-N 3.34Å; I1039-A1041 PolarHBondContact O-N 3.33Å; A1041-L1045 PolarHBondContact O-N 2.8Å
1042	C	95.3	Very high	92.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.7	-51.6	174.2	-63.8	0	0	0	0	111.6	F1002 I1021 L1025 F1028 E1038 I1039 C1040 R1044 L1045 L1046	F1002-C1042 WeakPolarHBondContact CD2-SG 3.37Å; F1002-C1042 HydrophobicContact CE2-CB 4.49Å; I1021-C1042 HydrophobicContact CG2-CB 4.08Å; L1025-C1042 HydrophobicContact CB-CB 4.09Å; L1025-C1042 HydrophobicContact CD1-CB 4.05Å; F1028-C1042 VanDerWaalsContact CD2-SG 3.57Å; E1038-C1042 PolarHBondContact O-N 2.78Å; E1038-C1042 PolarHBondContact O-SG 3.37Å; I1039-C1042 PolarHBondContact O-N 2.65Å; C1040-C1042 VanDerWaalsContact C-N 3.33Å; C1040-C1042 PolarHBondContact O-N 3.11Å; C1042-R1044 VanDerWaalsContact C-N 3.33Å; C1042-R1044 PolarHBondContact O-N 2.67Å; C1042-L1045 PolarHBondContact O-N 2.69Å; C1042-L1045 VanDerWaalsContact O-N 3.09Å; C1042-L1046 WeakPolarHBondContact O-CG 3.49Å; C1042-L1046 PolarHBondContact O-N 2.9Å
1043	L	96	Very high	92.5	Very high	6 Å²	6	26 Å²	26	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-59.5	-41.8	-179.2	-72.5	169.8	0	0	0	112.5	L1025 I1039 C1040 L1045 L1046 A1047 N1062 K1065 A1066 M1069	L1025-L1043 HydrophobicContact CD1-CD2 4.33Å; L1025-L1043 HydrophobicContact CD1-CG 4.19Å; L1025-L1043 HydrophobicContact CD2-CD2 3.93Å; I1039-L1043 HydrophobicContact CG2-CD1 4.16Å; I1039-L1043 HydrophobicContact CG2-CG 4.49Å; I1039-L1043 WeakPolarHBondContact O-CG 3.41Å; I1039-L1043 PolarHBondContact O-N 3.32Å; C1040-L1043 PolarHBondContact O-N 3.13Å; L1043-L1045 VanDerWaalsContact C-N 3.35Å; L1043-L1045 PolarHBondContact O-N 3.4Å; L1043-L1046 PolarHBondContact O-N 3.03Å; L1043-A1047 WeakPolarHBondContact O-CB 3.37Å; L1043-A1047 PolarHBondContact O-N 3.3Å; L1043-N1062 HydrophobicContact CD2-CB 4.3Å; L1043-K1065 HydrophobicContact CD1-CB 3.73Å; L1043-K1065 HydrophobicContact CD2-CB 4.48Å; L1043-K1065 HydrophobicContact CD2-CD 4.28Å; L1043-A1066 HydrophobicContact CB-CB 4.03Å; L1043-M1069 HydrophobicContact CD1-CE 3.43Å; L1043-M1069 VanDerWaalsContact CD1-CE 3.43Å
1044	R	94.8	Very high	92.6	Very high	80 Å²	80	26.8 Å²	26.8	30%	0.302	15%	0.15	S	C	.	.	H	α-helix	trans	-59.6	-45.1	174.1	175.6	179.8	63	-168.3	6.9	112	C1040 C1042 A1047 R1048 E1084	C1040-R1044 WeakPolarHBondContact O-CB 3.47Å; C1040-R1044 PolarHBondContact O-N 3.07Å; C1042-R1044 VanDerWaalsContact C-N 3.33Å; C1042-R1044 PolarHBondContact O-N 2.67Å; R1044-A1047 PolarHBondContact O-N 2.95Å; R1044-R1048 PolarHBondContact O-N 3.04Å; R1044-R1048 VanDerWaalsContact O-N 3.08Å; R1044-E1084 VanDerWaalsContact CD-OE1 3.27Å; R1044-E1084 WeakPolarHBondContact CD-OE1 3.36Å; R1044-E1084 WeakPolarHBondContact CD-OE2 3.35Å; R1044-E1084 IonicContact CZ-OE1 2.68Å; R1044-E1084 IonicContact NE-OE1 2.98Å; R1044-E1084 IonicContact NH1-OE1 2.64Å; R1044-E1084 PolarHBondContact NH1-OE1 3.31Å
1045	L	94	Very high	92.8	Very high	25 Å²	25	28.5 Å²	28.5	13%	0.131	15%	0.153	C	C	.	.	H	α-helix	trans	-68.6	-41.3	-179.7	-177	55	0	0	0	111.3	F1002 Q1006 I1021 A1041 C1042 L1043 A1047 R1048 L1049	F1002-L1045 HydrophobicContact CE2-CD2 4.34Å; Q1006-L1045 HydrophobicContact CG-CD2 3.77Å; I1021-L1045 HydrophobicContact CD1-CD2 3.59Å; I1021-L1045 HydrophobicContact CG1-CD2 3.7Å; I1021-L1045 HydrophobicContact CG1-CG 4.29Å; I1021-L1045 HydrophobicContact CG2-CB 4.47Å; I1021-L1045 HydrophobicContact CG2-CD2 4.47Å; A1041-L1045 PolarHBondContact O-N 2.8Å; C1042-L1045 PolarHBondContact O-N 2.69Å; C1042-L1045 VanDerWaalsContact O-N 3.09Å; L1043-L1045 VanDerWaalsContact C-N 3.35Å; L1043-L1045 PolarHBondContact O-N 3.4Å; L1045-A1047 VanDerWaalsContact C-N 3.34Å; L1045-A1047 PolarHBondContact O-N 3.11Å; L1045-R1048 WeakPolarHBondContact O-CB 3.36Å; L1045-R1048 PolarHBondContact O-N 2.97Å; L1045-L1049 HydrophobicContact CD1-CG 4.39Å; L1045-L1049 HydrophobicContact CG-CD1 4.25Å; L1045-L1049 VanDerWaalsContact O-CG 3.32Å; L1045-L1049 WeakPolarHBondContact O-CG 3.24Å; L1045-L1049 PolarHBondContact O-N 3.24Å
1046	L	95.4	Very high	92.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.9	-42.8	173	-70.6	169.9	0	0	0	111.8	I1021 N1022 L1025 C1042 L1043 R1048 L1049 N1050	I1021-L1046 HydrophobicContact CB-CD2 3.95Å; I1021-L1046 HydrophobicContact CB-CG 4.35Å; I1021-L1046 HydrophobicContact CG2-CD1 4.18Å; I1021-L1046 HydrophobicContact CG2-CD2 3.79Å; I1021-L1046 HydrophobicContact CG2-CG 3.61Å; N1022-L1046 WeakPolarHBondContact OD1-CD1 3.44Å; L1025-L1046 HydrophobicContact CB-CD1 4.47Å; L1025-L1046 HydrophobicContact CD2-CD1 3.69Å; C1042-L1046 WeakPolarHBondContact O-CG 3.49Å; C1042-L1046 PolarHBondContact O-N 2.9Å; L1043-L1046 PolarHBondContact O-N 3.03Å; L1046-R1048 VanDerWaalsContact C-N 3.29Å; L1046-R1048 PolarHBondContact O-N 2.71Å; L1046-L1049 PolarHBondContact O-N 3.4Å; L1046-N1050 WeakPolarHBondContact O-CB 3.31Å; L1046-N1050 VanDerWaalsContact O-CG 3.31Å; L1046-N1050 PolarHBondContact O-N 3.38Å; L1046-N1050 PolarHBondContact O-ND2 3.24Å
1047	A	95.3	Very high	92.7	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.7	-45.3	175.8	0	0	0	0	0	111.4	L1043 R1044 L1045 Y1051 A1059 N1062 Q1063 Y1091	L1043-A1047 WeakPolarHBondContact O-CB 3.37Å; L1043-A1047 PolarHBondContact O-N 3.3Å; R1044-A1047 PolarHBondContact O-N 2.95Å; L1045-A1047 VanDerWaalsContact C-N 3.34Å; L1045-A1047 PolarHBondContact O-N 3.11Å; A1047-Y1051 VanDerWaalsContact O-CB 3.28Å; A1047-Y1051 WeakPolarHBondContact O-CB 3.38Å; A1047-Y1051 PolarHBondContact O-N 3.44Å; A1047-A1059 WeakPolarHBondContact CB-O 3.45Å; A1047-A1059 VanDerWaalsContact O-CB 3.23Å; A1047-A1059 WeakPolarHBondContact O-CB 3.15Å; A1047-N1062 HydrophobicContact CB-CB 3.99Å; A1047-Q1063 HydrophobicContact CB-CB 3.91Å; A1047-Y1091 HydrophobicContact CB-CE2 3.81Å
1048	R	93.5	Very high	92.7	Very high	63 Å²	63	36 Å²	36	24%	0.238	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-45	175.1	-176.4	178.5	176.4	175.7	0.4	112.5	R1044 L1045 L1046 Y1051 I1052 Y1091 G1262 I1263 F1265	R1044-R1048 PolarHBondContact O-N 3.04Å; R1044-R1048 VanDerWaalsContact O-N 3.08Å; L1045-R1048 WeakPolarHBondContact O-CB 3.36Å; L1045-R1048 PolarHBondContact O-N 2.97Å; L1046-R1048 VanDerWaalsContact C-N 3.29Å; L1046-R1048 PolarHBondContact O-N 2.71Å; R1048-Y1051 WeakPolarHBondContact O-CB 3.39Å; R1048-Y1051 PolarHBondContact O-N 3.21Å; R1048-I1052 HydrophobicContact CG-CD1 3.99Å; R1048-I1052 VanDerWaalsContact O-CG1 3.29Å; R1048-I1052 WeakPolarHBondContact O-CG1 3.5Å; R1048-I1052 PolarHBondContact O-N 2.81Å; R1048-Y1091 VanDerWaalsContact CA-OH 3.26Å; R1048-Y1091 WeakPolarHBondContact CA-OH 3.28Å; R1048-Y1091 PolarHBondContact N-OH 3.19Å; R1048-G1262 PolarHBondContact NH2-O 3.35Å; R1048-I1263 HydrophobicContact CG-CD1 4.43Å; R1048-I1263 HydrophobicContact CG-CG2 4.45Å; R1048-I1263 PolarHBondContact NE-O 2.85Å; R1048-I1263 PolarHBondContact NH2-O 3.05Å; R1048-F1265 PolarHBondContact NH2-O 3.08Å
1049	L	93.3	Very high	92.7	Very high	1 Å²	1	34 Å²	34	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-47.4	-180	-69.2	172.9	0	0	0	111.6	V1009 L1014 C1018 L1045 L1046 Y1051 I1052 M1053	V1009-L1049 HydrophobicContact CG1-CD2 3.92Å; V1009-L1049 HydrophobicContact CG2-CD1 3.9Å; V1009-L1049 HydrophobicContact CG2-CD2 3.75Å; V1009-L1049 HydrophobicContact CG2-CG 4.39Å; L1014-L1049 HydrophobicContact CB-CD2 4.42Å; L1014-L1049 HydrophobicContact CD2-CD2 4.12Å; C1018-L1049 HydrophobicContact CB-CD1 3.99Å; L1045-L1049 HydrophobicContact CD1-CG 4.39Å; L1045-L1049 HydrophobicContact CG-CD1 4.25Å; L1045-L1049 VanDerWaalsContact O-CG 3.32Å; L1045-L1049 WeakPolarHBondContact O-CG 3.24Å; L1045-L1049 PolarHBondContact O-N 3.24Å; L1046-L1049 PolarHBondContact O-N 3.4Å; L1049-Y1051 VanDerWaalsContact C-N 3.27Å; L1049-Y1051 PolarHBondContact O-N 2.89Å; L1049-I1052 PolarHBondContact O-N 3.02Å; L1049-I1052 VanDerWaalsContact O-N 3.17Å; L1049-M1053 HydrophobicContact CB-CE 4.3Å; L1049-M1053 WeakPolarHBondContact O-CB 3.32Å; L1049-M1053 WeakPolarHBondContact O-CG 3.42Å; L1049-M1053 PolarHBondContact O-N 2.88Å
1050	N	93.7	Very high	92.7	Very high	17 Å²	17	34.4 Å²	34.4	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-38.9	177.4	-70.6	-19.1	0	0	0	111.3	L1046 M1053 G1054 D1055 E1058 A1059 N1062	L1046-N1050 WeakPolarHBondContact O-CB 3.31Å; L1046-N1050 VanDerWaalsContact O-CG 3.31Å; L1046-N1050 PolarHBondContact O-N 3.38Å; L1046-N1050 PolarHBondContact O-ND2 3.24Å; N1050-M1053 CarbonylContact O-C 3.39Å; N1050-M1053 PolarHBondContact O-N 2.69Å; N1050-M1053 VanDerWaalsContact OD1-CE 3.23Å; N1050-M1053 WeakPolarHBondContact OD1-CE 3.48Å; N1050-G1054 PolarHBondContact O-N 3.37Å; N1050-G1054 VanDerWaalsContact O-N 3.08Å; N1050-D1055 HydrophobicContact CB-CB 4.33Å; N1050-D1055 PolarHBondContact O-N 3.03Å; N1050-E1058 HydrophobicContact CB-CB 4.47Å; N1050-E1058 VanDerWaalsContact ND2-CG 3.25Å; N1050-E1058 WeakPolarHBondContact ND2-CG 3.41Å; N1050-A1059 HydrophobicContact CB-CB 4.29Å; N1050-N1062 PolarHBondContact ND2-ND2 3.02Å
1051	Y	92.9	Very high	92.7	Very high	13 Å²	13	35.8 Å²	35.8	5%	0.051	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-47.6	173.7	-178.3	-95.5	0	0	0	112.4	A1047 R1048 L1049 M1053 G1054 H1056 Y1091 A1094 L1254 N1258 I1263	A1047-Y1051 VanDerWaalsContact O-CB 3.28Å; A1047-Y1051 WeakPolarHBondContact O-CB 3.38Å; A1047-Y1051 PolarHBondContact O-N 3.44Å; R1048-Y1051 WeakPolarHBondContact O-CB 3.39Å; R1048-Y1051 PolarHBondContact O-N 3.21Å; L1049-Y1051 VanDerWaalsContact C-N 3.27Å; L1049-Y1051 PolarHBondContact O-N 2.89Å; Y1051-M1053 VanDerWaalsContact C-N 3.29Å; Y1051-M1053 PolarHBondContact O-N 3.06Å; Y1051-G1054 PolarHBondContact O-N 2.57Å; Y1051-G1054 VanDerWaalsContact O-N 3.14Å; Y1051-H1056 AromaticContact CD2-CE1 3.83Å; Y1051-H1056 AromaticContact CD2-ND1 3.28Å; Y1051-H1056 VanDerWaalsContact CD2-ND1 3.28Å; Y1051-H1056 WeakPolarHBondContact CD2-ND1 3.49Å; Y1051-H1056 AromaticContact CE2-CE1 3.56Å; Y1051-H1056 AromaticContact CE2-ND1 3.35Å; Y1051-H1056 WeakPolarHBondContact CE2-ND1 3.34Å; Y1051-Y1091 HydrophobicContact CD1-CE1 4.11Å; Y1051-Y1091 AromaticContact CD2-CD1 3.44Å; Y1051-Y1091 HydrophobicContact CD2-CD1 3.44Å; Y1051-Y1091 VanDerWaalsContact CD2-CD1 3.44Å; Y1051-Y1091 AromaticContact CD2-CE1 3.6Å; Y1051-Y1091 HydrophobicContact CD2-CE1 3.6Å; Y1051-Y1091 AromaticContact CE2-CD1 3.99Å; Y1051-Y1091 HydrophobicContact CE2-CD1 3.99Å; Y1051-Y1091 HydrophobicContact CE2-CE1 4.34Å; Y1051-Y1091 AromaticContact CG-CD1 3.86Å; Y1051-Y1091 HydrophobicContact CG-CD1 3.86Å; Y1051-Y1091 AromaticContact CG-CE1 3.48Å; Y1051-Y1091 HydrophobicContact CG-CE1 3.48Å; Y1051-Y1091 VanDerWaalsContact CG-CE1 3.48Å; Y1051-A1094 HydrophobicContact CE2-CB 3.65Å; Y1051-L1254 WeakPolarHBondContact OH-CD1 3.44Å; Y1051-N1258 VanDerWaalsContact CE1-OD1 3.32Å; Y1051-N1258 WeakPolarHBondContact CE1-OD1 3.23Å; Y1051-N1258 PolarHBondContact OH-ND2 2.69Å; Y1051-N1258 PolarHBondContact OH-OD1 3.33Å; Y1051-I1263 HydrophobicContact CD1-CG2 3.57Å; Y1051-I1263 HydrophobicContact CE1-CG2 3.82Å
1052	I	91	Very high	92.8	Very high	57 Å²	57	35.1 Å²	35.1	29%	0.292	19%	0.188	S	C	.	.	H	α-helix	trans	-65.2	-34.3	178.3	-65.9	165.2	0	0	0	111.2	L1014 R1048 L1049 G1054 I1263	L1014-I1052 HydrophobicContact CD1-CG2 3.6Å; R1048-I1052 HydrophobicContact CG-CD1 3.99Å; R1048-I1052 VanDerWaalsContact O-CG1 3.29Å; R1048-I1052 WeakPolarHBondContact O-CG1 3.5Å; R1048-I1052 PolarHBondContact O-N 2.81Å; L1049-I1052 PolarHBondContact O-N 3.02Å; L1049-I1052 VanDerWaalsContact O-N 3.17Å; I1052-G1054 PolarHBondContact O-N 2.83Å; I1052-I1263 WeakPolarHBondContact CD1-O 3.38Å; I1052-I1263 HydrophobicContact CG1-CG2 4.13Å
1053	M	89.8	Confident	92.8	Very high	80 Å²	80	35.1 Å²	35.1	39%	0.394	19%	0.188	S	C	.	.	H	α-helix	trans	-76.8	-6.7	176.4	-67.8	-173.1	-64.1	0	0	113.8	K1015 C1018 L1049 N1050 Y1051	K1015-M1053 HydrophobicContact CG-SD 4.31Å; C1018-M1053 HydrophobicContact CB-CE 4.18Å; L1049-M1053 HydrophobicContact CB-CE 4.3Å; L1049-M1053 WeakPolarHBondContact O-CB 3.32Å; L1049-M1053 WeakPolarHBondContact O-CG 3.42Å; L1049-M1053 PolarHBondContact O-N 2.88Å; N1050-M1053 CarbonylContact O-C 3.39Å; N1050-M1053 PolarHBondContact O-N 2.69Å; N1050-M1053 VanDerWaalsContact OD1-CE 3.23Å; N1050-M1053 WeakPolarHBondContact OD1-CE 3.48Å; Y1051-M1053 VanDerWaalsContact C-N 3.29Å; Y1051-M1053 PolarHBondContact O-N 3.06Å
1054	G	89.1	Confident	92.8	Very high	48 Å²	48	36.3 Å²	36.3	50%	0.495	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	4.4	177.1	0	0	0	0	0	115.3	N1050 Y1051 I1052 H1056	N1050-G1054 PolarHBondContact O-N 3.37Å; N1050-G1054 VanDerWaalsContact O-N 3.08Å; Y1051-G1054 PolarHBondContact O-N 2.57Å; Y1051-G1054 VanDerWaalsContact O-N 3.14Å; I1052-G1054 PolarHBondContact O-N 2.83Å; G1054-H1056 PolarHBondContact O-N 3.3Å
1055	D	89.8	Confident	92.8	Very high	76 Å²	76	35.2 Å²	35.2	41%	0.406	19%	0.191	S	C	.	.			trans	-90.3	76.9	174.4	-164	-19.4	0	0	0	110.8	N1050 P1057 E1058 A1059	N1050-D1055 HydrophobicContact CB-CB 4.33Å; N1050-D1055 PolarHBondContact O-N 3.03Å; D1055-P1057 WeakPolarHBondContact OD1-CD 3.27Å; D1055-E1058 HydrophobicContact CB-CB 4.33Å; D1055-E1058 VanDerWaalsContact CG-CB 3.46Å; D1055-E1058 WeakPolarHBondContact OD1-CB 3.49Å; D1055-E1058 PolarHBondContact OD1-N 3.46Å; D1055-E1058 VanDerWaalsContact OD1-N 3.13Å; D1055-A1059 WeakPolarHBondContact O-CB 3.48Å; D1055-A1059 PolarHBondContact O-N 3.18Å
1056	H	89.1	Confident	92.9	Very high	59 Å²	59	34 Å²	34	27%	0.273	19%	0.185	S	C	.	.	H	α-helix	trans	-65.7	-35.8	-179.6	-56.2	-44.9	0	0	0	114.9	Y1051 G1054 L1060 N1095	Y1051-H1056 AromaticContact CD2-CE1 3.83Å; Y1051-H1056 AromaticContact CD2-ND1 3.28Å; Y1051-H1056 VanDerWaalsContact CD2-ND1 3.28Å; Y1051-H1056 WeakPolarHBondContact CD2-ND1 3.49Å; Y1051-H1056 AromaticContact CE2-CE1 3.56Å; Y1051-H1056 AromaticContact CE2-ND1 3.35Å; Y1051-H1056 WeakPolarHBondContact CE2-ND1 3.34Å; G1054-H1056 PolarHBondContact O-N 3.3Å; H1056-L1060 WeakPolarHBondContact O-CB 3.37Å; H1056-L1060 PolarHBondContact O-N 3.43Å; H1056-L1060 VanDerWaalsContact O-N 3.08Å; H1056-N1095 PolarHBondContact O-ND2 2.86Å
1057	P	90	Very high	92.9	Very high	85 Å²	85	34 Å²	34	55%	0.552	19%	0.185	S	C	*	.	H	α-helix	trans	-62.3	-46.3	173.6	-25.3	35.6	0	0	0	112.8	D1055 A1059 L1060 S1061	D1055-P1057 WeakPolarHBondContact OD1-CD 3.27Å; P1057-A1059 VanDerWaalsContact C-N 3.34Å; P1057-A1059 PolarHBondContact O-N 3.33Å; P1057-L1060 WeakPolarHBondContact O-CB 3.26Å; P1057-L1060 PolarHBondContact O-N 3.45Å; P1057-S1061 PolarHBondContact O-N 2.86Å
1058	E	91	Very high	92.9	Very high	73 Å²	73	34.1 Å²	34.1	34%	0.341	19%	0.185	S	C	.	.	H	α-helix	trans	-69.7	-34.6	-179.8	-171.4	58	-149.8	0	0	111.6	N1050 D1055 L1060 S1061 N1062	N1050-E1058 HydrophobicContact CB-CB 4.47Å; N1050-E1058 VanDerWaalsContact ND2-CG 3.25Å; N1050-E1058 WeakPolarHBondContact ND2-CG 3.41Å; D1055-E1058 HydrophobicContact CB-CB 4.33Å; D1055-E1058 VanDerWaalsContact CG-CB 3.46Å; D1055-E1058 WeakPolarHBondContact OD1-CB 3.49Å; D1055-E1058 PolarHBondContact OD1-N 3.46Å; D1055-E1058 VanDerWaalsContact OD1-N 3.13Å; E1058-L1060 VanDerWaalsContact C-N 3.34Å; E1058-L1060 PolarHBondContact O-N 2.89Å; E1058-S1061 PolarHBondContact O-N 2.81Å; E1058-N1062 PolarHBondContact O-N 3Å; E1058-N1062 PolarHBondContact O-ND2 3.24Å; E1058-N1062 PolarHBondContact OE1-ND2 2.71Å; E1058-N1062 PolarHBondContact OE1-OD1 2.99Å
1059	A	93.6	Very high	92.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.8	-44.9	171.4	0	0	0	0	0	112.5	A1047 N1050 D1055 P1057 Q1063	A1047-A1059 WeakPolarHBondContact CB-O 3.45Å; A1047-A1059 VanDerWaalsContact O-CB 3.23Å; A1047-A1059 WeakPolarHBondContact O-CB 3.15Å; N1050-A1059 HydrophobicContact CB-CB 4.29Å; D1055-A1059 WeakPolarHBondContact O-CB 3.48Å; D1055-A1059 PolarHBondContact O-N 3.18Å; P1057-A1059 VanDerWaalsContact C-N 3.34Å; P1057-A1059 PolarHBondContact O-N 3.33Å; A1059-Q1063 WeakPolarHBondContact O-CB 3.3Å; A1059-Q1063 PolarHBondContact O-N 2.88Å
1060	L	93.4	Very high	93.1	Very high	11 Å²	11	31.1 Å²	31.1	6%	0.058	17%	0.174	C	C	.	.	H	α-helix	trans	-62.9	-46.6	177.6	-176.5	67.8	0	0	0	111.4	L160 H1056 P1057 E1058 Q1063 Q1064 L1088	L160-L1060 HydrophobicContact CD2-CD1 4.34Å; L160-L1060 WeakPolarHBondContact O-CD2 3.47Å; H1056-L1060 WeakPolarHBondContact O-CB 3.37Å; H1056-L1060 PolarHBondContact O-N 3.43Å; H1056-L1060 VanDerWaalsContact O-N 3.08Å; P1057-L1060 WeakPolarHBondContact O-CB 3.26Å; P1057-L1060 PolarHBondContact O-N 3.45Å; E1058-L1060 VanDerWaalsContact C-N 3.34Å; E1058-L1060 PolarHBondContact O-N 2.89Å; L1060-Q1063 PolarHBondContact O-N 2.85Å; L1060-Q1064 WeakPolarHBondContact O-CB 3.5Å; L1060-Q1064 PolarHBondContact O-N 2.75Å; L1060-L1088 HydrophobicContact CD1-CD1 3.69Å
1061	S	92.6	Very high	93.1	Very high	36 Å²	36	30.4 Å²	30.4	25%	0.252	17%	0.17	S	C	.	.	H	α-helix	trans	-58.5	-50.1	178.5	177.9	0	0	0	0	112.1	P1057 E1058 Q1063 Q1064 K1065	P1057-S1061 PolarHBondContact O-N 2.86Å; E1058-S1061 PolarHBondContact O-N 2.81Å; S1061-Q1063 PolarHBondContact O-N 3.11Å; S1061-Q1064 PolarHBondContact O-N 2.85Å; S1061-K1065 WeakPolarHBondContact O-CG 3.49Å; S1061-K1065 PolarHBondContact O-N 3.01Å; S1061-K1065 VanDerWaalsContact O-N 3.08Å
1062	N	94.9	Very high	93.2	Very high	7 Å²	7	30.1 Å²	30.1	4%	0.037	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-37.2	-179.7	-72.3	-38	0	0	0	112.6	L1043 A1047 N1050 E1058 K1065 A1066	L1043-N1062 HydrophobicContact CD2-CB 4.3Å; A1047-N1062 HydrophobicContact CB-CB 3.99Å; N1050-N1062 PolarHBondContact ND2-ND2 3.02Å; E1058-N1062 PolarHBondContact O-N 3Å; E1058-N1062 PolarHBondContact O-ND2 3.24Å; E1058-N1062 PolarHBondContact OE1-ND2 2.71Å; E1058-N1062 PolarHBondContact OE1-OD1 2.99Å; N1062-K1065 PolarHBondContact O-N 2.69Å; N1062-K1065 PolarHBondContact OD1-NZ 2.91Å; N1062-A1066 PolarHBondContact O-N 3.42Å
1063	Q	96.3	Very high	93.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-69.6	-35.8	175.7	-168.1	60	42.9	0	0	112.5	A1047 A1059 L1060 S1061 A1066 V1067 E1084 H1087 L1088 Y1091	A1047-Q1063 HydrophobicContact CB-CB 3.91Å; A1059-Q1063 WeakPolarHBondContact O-CB 3.3Å; A1059-Q1063 PolarHBondContact O-N 2.88Å; L1060-Q1063 PolarHBondContact O-N 2.85Å; S1061-Q1063 PolarHBondContact O-N 3.11Å; Q1063-A1066 WeakPolarHBondContact O-CB 3.36Å; Q1063-A1066 PolarHBondContact O-N 3.38Å; Q1063-V1067 WeakPolarHBondContact O-CG2 3.49Å; Q1063-V1067 PolarHBondContact O-N 2.9Å; Q1063-E1084 PolarHBondContact NE2-O 3.11Å; Q1063-E1084 PolarHBondContact NE2-OE2 3.32Å; Q1063-H1087 HydrophobicContact CG-CB 4.1Å; Q1063-L1088 HydrophobicContact CB-CD1 4.06Å; Q1063-L1088 HydrophobicContact CG-CB 3.82Å; Q1063-L1088 HydrophobicContact CG-CD1 4.01Å; Q1063-Y1091 HydrophobicContact CB-CD2 3.52Å; Q1063-Y1091 HydrophobicContact CB-CE2 3.75Å; Q1063-Y1091 HydrophobicContact CG-CD2 3.67Å; Q1063-Y1091 HydrophobicContact CG-CE2 3.76Å
1064	Q	95.1	Very high	93.6	Very high	32 Å²	32	27.3 Å²	27.3	15%	0.15	16%	0.157	C	C	.	.	H	α-helix	trans	-60.6	-46.3	173.6	177.7	-179.6	4.7	0	0	111	L152 L160 L1060 S1061 A1066 V1067 L1068 L1088	L152-Q1064 HydrophobicContact CD2-CG 3.84Å; L160-Q1064 HydrophobicContact CB-CG 4.43Å; L160-Q1064 HydrophobicContact CD1-CG 3.87Å; L1060-Q1064 WeakPolarHBondContact O-CB 3.5Å; L1060-Q1064 PolarHBondContact O-N 2.75Å; S1061-Q1064 PolarHBondContact O-N 2.85Å; Q1064-A1066 VanDerWaalsContact C-N 3.31Å; Q1064-A1066 PolarHBondContact O-N 3.06Å; Q1064-V1067 PolarHBondContact O-N 3.34Å; Q1064-L1068 HydrophobicContact CG-CD1 4.31Å; Q1064-L1068 WeakPolarHBondContact O-CG 2.95Å; Q1064-L1068 PolarHBondContact O-N 2.88Å; Q1064-L1068 VanDerWaalsContact O-N 3.1Å; Q1064-L1088 HydrophobicContact CB-CD1 4.34Å
1065	K	94.5	Very high	93.8	Very high	57 Å²	57	25.6 Å²	25.6	25%	0.248	14%	0.139	C	C	.	.	H	α-helix	trans	-59.3	-41.8	174.9	-68.4	170.8	-165.4	164.9	0	111.6	F304 L1043 S1061 N1062 M1069	F304-K1065 HydrophobicContact CD2-CB 4.37Å; F304-K1065 HydrophobicContact CE2-CB 3.88Å; F304-K1065 HydrophobicContact CE2-CG 4.13Å; L1043-K1065 HydrophobicContact CD1-CB 3.73Å; L1043-K1065 HydrophobicContact CD2-CB 4.48Å; L1043-K1065 HydrophobicContact CD2-CD 4.28Å; S1061-K1065 WeakPolarHBondContact O-CG 3.49Å; S1061-K1065 PolarHBondContact O-N 3.01Å; S1061-K1065 VanDerWaalsContact O-N 3.08Å; N1062-K1065 PolarHBondContact O-N 2.69Å; N1062-K1065 PolarHBondContact OD1-NZ 2.91Å; K1065-M1069 WeakPolarHBondContact O-CB 3.4Å; K1065-M1069 PolarHBondContact O-N 2.95Å
1066	A	96	Very high	94	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.8	-45.4	177	0	0	0	0	0	112.4	C1040 L1043 N1062 Q1063 Q1064 M1069 S1070	C1040-A1066 PolarHBondContact SG-O 3.41Å; C1040-A1066 VanDerWaalsContact SG-O 3.36Å; L1043-A1066 HydrophobicContact CB-CB 4.03Å; N1062-A1066 PolarHBondContact O-N 3.42Å; Q1063-A1066 WeakPolarHBondContact O-CB 3.36Å; Q1063-A1066 PolarHBondContact O-N 3.38Å; Q1064-A1066 VanDerWaalsContact C-N 3.31Å; Q1064-A1066 PolarHBondContact O-N 3.06Å; A1066-M1069 PolarHBondContact O-N 2.83Å; A1066-S1070 WeakPolarHBondContact O-CB 3.29Å; A1066-S1070 PolarHBondContact O-N 3.03Å
1067	V	96.2	Very high	94.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.9	-49.2	177.6	176.6	0	0	0	0	111.4	L152 Q1063 Q1064 M1069 S1070 E1071 E1084 Y1085 L1088	L152-V1067 HydrophobicContact CB-CG1 4.27Å; L152-V1067 HydrophobicContact CD1-CG1 3.95Å; L152-V1067 HydrophobicContact CD2-CB 3.91Å; L152-V1067 HydrophobicContact CD2-CG1 3.87Å; L152-V1067 HydrophobicContact CG-CG1 4.24Å; Q1063-V1067 WeakPolarHBondContact O-CG2 3.49Å; Q1063-V1067 PolarHBondContact O-N 2.9Å; Q1064-V1067 PolarHBondContact O-N 3.34Å; V1067-M1069 VanDerWaalsContact C-N 3.3Å; V1067-M1069 PolarHBondContact O-N 3.41Å; V1067-S1070 PolarHBondContact O-N 2.96Å; V1067-E1071 WeakPolarHBondContact O-CG 3.19Å; V1067-E1071 PolarHBondContact O-N 3.31Å; V1067-E1084 HydrophobicContact CB-CB 4.38Å; V1067-E1084 HydrophobicContact CG2-CB 3.57Å; V1067-E1084 VanDerWaalsContact CG2-O 3.29Å; V1067-E1084 WeakPolarHBondContact CG2-O 3.27Å; V1067-Y1085 HydrophobicContact CG1-CD1 4.19Å; V1067-Y1085 HydrophobicContact CG1-CE1 3.92Å; V1067-Y1085 HydrophobicContact CG1-CE2 4.27Å; V1067-Y1085 HydrophobicContact CG1-CG 4.49Å; V1067-L1088 HydrophobicContact CB-CD2 4.45Å; V1067-L1088 HydrophobicContact CG2-CB 3.98Å; V1067-L1088 HydrophobicContact CG2-CD2 3.92Å
1068	L	94.4	Very high	94.4	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-57	-45.4	179.4	-72.7	170.6	0	0	0	111.8	S150 L152 H302 F304 E305 Q1064 R1072	S150-L1068 WeakPolarHBondContact OG-CD2 3.3Å; L152-L1068 HydrophobicContact CB-CD2 3.74Å; L152-L1068 HydrophobicContact CB-CG 4.45Å; L152-L1068 HydrophobicContact CD2-CD1 4.48Å; L152-L1068 HydrophobicContact CD2-CD2 3.9Å; L152-L1068 HydrophobicContact CD2-CG 3.72Å; L152-L1068 HydrophobicContact CG-CD2 4.37Å; H302-L1068 HydrophobicContact CB-CD1 3.55Å; H302-L1068 WeakPolarHBondContact ND1-CD1 3.33Å; F304-L1068 HydrophobicContact CB-CB 4.24Å; E305-L1068 HydrophobicContact CG-CD2 3.78Å; Q1064-L1068 HydrophobicContact CG-CD1 4.31Å; Q1064-L1068 WeakPolarHBondContact O-CG 2.95Å; Q1064-L1068 PolarHBondContact O-N 2.88Å; Q1064-L1068 VanDerWaalsContact O-N 3.1Å; L1068-R1072 VanDerWaalsContact O-CG 3.24Å; L1068-R1072 WeakPolarHBondContact O-CG 3.46Å; L1068-R1072 PolarHBondContact O-N 3.02Å; L1068-R1072 VanDerWaalsContact O-N 3.16Å
1069	M	94.9	Very high	94.6	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-69.9	-37.5	179.7	-176.1	160.4	43.1	0	0	112.2	M1035 H1036 I1039 C1040 L1043 K1065 A1066 V1067 R1072 V1073	M1035-M1069 HydrophobicContact CG-CG 4.13Å; M1035-M1069 HydrophobicContact CG-SD 4.48Å; M1035-M1069 HydrophobicContact SD-CB 4.36Å; M1035-M1069 HydrophobicContact SD-CG 3.96Å; H1036-M1069 PolarHBondContact N-SD 2.63Å; H1036-M1069 VanDerWaalsContact N-SD 3.41Å; I1039-M1069 HydrophobicContact CB-CE 3.74Å; I1039-M1069 HydrophobicContact CB-SD 3.89Å; I1039-M1069 HydrophobicContact CG2-CE 3.49Å; I1039-M1069 VanDerWaalsContact CG2-CE 3.49Å; I1039-M1069 HydrophobicContact CG2-SD 3.95Å; C1040-M1069 VanDerWaalsContact CA-CE 3.47Å; C1040-M1069 HydrophobicContact CB-CE 3.84Å; C1040-M1069 HydrophobicContact CB-CG 4.47Å; L1043-M1069 HydrophobicContact CD1-CE 3.43Å; L1043-M1069 VanDerWaalsContact CD1-CE 3.43Å; K1065-M1069 WeakPolarHBondContact O-CB 3.4Å; K1065-M1069 PolarHBondContact O-N 2.95Å; A1066-M1069 PolarHBondContact O-N 2.83Å; V1067-M1069 VanDerWaalsContact C-N 3.3Å; V1067-M1069 PolarHBondContact O-N 3.41Å; M1069-R1072 PolarHBondContact O-N 2.85Å; M1069-V1073 HydrophobicContact CG-CG2 3.96Å; M1069-V1073 WeakPolarHBondContact O-CB 3.34Å; M1069-V1073 WeakPolarHBondContact O-CG2 3.5Å; M1069-V1073 PolarHBondContact O-N 2.86Å
1070	S	96.2	Very high	94.6	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.014	9%	0.09	C	C	.	.	H	α-helix	trans	-62.6	-43.8	175.4	-167.2	0	0	0	0	111.7	A1066 V1067 R1072 L1074 G1075 T1081	A1066-S1070 WeakPolarHBondContact O-CB 3.29Å; A1066-S1070 PolarHBondContact O-N 3.03Å; V1067-S1070 PolarHBondContact O-N 2.96Å; S1070-R1072 VanDerWaalsContact C-N 3.3Å; S1070-R1072 PolarHBondContact O-N 2.79Å; S1070-L1074 WeakPolarHBondContact O-CB 3.44Å; S1070-L1074 PolarHBondContact O-N 3.44Å; S1070-G1075 PolarHBondContact O-N 3.19Å; S1070-T1081 PolarHBondContact O-OG1 3.26Å; S1070-T1081 WeakPolarHBondContact OG-CA 3.44Å; S1070-T1081 PolarHBondContact OG-N 2.94Å; S1070-T1081 PolarHBondContact OG-OG1 3.17Å
1071	E	95.3	Very high	94.8	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-57	-45.8	173.8	-71.7	-167.1	131.2	0	0	111.6	L149 S150 F151 L152 V1067 G1075 I1076 T1081 Y1085	L149-E1071 CarbonylContact O-C 3.39Å; S150-E1071 VanDerWaalsContact CA-OE2 3.23Å; S150-E1071 WeakPolarHBondContact CA-OE2 3.28Å; S150-E1071 WeakPolarHBondContact CB-OE2 3.35Å; S150-E1071 PolarHBondContact OG-OE2 3.06Å; F151-E1071 PolarHBondContact N-OE1 3.32Å; F151-E1071 PolarHBondContact N-OE2 3.16Å; L152-E1071 PolarHBondContact N-OE2 3.46Å; L152-E1071 VanDerWaalsContact N-OE2 3.16Å; V1067-E1071 WeakPolarHBondContact O-CG 3.19Å; V1067-E1071 PolarHBondContact O-N 3.31Å; E1071-G1075 CarbonylContact O-C 3.6Å; E1071-G1075 WeakPolarHBondContact O-CA 2.97Å; E1071-G1075 PolarHBondContact O-N 2.97Å; E1071-I1076 HydrophobicContact CB-CG2 4.24Å; E1071-I1076 HydrophobicContact CG-CG2 4.28Å; E1071-T1081 HydrophobicContact CG-CG2 3.7Å; E1071-Y1085 PolarHBondContact OE1-OH 3.15Å
1072	R	94.1	Very high	94.9	Very high	8 Å²	8	14.7 Å²	14.7	3%	0.03	8%	0.076	C	C	.	.	H	α-helix	trans	-71.7	-44.8	-175.3	-68.9	-74.5	-62.9	-171.5	1.5	112.6	S148 E305 I307 T309 V313 M1035 L1068 M1069 S1070	S148-R1072 WeakPolarHBondContact CB-O 3.36Å; S148-R1072 PolarHBondContact O-NH1 3.48Å; S148-R1072 VanDerWaalsContact OG-C 3.32Å; S148-R1072 WeakPolarHBondContact OG-CA 3.48Å; S148-R1072 WeakPolarHBondContact OG-CB 3.25Å; S148-R1072 VanDerWaalsContact OG-CD 3.3Å; S148-R1072 WeakPolarHBondContact OG-CD 3.32Å; S148-R1072 PolarHBondContact OG-NE 3.13Å; S148-R1072 PolarHBondContact OG-O 3.24Å; E305-R1072 PolarHBondContact O-NH1 2.93Å; I307-R1072 PolarHBondContact O-NH2 2.98Å; T309-R1072 HydrophobicContact CG2-CB 3.96Å; T309-R1072 WeakPolarHBondContact CG2-O 3.41Å; V313-R1072 WeakPolarHBondContact CG2-O 3.21Å; M1035-R1072 HydrophobicContact CE-CB 4.01Å; M1035-R1072 HydrophobicContact CE-CG 4.21Å; M1035-R1072 HydrophobicContact SD-CB 3.62Å; M1035-R1072 HydrophobicContact SD-CG 4.19Å; L1068-R1072 VanDerWaalsContact O-CG 3.24Å; L1068-R1072 WeakPolarHBondContact O-CG 3.46Å; L1068-R1072 PolarHBondContact O-N 3.02Å; L1068-R1072 VanDerWaalsContact O-N 3.16Å; M1069-R1072 PolarHBondContact O-N 2.85Å; S1070-R1072 VanDerWaalsContact C-N 3.3Å; S1070-R1072 PolarHBondContact O-N 2.79Å
1073	V	94.6	Very high	94.9	Very high	30 Å²	30	16.5 Å²	16.5	18%	0.182	8%	0.084	C	C	.	.	H	α-helix	trans	-89.6	-28	-171.5	-179.6	0	0	0	0	113.2	T309 V313 M1035 V1037 M1069	T309-V1073 HydrophobicContact CG2-CG2 4.34Å; V313-V1073 WeakPolarHBondContact CG2-O 3.44Å; M1035-V1073 HydrophobicContact CG-CG2 3.28Å; M1035-V1073 HydrophobicContact SD-CG2 4.02Å; V1037-V1073 HydrophobicContact CB-CG1 4.21Å; M1069-V1073 HydrophobicContact CG-CG2 3.96Å; M1069-V1073 WeakPolarHBondContact O-CB 3.34Å; M1069-V1073 WeakPolarHBondContact O-CG2 3.5Å; M1069-V1073 PolarHBondContact O-N 2.86Å
1074	L	94.2	Very high	94.9	Very high	48 Å²	48	16.6 Å²	16.6	25%	0.251	8%	0.084	S	C	.	.	H	α-helix	trans	-113.7	-25.6	-177.2	-57.9	176.6	0	0	0	113.3	V1037 S1070 H1078 N1080	V1037-L1074 HydrophobicContact CB-CD2 4.5Å; V1037-L1074 HydrophobicContact CG2-CD1 4.16Å; V1037-L1074 HydrophobicContact CG2-CD2 4.05Å; V1037-L1074 HydrophobicContact CG2-CG 4.42Å; S1070-L1074 WeakPolarHBondContact O-CB 3.44Å; S1070-L1074 PolarHBondContact O-N 3.44Å; L1074-H1078 HydrophobicContact CB-CB 3.76Å; L1074-N1080 HydrophobicContact CD1-CB 3.91Å
1075	G	93.8	Very high	95	Very high	11 Å²	11	15 Å²	15	11%	0.113	8%	0.077	C	C	.	.			trans	110	156	-173.3	0	0	0	0	0	112.9	S1070 E1071 E1077 H1078 T1081	S1070-G1075 PolarHBondContact O-N 3.19Å; E1071-G1075 CarbonylContact O-C 3.6Å; E1071-G1075 WeakPolarHBondContact O-CA 2.97Å; E1071-G1075 PolarHBondContact O-N 2.97Å; G1075-E1077 VanDerWaalsContact C-N 3.28Å; G1075-E1077 PolarHBondContact O-N 3.34Å; G1075-H1078 PolarHBondContact O-N 2.95Å; G1075-T1081 PolarHBondContact O-OG1 3.41Å
1076	I	93.6	Very high	95.1	Very high	4 Å²	4	12.5 Å²	12.5	2%	0.021	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.4	-173.5	61.3	176.4	0	0	0	113.3	L149 F151 E1071 L1111	L149-I1076 HydrophobicContact CB-CG2 3.92Å; L149-I1076 HydrophobicContact CD1-CD1 4.48Å; F151-I1076 HydrophobicContact CD2-CB 4.47Å; F151-I1076 HydrophobicContact CD2-CD1 3.88Å; F151-I1076 HydrophobicContact CD2-CG2 3.95Å; F151-I1076 HydrophobicContact CE2-CD1 3.42Å; F151-I1076 VanDerWaalsContact CE2-CD1 3.42Å; F151-I1076 HydrophobicContact CE2-CG2 4.21Å; E1071-I1076 HydrophobicContact CB-CG2 4.24Å; E1071-I1076 HydrophobicContact CG-CG2 4.28Å; I1076-L1111 VanDerWaalsContact O-CD1 3.28Å; I1076-L1111 WeakPolarHBondContact O-CD1 3.28Å
1077	E	93.3	Very high	95	Very high	16 Å²	16	14.5 Å²	14.5	8%	0.075	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	14.4	-177.6	76.3	-77.7	-167	0	0	113.1	W316 R951 G1075 L1111 V1115	W316-E1077 PolarHBondContact NE1-OE1 3.39Å; R951-E1077 PolarHBondContact NH2-O 3.28Å; R951-E1077 VanDerWaalsContact NH2-O 3.08Å; G1075-E1077 VanDerWaalsContact C-N 3.28Å; G1075-E1077 PolarHBondContact O-N 3.34Å; E1077-L1111 HydrophobicContact CB-CD2 4.01Å; E1077-V1115 WeakPolarHBondContact O-CG2 3.47Å
1078	H	94.9	Very high	95	Very high	35 Å²	35	14.5 Å²	14.5	16%	0.162	8%	0.076	C	C	.	.			trans	-69.6	140	175.6	-171.4	-85	0	0	0	110.4	L1074 G1075 N1080 T1081 I1082	L1074-H1078 HydrophobicContact CB-CB 3.76Å; G1075-H1078 PolarHBondContact O-N 2.95Å; H1078-N1080 VanDerWaalsContact C-N 3.3Å; H1078-N1080 PolarHBondContact ND1-N 2.94Å; H1078-N1080 VanDerWaalsContact ND1-N 3.13Å; H1078-N1080 PolarHBondContact O-N 2.91Å; H1078-T1081 WeakPolarHBondContact O-CA 3.36Å; H1078-T1081 VanDerWaalsContact O-CB 3.29Å; H1078-T1081 WeakPolarHBondContact O-CB 3.36Å; H1078-T1081 PolarHBondContact O-N 3.21Å; H1078-I1082 PolarHBondContact O-N 3.04Å; H1078-I1082 VanDerWaalsContact O-N 3.13Å
1079	P	94.6	Very high	95.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-50	-43.5	179.5	-32.8	38.4	0	0	0	115.1	M790 D791 T794 T1081 I1082 Q1083	M790-P1079 HydrophobicContact CB-CB 3.85Å; M790-P1079 HydrophobicContact CB-CG 3.89Å; M790-P1079 HydrophobicContact CE-CB 3.53Å; M790-P1079 HydrophobicContact CG-CB 4.28Å; M790-P1079 HydrophobicContact SD-CB 3.8Å; D791-P1079 HydrophobicContact CB-CG 4.37Å; T794-P1079 HydrophobicContact CG2-CB 4.03Å; T794-P1079 HydrophobicContact CG2-CG 3.84Å; P1079-T1081 PolarHBondContact O-N 2.68Å; P1079-I1082 WeakPolarHBondContact O-CB 3.35Å; P1079-I1082 PolarHBondContact O-N 3.33Å; P1079-Q1083 PolarHBondContact O-N 3.23Å; P1079-Q1083 VanDerWaalsContact O-N 3.16Å
1080	N	94.3	Very high	95.1	Very high	54 Å²	54	14.7 Å²	14.7	29%	0.289	8%	0.077	S	C	.	.	H	α-helix	trans	-60.5	-42.6	174.5	-64	-10.8	0	0	0	112.1	L1074 H1078 I1082 Q1083 E1084	L1074-N1080 HydrophobicContact CD1-CB 3.91Å; H1078-N1080 VanDerWaalsContact C-N 3.3Å; H1078-N1080 PolarHBondContact ND1-N 2.94Å; H1078-N1080 VanDerWaalsContact ND1-N 3.13Å; H1078-N1080 PolarHBondContact O-N 2.91Å; N1080-I1082 VanDerWaalsContact C-N 3.27Å; N1080-I1082 PolarHBondContact O-N 3Å; N1080-Q1083 WeakPolarHBondContact O-CB 3.19Å; N1080-Q1083 PolarHBondContact O-N 2.98Å; N1080-Q1083 VanDerWaalsContact O-N 3.1Å; N1080-E1084 WeakPolarHBondContact O-CG 3.4Å; N1080-E1084 PolarHBondContact O-N 2.83Å
1081	T	96.3	Very high	95	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.7	-38.9	177	-53.5	0	0	0	0	111.4	S1070 E1071 G1075 H1078 P1079 E1084 Y1085	S1070-T1081 PolarHBondContact O-OG1 3.26Å; S1070-T1081 WeakPolarHBondContact OG-CA 3.44Å; S1070-T1081 PolarHBondContact OG-N 2.94Å; S1070-T1081 PolarHBondContact OG-OG1 3.17Å; E1071-T1081 HydrophobicContact CG-CG2 3.7Å; G1075-T1081 PolarHBondContact O-OG1 3.41Å; H1078-T1081 WeakPolarHBondContact O-CA 3.36Å; H1078-T1081 VanDerWaalsContact O-CB 3.29Å; H1078-T1081 WeakPolarHBondContact O-CB 3.36Å; H1078-T1081 PolarHBondContact O-N 3.21Å; P1079-T1081 PolarHBondContact O-N 2.68Å; T1081-E1084 PolarHBondContact O-N 3.44Å; T1081-Y1085 HydrophobicContact CG2-CD2 4.08Å; T1081-Y1085 HydrophobicContact CG2-CE2 3.83Å; T1081-Y1085 WeakPolarHBondContact O-CD2 3.24Å; T1081-Y1085 PolarHBondContact O-N 3.27Å
1082	I	96.4	Very high	94.9	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.01	8%	0.077	C	C	.	.	H	α-helix	trans	-61.8	-43.6	175.6	-59.7	173.1	0	0	0	110.8	H1078 P1079 N1080 Y1085 M1086 A1108 L1111 M1112 V1115 I1126	H1078-I1082 PolarHBondContact O-N 3.04Å; H1078-I1082 VanDerWaalsContact O-N 3.13Å; P1079-I1082 WeakPolarHBondContact O-CB 3.35Å; P1079-I1082 PolarHBondContact O-N 3.33Å; N1080-I1082 VanDerWaalsContact C-N 3.27Å; N1080-I1082 PolarHBondContact O-N 3Å; I1082-Y1085 WeakPolarHBondContact O-CB 3.32Å; I1082-Y1085 PolarHBondContact O-N 3.43Å; I1082-M1086 PolarHBondContact O-N 3.23Å; I1082-A1108 HydrophobicContact CG2-CB 4.07Å; I1082-L1111 HydrophobicContact CD1-CB 3.73Å; I1082-L1111 HydrophobicContact CG1-CB 3.74Å; I1082-L1111 HydrophobicContact CG1-CD1 4.16Å; I1082-M1112 HydrophobicContact CD1-SD 4.5Å; I1082-M1112 HydrophobicContact CG2-CB 4.43Å; I1082-V1115 HydrophobicContact CD1-CG2 4.11Å; I1082-I1126 HydrophobicContact CG2-CD1 4.31Å
1083	Q	94.4	Very high	94.8	Very high	45 Å²	45	14.8 Å²	14.8	21%	0.21	8%	0.078	C	C	.	.	H	α-helix	trans	-65.4	-39.2	175.5	-69	-175.9	-33	0	0	112	M790 P1079 N1080 Y1085 M1086 H1087 E1122	M790-Q1083 HydrophobicContact CE-CG 3.93Å; P1079-Q1083 PolarHBondContact O-N 3.23Å; P1079-Q1083 VanDerWaalsContact O-N 3.16Å; N1080-Q1083 WeakPolarHBondContact O-CB 3.19Å; N1080-Q1083 PolarHBondContact O-N 2.98Å; N1080-Q1083 VanDerWaalsContact O-N 3.1Å; Q1083-Y1085 VanDerWaalsContact C-N 3.28Å; Q1083-Y1085 PolarHBondContact O-N 2.86Å; Q1083-M1086 WeakPolarHBondContact O-CB 3.35Å; Q1083-M1086 PolarHBondContact O-N 3.29Å; Q1083-M1086 VanDerWaalsContact O-N 3.11Å; Q1083-H1087 PolarHBondContact O-N 2.65Å; Q1083-H1087 PolarHBondContact O-ND1 2.77Å; Q1083-E1122 PolarHBondContact NE2-OE1 2.86Å
1084	E	96.4	Very high	94.5	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.009	8%	0.078	C	C	.	.	H	α-helix	trans	-63	-35.7	176.7	-57.9	-40.3	143	0	0	112.2	R1044 Q1063 V1067 N1080 T1081 H1087 L1088	R1044-E1084 VanDerWaalsContact CD-OE1 3.27Å; R1044-E1084 WeakPolarHBondContact CD-OE1 3.36Å; R1044-E1084 WeakPolarHBondContact CD-OE2 3.35Å; R1044-E1084 IonicContact CZ-OE1 2.68Å; R1044-E1084 IonicContact NE-OE1 2.98Å; R1044-E1084 IonicContact NH1-OE1 2.64Å; R1044-E1084 PolarHBondContact NH1-OE1 3.31Å; Q1063-E1084 PolarHBondContact NE2-O 3.11Å; Q1063-E1084 PolarHBondContact NE2-OE2 3.32Å; V1067-E1084 HydrophobicContact CB-CB 4.38Å; V1067-E1084 HydrophobicContact CG2-CB 3.57Å; V1067-E1084 VanDerWaalsContact CG2-O 3.29Å; V1067-E1084 WeakPolarHBondContact CG2-O 3.27Å; N1080-E1084 WeakPolarHBondContact O-CG 3.4Å; N1080-E1084 PolarHBondContact O-N 2.83Å; T1081-E1084 PolarHBondContact O-N 3.44Å; E1084-H1087 PolarHBondContact O-N 3.01Å; E1084-H1087 IonicContact OE2-ND1 3.35Å; E1084-L1088 WeakPolarHBondContact O-CB 3.39Å; E1084-L1088 PolarHBondContact O-N 2.8Å
1085	Y	97.3	Very high	94.3	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.4	-41	172.2	-86.3	-65.7	0	0	0	112.6	L152 V1067 E1071 T1081 I1082 Q1083 L1088 A1089 L1104 R1107 L1111	L152-Y1085 HydrophobicContact CD1-CD1 4.43Å; L152-Y1085 HydrophobicContact CD1-CE1 3.73Å; V1067-Y1085 HydrophobicContact CG1-CD1 4.19Å; V1067-Y1085 HydrophobicContact CG1-CE1 3.92Å; V1067-Y1085 HydrophobicContact CG1-CE2 4.27Å; V1067-Y1085 HydrophobicContact CG1-CG 4.49Å; E1071-Y1085 PolarHBondContact OE1-OH 3.15Å; T1081-Y1085 HydrophobicContact CG2-CD2 4.08Å; T1081-Y1085 HydrophobicContact CG2-CE2 3.83Å; T1081-Y1085 WeakPolarHBondContact O-CD2 3.24Å; T1081-Y1085 PolarHBondContact O-N 3.27Å; I1082-Y1085 WeakPolarHBondContact O-CB 3.32Å; I1082-Y1085 PolarHBondContact O-N 3.43Å; Q1083-Y1085 VanDerWaalsContact C-N 3.28Å; Q1083-Y1085 PolarHBondContact O-N 2.86Å; Y1085-L1088 PolarHBondContact O-N 2.82Å; Y1085-A1089 WeakPolarHBondContact O-CB 3.27Å; Y1085-A1089 PolarHBondContact O-N 3.18Å; Y1085-L1104 HydrophobicContact CD1-CB 4.47Å; Y1085-L1104 HydrophobicContact CD1-CD2 3.51Å; Y1085-L1104 HydrophobicContact CE1-CD2 3.68Å; Y1085-R1107 HydrophobicContact CE1-CG 4.3Å; Y1085-R1107 HydrophobicContact CE2-CG 4.34Å; Y1085-L1111 HydrophobicContact CD2-CD1 4.36Å; Y1085-L1111 HydrophobicContact CE2-CD1 4.3Å
1086	M	95.6	Very high	94	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.02	10%	0.103	C	C	.	.	H	α-helix	trans	-65.5	-46.7	177.5	-65.7	170.8	60.3	0	0	112	I1082 Q1083 L1088 A1089 L1090 A1108 L1125 I1126	I1082-M1086 PolarHBondContact O-N 3.23Å; Q1083-M1086 WeakPolarHBondContact O-CB 3.35Å; Q1083-M1086 PolarHBondContact O-N 3.29Å; Q1083-M1086 VanDerWaalsContact O-N 3.11Å; M1086-L1088 VanDerWaalsContact C-N 3.32Å; M1086-L1088 PolarHBondContact O-N 3.1Å; M1086-A1089 WeakPolarHBondContact O-CB 3.32Å; M1086-A1089 PolarHBondContact O-N 3.17Å; M1086-L1090 PolarHBondContact O-N 3.32Å; M1086-L1090 VanDerWaalsContact O-N 3.1Å; M1086-A1108 HydrophobicContact CG-CB 3.97Å; M1086-L1125 HydrophobicContact CE-CB 4.21Å; M1086-L1125 HydrophobicContact CE-CD2 3.69Å; M1086-L1125 HydrophobicContact CE-CG 3.6Å; M1086-I1126 HydrophobicContact CE-CG1 3.67Å; M1086-I1126 HydrophobicContact CG-CG1 4.05Å; M1086-I1126 HydrophobicContact SD-CD1 3.89Å; M1086-I1126 HydrophobicContact SD-CG1 3.32Å; M1086-I1126 WeakPolarHBondContact SD-CG1 3.22Å
1087	H	95.1	Very high	93.8	Very high	41 Å²	41	19.2 Å²	19.2	19%	0.19	11%	0.113	C	C	.	.	H	α-helix	trans	-61.6	-41.7	176.5	-63.4	143.1	0	0	0	111.5	Q1063 Q1083 E1084 A1089 L1090 Y1091	Q1063-H1087 HydrophobicContact CG-CB 4.1Å; Q1083-H1087 PolarHBondContact O-N 2.65Å; Q1083-H1087 PolarHBondContact O-ND1 2.77Å; E1084-H1087 PolarHBondContact O-N 3.01Å; E1084-H1087 IonicContact OE2-ND1 3.35Å; H1087-A1089 VanDerWaalsContact C-N 3.32Å; H1087-A1089 PolarHBondContact O-N 3.28Å; H1087-L1090 WeakPolarHBondContact O-CB 3.42Å; H1087-L1090 PolarHBondContact O-N 2.73Å; H1087-Y1091 HydrophobicContact CB-CE2 4.46Å; H1087-Y1091 VanDerWaalsContact O-CD2 3.3Å; H1087-Y1091 WeakPolarHBondContact O-CD2 3.31Å; H1087-Y1091 PolarHBondContact O-N 3.43Å
1088	L	96.2	Very high	93.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-42.3	176	-174.5	60.6	0	0	0	111.4	L152 L160 L1060 Q1063 Q1064 V1067 E1084 Y1085 M1086 L1090 Y1091 C1092 L1104	L152-L1088 HydrophobicContact CD1-CD2 3.62Å; L152-L1088 HydrophobicContact CD2-CD2 4.09Å; L152-L1088 HydrophobicContact CG-CD2 4.47Å; L160-L1088 HydrophobicContact CD1-CD2 3.99Å; L160-L1088 HydrophobicContact CD2-CD1 4.45Å; L160-L1088 HydrophobicContact CD2-CD2 4.45Å; L1060-L1088 HydrophobicContact CD1-CD1 3.69Å; Q1063-L1088 HydrophobicContact CB-CD1 4.06Å; Q1063-L1088 HydrophobicContact CG-CB 3.82Å; Q1063-L1088 HydrophobicContact CG-CD1 4.01Å; Q1064-L1088 HydrophobicContact CB-CD1 4.34Å; V1067-L1088 HydrophobicContact CB-CD2 4.45Å; V1067-L1088 HydrophobicContact CG2-CB 3.98Å; V1067-L1088 HydrophobicContact CG2-CD2 3.92Å; E1084-L1088 WeakPolarHBondContact O-CB 3.39Å; E1084-L1088 PolarHBondContact O-N 2.8Å; Y1085-L1088 PolarHBondContact O-N 2.82Å; M1086-L1088 VanDerWaalsContact C-N 3.32Å; M1086-L1088 PolarHBondContact O-N 3.1Å; L1088-L1090 VanDerWaalsContact C-N 3.29Å; L1088-L1090 PolarHBondContact O-N 2.86Å; L1088-Y1091 PolarHBondContact O-N 3.01Å; L1088-C1092 WeakPolarHBondContact O-CB 3.43Å; L1088-C1092 PolarHBondContact O-N 3.15Å; L1088-C1092 PolarHBondContact O-SG 3.14Å; L1088-L1104 HydrophobicContact CB-CD1 4.22Å; L1088-L1104 HydrophobicContact CD2-CD1 3.86Å; L1088-L1104 HydrophobicContact CD2-CD2 4.22Å; L1088-L1104 HydrophobicContact CG-CD1 3.74Å
1089	A	95.6	Very high	93.3	Very high	3 Å²	3	20 Å²	20	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-60.4	-39.1	177.8	0	0	0	0	0	112.7	Y1085 M1086 H1087 C1092 F1093 A1101 L1104 L1105	Y1085-A1089 WeakPolarHBondContact O-CB 3.27Å; Y1085-A1089 PolarHBondContact O-N 3.18Å; M1086-A1089 WeakPolarHBondContact O-CB 3.32Å; M1086-A1089 PolarHBondContact O-N 3.17Å; H1087-A1089 VanDerWaalsContact C-N 3.32Å; H1087-A1089 PolarHBondContact O-N 3.28Å; A1089-C1092 WeakPolarHBondContact O-CB 3.35Å; A1089-C1092 PolarHBondContact O-N 3.22Å; A1089-F1093 PolarHBondContact O-N 2.9Å; A1089-A1101 HydrophobicContact CB-CB 4.44Å; A1089-A1101 WeakPolarHBondContact O-CB 3.42Å; A1089-L1104 HydrophobicContact CB-CB 3.88Å; A1089-L1104 HydrophobicContact CB-CD1 4.39Å; A1089-L1105 HydrophobicContact CB-CD1 4.35Å; A1089-L1105 HydrophobicContact CB-CD2 3.86Å; A1089-L1105 HydrophobicContact CB-CG 3.64Å
1090	L	94.4	Very high	93.1	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-59.9	-47.6	174.5	177.2	63.8	0	0	0	111.7	M1086 H1087 L1088 F1093 A1094 L1254 L1257 N1261 I1263	M1086-L1090 PolarHBondContact O-N 3.32Å; M1086-L1090 VanDerWaalsContact O-N 3.1Å; H1087-L1090 WeakPolarHBondContact O-CB 3.42Å; H1087-L1090 PolarHBondContact O-N 2.73Å; L1088-L1090 VanDerWaalsContact C-N 3.29Å; L1088-L1090 PolarHBondContact O-N 2.86Å; L1090-F1093 WeakPolarHBondContact O-CB 3.47Å; L1090-F1093 PolarHBondContact O-N 3.26Å; L1090-A1094 PolarHBondContact O-N 3.42Å; L1090-L1254 HydrophobicContact CD1-CD1 4.27Å; L1090-L1257 HydrophobicContact CD1-CB 3.59Å; L1090-L1257 HydrophobicContact CD1-CD1 4.27Å; L1090-L1257 HydrophobicContact CD1-CG 4.45Å; L1090-N1261 HydrophobicContact CD2-CB 4.35Å; L1090-I1263 HydrophobicContact CD2-CD1 4.01Å; L1090-I1263 HydrophobicContact CD2-CG1 3.53Å
1091	Y	94.5	Very high	93	Very high	3 Å²	3	17.7 Å²	17.7	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-71	-31.8	179.7	-56.1	-37.4	0	0	0	112.5	A1047 R1048 Y1051 Q1063 H1087 L1088 A1094 N1095	A1047-Y1091 HydrophobicContact CB-CE2 3.81Å; R1048-Y1091 VanDerWaalsContact CA-OH 3.26Å; R1048-Y1091 WeakPolarHBondContact CA-OH 3.28Å; R1048-Y1091 PolarHBondContact N-OH 3.19Å; Y1051-Y1091 HydrophobicContact CD1-CE1 4.11Å; Y1051-Y1091 AromaticContact CD2-CD1 3.44Å; Y1051-Y1091 HydrophobicContact CD2-CD1 3.44Å; Y1051-Y1091 VanDerWaalsContact CD2-CD1 3.44Å; Y1051-Y1091 AromaticContact CD2-CE1 3.6Å; Y1051-Y1091 HydrophobicContact CD2-CE1 3.6Å; Y1051-Y1091 AromaticContact CE2-CD1 3.99Å; Y1051-Y1091 HydrophobicContact CE2-CD1 3.99Å; Y1051-Y1091 HydrophobicContact CE2-CE1 4.34Å; Y1051-Y1091 AromaticContact CG-CD1 3.86Å; Y1051-Y1091 HydrophobicContact CG-CD1 3.86Å; Y1051-Y1091 AromaticContact CG-CE1 3.48Å; Y1051-Y1091 HydrophobicContact CG-CE1 3.48Å; Y1051-Y1091 VanDerWaalsContact CG-CE1 3.48Å; Q1063-Y1091 HydrophobicContact CB-CD2 3.52Å; Q1063-Y1091 HydrophobicContact CB-CE2 3.75Å; Q1063-Y1091 HydrophobicContact CG-CD2 3.67Å; Q1063-Y1091 HydrophobicContact CG-CE2 3.76Å; H1087-Y1091 HydrophobicContact CB-CE2 4.46Å; H1087-Y1091 VanDerWaalsContact O-CD2 3.3Å; H1087-Y1091 WeakPolarHBondContact O-CD2 3.31Å; H1087-Y1091 PolarHBondContact O-N 3.43Å; L1088-Y1091 PolarHBondContact O-N 3.01Å; Y1091-A1094 PolarHBondContact O-N 3.15Å; Y1091-N1095 PolarHBondContact O-N 3.11Å; Y1091-N1095 VanDerWaalsContact O-N 3.11Å; Y1091-N1095 PolarHBondContact O-ND2 3.33Å
1092	C	93	Very high	92.9	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.1	-46.3	168.6	-71	0	0	0	0	111	L160 L1088 A1089 A1094 N1095 G1096 Q1097 A1101	L160-C1092 WeakPolarHBondContact CD2-SG 3.41Å; L1088-C1092 WeakPolarHBondContact O-CB 3.43Å; L1088-C1092 PolarHBondContact O-N 3.15Å; L1088-C1092 PolarHBondContact O-SG 3.14Å; A1089-C1092 WeakPolarHBondContact O-CB 3.35Å; A1089-C1092 PolarHBondContact O-N 3.22Å; C1092-A1094 PolarHBondContact O-N 2.92Å; C1092-N1095 CarbonylContact O-C 3.49Å; C1092-N1095 PolarHBondContact O-N 3.05Å; C1092-G1096 PolarHBondContact O-N 2.96Å; C1092-Q1097 HydrophobicContact CB-CB 4.15Å; C1092-Q1097 WeakPolarHBondContact O-CB 3.33Å; C1092-Q1097 PolarHBondContact O-N 2.86Å; C1092-A1101 HydrophobicContact CB-CB 4.01Å
1093	F	91.4	Very high	92.7	Very high	10 Å²	10	21.4 Å²	21.4	4%	0.044	13%	0.126	C	C	.	.	H	α-helix	trans	-61.1	-45.5	177.4	-176.2	-85.8	0	0	0	111.5	A1089 L1090 N1095 G1096 L1098 A1101 V1133 M1250 I1253 L1254 L1257	A1089-F1093 PolarHBondContact O-N 2.9Å; L1090-F1093 WeakPolarHBondContact O-CB 3.47Å; L1090-F1093 PolarHBondContact O-N 3.26Å; F1093-N1095 PolarHBondContact O-N 3.07Å; F1093-G1096 PolarHBondContact O-N 3.21Å; F1093-L1098 HydrophobicContact CD2-CD2 3.31Å; F1093-L1098 HydrophobicContact CE2-CD2 3.27Å; F1093-L1098 HydrophobicContact CG-CD2 4.27Å; F1093-L1098 HydrophobicContact CZ-CD2 4.18Å; F1093-A1101 HydrophobicContact CB-CB 4.15Å; F1093-V1133 HydrophobicContact CD2-CB 4.37Å; F1093-V1133 HydrophobicContact CD2-CG1 3.96Å; F1093-V1133 HydrophobicContact CD2-CG2 3.75Å; F1093-V1133 HydrophobicContact CE2-CB 4.43Å; F1093-V1133 HydrophobicContact CE2-CG1 4.14Å; F1093-V1133 HydrophobicContact CE2-CG2 4.13Å; F1093-V1133 HydrophobicContact CG-CG2 4.49Å; F1093-M1250 HydrophobicContact CE2-SD 4.37Å; F1093-M1250 HydrophobicContact CZ-SD 3.93Å; F1093-I1253 HydrophobicContact CE1-CB 4.34Å; F1093-I1253 HydrophobicContact CE1-CG2 3.96Å; F1093-I1253 HydrophobicContact CE2-CG2 4.13Å; F1093-I1253 HydrophobicContact CZ-CB 3.94Å; F1093-I1253 HydrophobicContact CZ-CG2 3.44Å; F1093-I1253 VanDerWaalsContact CZ-CG2 3.44Å; F1093-L1254 HydrophobicContact CD1-CB 4.38Å; F1093-L1254 HydrophobicContact CD1-CD1 3.85Å; F1093-L1254 HydrophobicContact CE1-CB 4Å; F1093-L1254 HydrophobicContact CE1-CD1 4.33Å; F1093-L1257 HydrophobicContact CB-CD1 4.41Å; F1093-L1257 HydrophobicContact CD1-CD1 3.48Å; F1093-L1257 VanDerWaalsContact CD1-CD1 3.48Å; F1093-L1257 HydrophobicContact CD2-CD1 4.16Å; F1093-L1257 HydrophobicContact CE1-CD1 3.69Å; F1093-L1257 HydrophobicContact CE2-CD1 4.33Å; F1093-L1257 HydrophobicContact CG-CD1 3.75Å; F1093-L1257 HydrophobicContact CZ-CD1 4.12Å
1094	A	90.1	Very high	92.7	Very high	24 Å²	24	19.3 Å²	19.3	20%	0.198	12%	0.116	C	C	.	.	H	α-helix	trans	-59.5	-31.6	176.9	0	0	0	0	0	113.2	Y1051 L1090 Y1091 C1092 G1096 L1254	Y1051-A1094 HydrophobicContact CE2-CB 3.65Å; L1090-A1094 PolarHBondContact O-N 3.42Å; Y1091-A1094 PolarHBondContact O-N 3.15Å; C1092-A1094 PolarHBondContact O-N 2.92Å; A1094-G1096 VanDerWaalsContact C-N 3.32Å; A1094-L1254 HydrophobicContact CB-CD1 3.82Å; A1094-L1254 HydrophobicContact CB-CD2 4.22Å
1095	N	89.7	Confident	92.8	Very high	59 Å²	59	19.2 Å²	19.2	32%	0.316	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	5.9	175.6	-75.1	-64.9	0	0	0	114	H1056 Y1091 C1092 F1093 Q1097	H1056-N1095 PolarHBondContact O-ND2 2.86Å; Y1091-N1095 PolarHBondContact O-N 3.11Å; Y1091-N1095 VanDerWaalsContact O-N 3.11Å; Y1091-N1095 PolarHBondContact O-ND2 3.33Å; C1092-N1095 CarbonylContact O-C 3.49Å; C1092-N1095 PolarHBondContact O-N 3.05Å; F1093-N1095 PolarHBondContact O-N 3.07Å; N1095-Q1097 VanDerWaalsContact C-N 3.35Å
1096	G	87.9	Confident	92.7	Very high	56 Å²	56	20.4 Å²	20.4	58%	0.577	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	10.3	178.5	0	0	0	0	0	115.1	C1092 F1093 A1094 L1098	C1092-G1096 PolarHBondContact O-N 2.96Å; F1093-G1096 PolarHBondContact O-N 3.21Å; A1094-G1096 VanDerWaalsContact C-N 3.32Å; G1096-L1098 VanDerWaalsContact C-N 3.31Å; G1096-L1098 PolarHBondContact O-N 3.02Å; G1096-L1098 VanDerWaalsContact O-N 3.13Å
1097	Q	89	Confident	92.7	Very high	46 Å²	46	20.7 Å²	20.7	22%	0.215	12%	0.122	C	C	.	.			trans	-87.3	65	178.4	-60.3	-177.1	-15.6	0	0	111.3	D159 C1092 N1095 S1099 T1100 A1101	D159-Q1097 PolarHBondContact O-NE2 3.43Å; C1092-Q1097 HydrophobicContact CB-CB 4.15Å; C1092-Q1097 WeakPolarHBondContact O-CB 3.33Å; C1092-Q1097 PolarHBondContact O-N 2.86Å; N1095-Q1097 VanDerWaalsContact C-N 3.35Å; Q1097-S1099 PolarHBondContact O-N 3.23Å; Q1097-T1100 PolarHBondContact O-N 3.15Å; Q1097-A1101 PolarHBondContact O-N 3.34Å
1098	L	88.6	Confident	92.7	Very high	24 Å²	24	18.8 Å²	18.8	13%	0.126	11%	0.113	C	C	.	.	H	α-helix	trans	-60.7	-43.8	-171.9	-62	173.5	0	0	0	113.6	I176 F1093 G1096 A1101 L1102 V1137 M1250	I176-L1098 HydrophobicContact CD1-CB 4.11Å; I176-L1098 HydrophobicContact CD1-CD1 4.34Å; F1093-L1098 HydrophobicContact CD2-CD2 3.31Å; F1093-L1098 HydrophobicContact CE2-CD2 3.27Å; F1093-L1098 HydrophobicContact CG-CD2 4.27Å; F1093-L1098 HydrophobicContact CZ-CD2 4.18Å; G1096-L1098 VanDerWaalsContact C-N 3.31Å; G1096-L1098 PolarHBondContact O-N 3.02Å; G1096-L1098 VanDerWaalsContact O-N 3.13Å; L1098-A1101 PolarHBondContact O-N 3.42Å; L1098-L1102 PolarHBondContact O-N 3.42Å; L1098-V1137 HydrophobicContact CB-CG1 4.48Å; L1098-V1137 HydrophobicContact CD1-CG1 4.02Å; L1098-M1250 HydrophobicContact CD2-SD 4.47Å
1099	S	87.8	Confident	92.8	Very high	43 Å²	43	18.8 Å²	18.8	30%	0.301	11%	0.113	S	C	.	.	H	α-helix	trans	-62.1	-46.2	179.2	-175.4	0	0	0	0	111.5	Q1097 A1101 L1102 K1103	Q1097-S1099 PolarHBondContact O-N 3.23Å; S1099-A1101 PolarHBondContact O-N 2.86Å; S1099-L1102 PolarHBondContact O-N 3.35Å; S1099-K1103 WeakPolarHBondContact O-CG 3.38Å; S1099-K1103 PolarHBondContact O-N 2.97Å
1100	T	90.3	Very high	92.8	Very high	7 Å²	7	19.1 Å²	19.1	4%	0.043	11%	0.113	C	C	.	.	H	α-helix	trans	-63.1	-42.6	177.7	-49.8	0	0	0	0	111.1	T156 L160 Q1097 L1102 K1103 L1104	T156-T1100 HydrophobicContact CG2-CG2 3.63Å; L160-T1100 HydrophobicContact CD2-CG2 3.91Å; Q1097-T1100 PolarHBondContact O-N 3.15Å; T1100-L1102 PolarHBondContact O-N 3.16Å; T1100-K1103 PolarHBondContact O-N 3.49Å; T1100-L1104 HydrophobicContact CG2-CD1 4.04Å; T1100-L1104 HydrophobicContact CG2-CG 4.42Å; T1100-L1104 VanDerWaalsContact O-CG 3.22Å; T1100-L1104 WeakPolarHBondContact O-CG 3.43Å; T1100-L1104 PolarHBondContact O-N 3.28Å
1101	A	93.4	Very high	92.8	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.6	-47.1	175.4	0	0	0	0	0	112	A1089 C1092 F1093 Q1097 L1098 S1099 L1104 L1105	A1089-A1101 HydrophobicContact CB-CB 4.44Å; A1089-A1101 WeakPolarHBondContact O-CB 3.42Å; C1092-A1101 HydrophobicContact CB-CB 4.01Å; F1093-A1101 HydrophobicContact CB-CB 4.15Å; Q1097-A1101 PolarHBondContact O-N 3.34Å; L1098-A1101 PolarHBondContact O-N 3.42Å; S1099-A1101 PolarHBondContact O-N 2.86Å; A1101-L1104 PolarHBondContact O-N 3.14Å; A1101-L1105 WeakPolarHBondContact O-CG 3.26Å; A1101-L1105 PolarHBondContact O-N 3.14Å
1102	L	93.4	Very high	92.9	Very high	3 Å²	3	18.9 Å²	18.9	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-63	-45.4	176.2	-76.4	174	0	0	0	112.4	C178 L1098 S1099 T1100 L1104 L1105 Y1106 V1133 L1134	C178-L1102 HydrophobicContact CB-CD1 3.84Å; L1098-L1102 PolarHBondContact O-N 3.42Å; S1099-L1102 PolarHBondContact O-N 3.35Å; T1100-L1102 PolarHBondContact O-N 3.16Å; L1102-L1104 VanDerWaalsContact C-N 3.29Å; L1102-L1104 PolarHBondContact O-N 3.44Å; L1102-L1105 PolarHBondContact O-N 3.21Å; L1102-Y1106 HydrophobicContact CB-CE2 4.18Å; L1102-Y1106 HydrophobicContact CD2-CE1 4.26Å; L1102-Y1106 WeakPolarHBondContact O-CB 3.35Å; L1102-Y1106 WeakPolarHBondContact O-CD2 3.2Å; L1102-Y1106 PolarHBondContact O-N 3.44Å; L1102-V1133 HydrophobicContact CD1-CG1 4.28Å; L1102-V1133 HydrophobicContact CD2-CB 3.93Å; L1102-V1133 HydrophobicContact CD2-CG1 3.57Å; L1102-V1133 HydrophobicContact CG-CG1 3.63Å; L1102-L1134 HydrophobicContact CD1-CD2 4.3Å; L1102-L1134 HydrophobicContact CD2-CD2 4.19Å; L1102-L1134 HydrophobicContact CD2-CG 4.16Å
1103	K	92.4	Very high	93	Very high	77 Å²	77	19 Å²	19	34%	0.335	11%	0.113	S	C	.	.	H	α-helix	trans	-56.3	-43.9	176.9	-71.7	176.5	-175.2	175.2	0	111.7	F155 D157 S1099 T1100 R1107	F155-K1103 WeakPolarHBondContact O-CD 3.49Å; D157-K1103 IonicContact OD2-NZ 2.97Å; D157-K1103 PolarHBondContact OD2-NZ 3.11Å; S1099-K1103 WeakPolarHBondContact O-CG 3.38Å; S1099-K1103 PolarHBondContact O-N 2.97Å; T1100-K1103 PolarHBondContact O-N 3.49Å; K1103-R1107 WeakPolarHBondContact O-CB 3.36Å; K1103-R1107 PolarHBondContact O-N 2.91Å
1104	L	95.3	Very high	93.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.8	-41.6	178.8	-65.8	168.4	0	0	0	112	L152 T156 Y1085 L1088 A1089 T1100 A1101 L1102 R1107 A1108	L152-L1104 HydrophobicContact CD1-CD2 3.7Å; T156-L1104 HydrophobicContact CG2-CD1 4.48Å; T156-L1104 HydrophobicContact CG2-CD2 3.8Å; T156-L1104 HydrophobicContact CG2-CG 4.33Å; Y1085-L1104 HydrophobicContact CD1-CB 4.47Å; Y1085-L1104 HydrophobicContact CD1-CD2 3.51Å; Y1085-L1104 HydrophobicContact CE1-CD2 3.68Å; L1088-L1104 HydrophobicContact CB-CD1 4.22Å; L1088-L1104 HydrophobicContact CD2-CD1 3.86Å; L1088-L1104 HydrophobicContact CD2-CD2 4.22Å; L1088-L1104 HydrophobicContact CG-CD1 3.74Å; A1089-L1104 HydrophobicContact CB-CB 3.88Å; A1089-L1104 HydrophobicContact CB-CD1 4.39Å; T1100-L1104 HydrophobicContact CG2-CD1 4.04Å; T1100-L1104 HydrophobicContact CG2-CG 4.42Å; T1100-L1104 VanDerWaalsContact O-CG 3.22Å; T1100-L1104 WeakPolarHBondContact O-CG 3.43Å; T1100-L1104 PolarHBondContact O-N 3.28Å; A1101-L1104 PolarHBondContact O-N 3.14Å; L1102-L1104 VanDerWaalsContact C-N 3.29Å; L1102-L1104 PolarHBondContact O-N 3.44Å; L1104-R1107 WeakPolarHBondContact O-CB 3.45Å; L1104-R1107 PolarHBondContact O-N 2.92Å; L1104-A1108 WeakPolarHBondContact O-CB 3.1Å; L1104-A1108 PolarHBondContact O-N 3.08Å
1105	L	96.8	Very high	93.2	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-67.1	-40.1	176.1	-70.5	169.9	0	0	0	112.4	A1089 A1101 L1102 R1107 A1108 R1109 N1129 I1130 V1133	A1089-L1105 HydrophobicContact CB-CD1 4.35Å; A1089-L1105 HydrophobicContact CB-CD2 3.86Å; A1089-L1105 HydrophobicContact CB-CG 3.64Å; A1101-L1105 WeakPolarHBondContact O-CG 3.26Å; A1101-L1105 PolarHBondContact O-N 3.14Å; L1102-L1105 PolarHBondContact O-N 3.21Å; L1105-R1107 VanDerWaalsContact C-N 3.3Å; L1105-R1107 PolarHBondContact O-N 3.37Å; L1105-A1108 PolarHBondContact O-N 2.99Å; L1105-R1109 WeakPolarHBondContact O-CB 3.39Å; L1105-R1109 PolarHBondContact O-N 2.95Å; L1105-N1129 HydrophobicContact CD1-CB 4.02Å; L1105-N1129 HydrophobicContact CD2-CB 3.69Å; L1105-I1130 HydrophobicContact CB-CD1 4.25Å; L1105-I1130 HydrophobicContact CB-CG1 3.6Å; L1105-I1130 HydrophobicContact CD1-CG1 4.14Å; L1105-I1130 HydrophobicContact CG-CG1 4.35Å; L1105-V1133 HydrophobicContact CD1-CG2 3.95Å
1106	Y	95.7	Very high	93.2	Very high	24 Å²	24	15 Å²	15	9%	0.094	9%	0.089	C	C	.	.	H	α-helix	trans	-61.7	-40.2	173.6	-68.5	-13.9	0	0	0	111.5	C178 P180 I184 L1102 Y1110 I1130	C178-Y1106 PolarHBondContact O-OH 3.04Å; P180-Y1106 HydrophobicContact CB-CD1 4.47Å; P180-Y1106 HydrophobicContact CB-CE1 3.93Å; P180-Y1106 HydrophobicContact CB-CE2 4.1Å; I184-Y1106 HydrophobicContact CD1-CD1 3.32Å; I184-Y1106 HydrophobicContact CD1-CD2 4.1Å; I184-Y1106 HydrophobicContact CD1-CE1 4Å; I184-Y1106 HydrophobicContact CD1-CG 3.38Å; L1102-Y1106 HydrophobicContact CB-CE2 4.18Å; L1102-Y1106 HydrophobicContact CD2-CE1 4.26Å; L1102-Y1106 WeakPolarHBondContact O-CB 3.35Å; L1102-Y1106 WeakPolarHBondContact O-CD2 3.2Å; L1102-Y1106 PolarHBondContact O-N 3.44Å; Y1106-Y1110 WeakPolarHBondContact O-CB 3.48Å; Y1106-Y1110 PolarHBondContact O-N 3.21Å; Y1106-I1130 HydrophobicContact CD1-CD1 4.08Å; Y1106-I1130 HydrophobicContact CD1-CG1 4.38Å; Y1106-I1130 HydrophobicContact CE1-CD1 4.38Å; Y1106-I1130 HydrophobicContact CE1-CG1 4.41Å; Y1106-I1130 HydrophobicContact CE1-CG2 3.81Å
1107	R	95.2	Very high	93.3	Very high	11 Å²	11	12.4 Å²	12.4	4%	0.042	6%	0.062	C	C	.	.	H	α-helix	trans	-62.6	-48.7	172.3	178.7	59.1	177.2	-177	-2.1	111.8	F155 P195 L196 Y1085 K1103 L1104 L1105 R1109 Y1110 L1111	F155-R1107 HydrophobicContact CD2-CG 4.4Å; F155-R1107 HydrophobicContact CE2-CG 4.38Å; P195-R1107 PolarHBondContact O-NH1 3.15Å; L196-R1107 PolarHBondContact O-NH1 3.36Å; L196-R1107 PolarHBondContact O-NH2 2.94Å; Y1085-R1107 HydrophobicContact CE1-CG 4.3Å; Y1085-R1107 HydrophobicContact CE2-CG 4.34Å; K1103-R1107 WeakPolarHBondContact O-CB 3.36Å; K1103-R1107 PolarHBondContact O-N 2.91Å; L1104-R1107 WeakPolarHBondContact O-CB 3.45Å; L1104-R1107 PolarHBondContact O-N 2.92Å; L1105-R1107 VanDerWaalsContact C-N 3.3Å; L1105-R1107 PolarHBondContact O-N 3.37Å; R1107-R1109 PolarHBondContact O-N 2.87Å; R1107-Y1110 PolarHBondContact O-N 3.47Å; R1107-L1111 HydrophobicContact CG-CD1 4.21Å; R1107-L1111 WeakPolarHBondContact O-CG 3.29Å; R1107-L1111 PolarHBondContact O-N 3.25Å
1108	A	96.9	Very high	93.4	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.5	-46	178.3	0	0	0	0	0	111.6	I1082 M1086 L1104 L1105 Y1110 L1111 M1112	I1082-A1108 HydrophobicContact CG2-CB 4.07Å; M1086-A1108 HydrophobicContact CG-CB 3.97Å; L1104-A1108 WeakPolarHBondContact O-CB 3.1Å; L1104-A1108 PolarHBondContact O-N 3.08Å; L1105-A1108 PolarHBondContact O-N 2.99Å; A1108-Y1110 PolarHBondContact O-N 2.99Å; A1108-L1111 PolarHBondContact O-N 3.39Å; A1108-M1112 WeakPolarHBondContact O-CB 3.35Å; A1108-M1112 PolarHBondContact O-N 3.28Å
1109	R	96.6	Very high	93.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.9	-46.3	177	-161.2	-170.4	-167.9	-93.8	-8	112	I184 L185 L1105 R1107 L1111 M1112 L1113 E1118 M1123 I1126 D1127 I1130	I184-R1109 VanDerWaalsContact C-NH1 3.29Å; I184-R1109 WeakPolarHBondContact O-CD 3.16Å; I184-R1109 VanDerWaalsContact O-CZ 3.3Å; I184-R1109 PolarHBondContact O-NE 2.91Å; I184-R1109 PolarHBondContact O-NH1 3.34Å; L185-R1109 PolarHBondContact O-NH1 3.43Å; L1105-R1109 WeakPolarHBondContact O-CB 3.39Å; L1105-R1109 PolarHBondContact O-N 2.95Å; R1107-R1109 PolarHBondContact O-N 2.87Å; R1109-L1111 PolarHBondContact O-N 3.48Å; R1109-M1112 PolarHBondContact O-N 3.39Å; R1109-L1113 WeakPolarHBondContact O-CG 3.46Å; R1109-L1113 PolarHBondContact O-N 2.89Å; R1109-E1118 IonicContact NH2-OE1 3.77Å; R1109-E1118 PolarHBondContact NH2-OE1 3.29Å; R1109-E1118 VanDerWaalsContact NH2-OE1 3.07Å; R1109-M1123 HydrophobicContact CG-CE 4.49Å; R1109-M1123 HydrophobicContact CG-SD 3.73Å; R1109-I1126 HydrophobicContact CB-CG2 3.69Å; R1109-I1126 HydrophobicContact CG-CG2 3.98Å; R1109-D1127 WeakPolarHBondContact CD-OD1 3.2Å; R1109-D1127 IonicContact CZ-OD1 2.98Å; R1109-D1127 IonicContact CZ-OD2 2.73Å; R1109-D1127 IonicContact NE-OD1 3.95Å; R1109-D1127 PolarHBondContact NE-OD1 3.3Å; R1109-D1127 IonicContact NE-OD2 2.72Å; R1109-D1127 IonicContact NH2-OD1 3.8Å; R1109-D1127 IonicContact NH2-OD2 3.01Å; R1109-D1127 PolarHBondContact NH2-OD2 3.38Å; R1109-D1127 VanDerWaalsContact NH2-OD2 3.17Å; R1109-I1130 HydrophobicContact CB-CD1 4.04Å; R1109-I1130 HydrophobicContact CG-CD1 4.34Å
1110	Y	95.9	Very high	93.8	Very high	11 Å²	11	10.5 Å²	10.5	4%	0.043	5%	0.049	C	C	.	.	H	α-helix	trans	-57.2	-49.1	177.4	168.3	-104.9	0	0	0	112	H183 I184 P192 L193 P195 L196 Y1106 R1107 A1108 M1112 L1113 L1114	H183-Y1110 AromaticContact CD2-CD2 3.66Å; H183-Y1110 AromaticContact NE2-CD2 3.73Å; I184-Y1110 HydrophobicContact CG2-CD2 4.46Å; P192-Y1110 HydrophobicContact CG-CE2 4.49Å; P192-Y1110 WeakPolarHBondContact O-CE2 3.35Å; P192-Y1110 PolarHBondContact O-OH 2.97Å; L193-Y1110 PolarHBondContact O-OH 3.43Å; P195-Y1110 VanDerWaalsContact C-CE1 3.49Å; P195-Y1110 HydrophobicContact CB-CD2 4.46Å; P195-Y1110 HydrophobicContact CB-CE1 4.01Å; P195-Y1110 HydrophobicContact CB-CE2 3.89Å; P195-Y1110 HydrophobicContact CG-CE2 4.21Å; P195-Y1110 WeakPolarHBondContact O-CE1 3.37Å; L196-Y1110 HydrophobicContact CD1-CE1 3.95Å; L196-Y1110 WeakPolarHBondContact CD1-OH 3.49Å; L196-Y1110 PolarHBondContact N-OH 3.11Å; Y1106-Y1110 WeakPolarHBondContact O-CB 3.48Å; Y1106-Y1110 PolarHBondContact O-N 3.21Å; R1107-Y1110 PolarHBondContact O-N 3.47Å; A1108-Y1110 PolarHBondContact O-N 2.99Å; Y1110-M1112 VanDerWaalsContact C-N 3.31Å; Y1110-M1112 PolarHBondContact O-N 3.43Å; Y1110-L1113 WeakPolarHBondContact O-CB 3.5Å; Y1110-L1113 PolarHBondContact O-N 3.46Å; Y1110-L1114 PolarHBondContact O-N 3.45Å; Y1110-L1114 VanDerWaalsContact O-N 3.14Å
1111	L	95.9	Very high	93.9	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-62.7	-40.2	178	-67.1	174.4	0	0	0	111.2	I1076 E1077 I1082 Y1085 R1107 A1108 R1109 L1113 L1114 V1115	I1076-L1111 VanDerWaalsContact O-CD1 3.28Å; I1076-L1111 WeakPolarHBondContact O-CD1 3.28Å; E1077-L1111 HydrophobicContact CB-CD2 4.01Å; I1082-L1111 HydrophobicContact CD1-CB 3.73Å; I1082-L1111 HydrophobicContact CG1-CB 3.74Å; I1082-L1111 HydrophobicContact CG1-CD1 4.16Å; Y1085-L1111 HydrophobicContact CD2-CD1 4.36Å; Y1085-L1111 HydrophobicContact CE2-CD1 4.3Å; R1107-L1111 HydrophobicContact CG-CD1 4.21Å; R1107-L1111 WeakPolarHBondContact O-CG 3.29Å; R1107-L1111 PolarHBondContact O-N 3.25Å; A1108-L1111 PolarHBondContact O-N 3.39Å; R1109-L1111 PolarHBondContact O-N 3.48Å; L1111-L1113 PolarHBondContact O-N 2.92Å; L1111-L1114 WeakPolarHBondContact O-CB 3.43Å; L1111-L1114 PolarHBondContact O-N 3.14Å; L1111-V1115 VanDerWaalsContact O-CG2 3.29Å; L1111-V1115 WeakPolarHBondContact O-CG2 3.31Å; L1111-V1115 PolarHBondContact O-N 3.08Å
1112	M	95.2	Very high	93.9	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-64.7	-39.8	177.6	-168.7	57.1	169.7	0	0	112.6	M790 I1082 A1108 R1109 Y1110 L1114 V1115 C1116 G1117 H1120 E1122 M1123 I1126	M790-M1112 HydrophobicContact CB-CE 4.39Å; M790-M1112 HydrophobicContact CG-CE 3.88Å; M790-M1112 HydrophobicContact SD-CE 3.82Å; M790-M1112 HydrophobicContact SD-SD 4.08Å; I1082-M1112 HydrophobicContact CD1-SD 4.5Å; I1082-M1112 HydrophobicContact CG2-CB 4.43Å; A1108-M1112 WeakPolarHBondContact O-CB 3.35Å; A1108-M1112 PolarHBondContact O-N 3.28Å; R1109-M1112 PolarHBondContact O-N 3.39Å; Y1110-M1112 VanDerWaalsContact C-N 3.31Å; Y1110-M1112 PolarHBondContact O-N 3.43Å; M1112-L1114 VanDerWaalsContact C-N 3.29Å; M1112-L1114 PolarHBondContact O-N 2.99Å; M1112-V1115 PolarHBondContact O-N 2.98Å; M1112-C1116 HydrophobicContact CE-CB 4.47Å; M1112-C1116 WeakPolarHBondContact CE-SG 3.44Å; M1112-C1116 PolarHBondContact O-N 2.79Å; M1112-C1116 PolarHBondContact O-SG 2.71Å; M1112-C1116 PolarHBondContact SD-SG 2.83Å; M1112-G1117 PolarHBondContact O-N 3.33Å; M1112-H1120 HydrophobicContact CE-CB 4.13Å; M1112-H1120 WeakPolarHBondContact CE-ND1 3.04Å; M1112-E1122 HydrophobicContact CE-CB 3.77Å; M1112-E1122 HydrophobicContact CE-CG 4.39Å; M1112-M1123 HydrophobicContact CB-CE 3.78Å; M1112-M1123 HydrophobicContact CG-CE 3.55Å; M1112-M1123 HydrophobicContact CG-SD 4.45Å; M1112-I1126 HydrophobicContact CB-CD1 3.84Å; M1112-I1126 HydrophobicContact CG-CD1 4.01Å
1113	L	94.9	Very high	94	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-61.2	-36.6	174.4	-74	170.2	0	0	0	112.4	Q945 R1109 Y1110 L1111 G1117 E1118 M1123	Q945-L1113 PolarHBondContact OE1-O 3.21Å; Q945-L1113 VanDerWaalsContact OE1-O 3.11Å; R1109-L1113 WeakPolarHBondContact O-CG 3.46Å; R1109-L1113 PolarHBondContact O-N 2.89Å; Y1110-L1113 WeakPolarHBondContact O-CB 3.5Å; Y1110-L1113 PolarHBondContact O-N 3.46Å; L1111-L1113 PolarHBondContact O-N 2.92Å; L1113-G1117 WeakPolarHBondContact O-CA 3.49Å; L1113-G1117 PolarHBondContact O-N 3.27Å; L1113-E1118 HydrophobicContact CD2-CB 3.96Å; L1113-M1123 HydrophobicContact CD2-CE 3.77Å; L1113-M1123 HydrophobicContact CG-CE 3.91Å
1114	L	93.4	Very high	94.2	Very high	3 Å²	3	7.9 Å²	7.9	2%	0.016	4%	0.038	C	C	.	.	H	α-helix	trans	-70.8	-42.7	176.6	-176.6	86.6	0	0	0	111.9	L193 L196 W316 T948 Y1110 L1111 M1112	L193-L1114 HydrophobicContact CD2-CD1 3.57Å; L196-L1114 HydrophobicContact CD1-CD1 3.89Å; L196-L1114 HydrophobicContact CD1-CD2 3.41Å; L196-L1114 VanDerWaalsContact CD1-CD2 3.41Å; L196-L1114 HydrophobicContact CD1-CG 4.23Å; L196-L1114 HydrophobicContact CD2-CD2 4.34Å; L196-L1114 HydrophobicContact CG-CD2 4.17Å; W316-L1114 HydrophobicContact CZ2-CD2 4.39Å; T948-L1114 PolarHBondContact OG1-O 2.84Å; Y1110-L1114 PolarHBondContact O-N 3.45Å; Y1110-L1114 VanDerWaalsContact O-N 3.14Å; L1111-L1114 WeakPolarHBondContact O-CB 3.43Å; L1111-L1114 PolarHBondContact O-N 3.14Å; M1112-L1114 VanDerWaalsContact C-N 3.29Å; M1112-L1114 PolarHBondContact O-N 2.99Å
1115	V	93.1	Very high	94.1	Very high	2 Å²	2	9.7 Å²	9.7	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-74.3	-49.9	-173.2	171.4	0	0	0	0	112.2	D791 T948 E1077 I1082 L1111 M1112	D791-V1115 HydrophobicContact CB-CG1 3.69Å; T948-V1115 WeakPolarHBondContact CG2-O 3.16Å; E1077-V1115 WeakPolarHBondContact O-CG2 3.47Å; I1082-V1115 HydrophobicContact CD1-CG2 4.11Å; L1111-V1115 VanDerWaalsContact O-CG2 3.29Å; L1111-V1115 WeakPolarHBondContact O-CG2 3.31Å; L1111-V1115 PolarHBondContact O-N 3.08Å; M1112-V1115 PolarHBondContact O-N 2.98Å
1116	C	89.3	Confident	94.1	Very high	6 Å²	6	9.7 Å²	9.7	4%	0.041	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.6	-9.6	-172	76.6	0	0	0	0	114.6	M790 R830 M1112 H1120	M790-C1116 VanDerWaalsContact O-CB 3.28Å; M790-C1116 WeakPolarHBondContact O-CB 3.27Å; R830-C1116 PolarHBondContact NH2-O 3.1Å; M1112-C1116 HydrophobicContact CE-CB 4.47Å; M1112-C1116 WeakPolarHBondContact CE-SG 3.44Å; M1112-C1116 PolarHBondContact O-N 2.79Å; M1112-C1116 PolarHBondContact O-SG 2.71Å; M1112-C1116 PolarHBondContact SD-SG 2.83Å; C1116-H1120 VanDerWaalsContact SG-CB 3.59Å
1117	G	90.4	Very high	94.3	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.01	4%	0.043	C	C	.	.			trans	87.2	-166.4	-175.3	0	0	0	0	0	114.7	M1112 L1113 M1123	M1112-G1117 PolarHBondContact O-N 3.33Å; L1113-G1117 WeakPolarHBondContact O-CA 3.49Å; L1113-G1117 PolarHBondContact O-N 3.27Å; G1117-M1123 WeakPolarHBondContact O-CE 3.46Å
1118	E	90	Very high	94.4	Very high	34 Å²	34	8.2 Å²	8.2	16%	0.159	4%	0.042	C	C	.	.	S	Bend	trans	-83.2	-24.4	-173.9	-174.9	158.5	-139.3	0	0	113.4	P186 G187 R1109 L1113 H1120 M1123	P186-E1118 WeakPolarHBondContact CA-OE1 3.16Å; G187-E1118 PolarHBondContact N-OE1 3.42Å; G187-E1118 PolarHBondContact N-OE2 3.23Å; R1109-E1118 IonicContact NH2-OE1 3.77Å; R1109-E1118 PolarHBondContact NH2-OE1 3.29Å; R1109-E1118 VanDerWaalsContact NH2-OE1 3.07Å; L1113-E1118 HydrophobicContact CD2-CB 3.96Å; E1118-H1120 PolarHBondContact O-N 2.77Å; E1118-M1123 WeakPolarHBondContact O-CG 3.43Å
1119	D	91.1	Very high	94.4	Very high	38 Å²	38	8.3 Å²	8.3	20%	0.203	4%	0.043	C	C	.	.			trans	-97.4	69	-169.5	177.5	39.5	0	0	0	111.1	R830 K1156 Y1157	R830-D1119 PolarHBondContact NH1-O 3.1Å; R830-D1119 IonicContact NH1-OD2 3.29Å; R830-D1119 PolarHBondContact NH1-OD2 2.89Å; R830-D1119 PolarHBondContact NH2-O 3.44Å; D1119-K1156 IonicContact OD1-NZ 2.62Å; D1119-K1156 PolarHBondContact OD1-NZ 3.16Å; D1119-K1156 IonicContact OD2-NZ 3.08Å; D1119-K1156 PolarHBondContact OD2-NZ 3.44Å; D1119-Y1157 PolarHBondContact O-OH 3.04Å; D1119-Y1157 VanDerWaalsContact O-OH 3.12Å; D1119-Y1157 VanDerWaalsContact OD1-CE2 3.28Å; D1119-Y1157 WeakPolarHBondContact OD1-CE2 3.48Å; D1119-Y1157 PolarHBondContact OD1-OH 2.89Å; D1119-Y1157 PolarHBondContact OD2-OH 2.96Å; D1119-Y1157 VanDerWaalsContact OD2-OH 3.05Å
1120	H	93.8	Very high	94.5	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.043	C	C	.	.	S	Bend	trans	-142.5	141.5	-179.1	-174.7	-83.1	0	0	0	110.8	P789 H827 M1112 C1116 E1118 E1122 M1123 V1153	P789-H1120 PolarHBondContact O-NE2 3.23Å; P789-H1120 VanDerWaalsContact O-NE2 3.16Å; H827-H1120 AromaticContact CD2-NE2 3.88Å; M1112-H1120 HydrophobicContact CE-CB 4.13Å; M1112-H1120 WeakPolarHBondContact CE-ND1 3.04Å; C1116-H1120 VanDerWaalsContact SG-CB 3.59Å; E1118-H1120 PolarHBondContact O-N 2.77Å; H1120-E1122 VanDerWaalsContact C-N 3.31Å; H1120-E1122 VanDerWaalsContact ND1-CB 3.29Å; H1120-E1122 WeakPolarHBondContact ND1-CB 3.4Å; H1120-E1122 PolarHBondContact ND1-N 2.95Å; H1120-E1122 PolarHBondContact O-N 3.36Å; H1120-M1123 VanDerWaalsContact O-CB 3.22Å; H1120-M1123 WeakPolarHBondContact O-CB 3.49Å; H1120-M1123 PolarHBondContact O-N 3.06Å; H1120-V1153 WeakPolarHBondContact O-CG1 3.46Å
1121	P	93.5	Very high	94.5	Very high	6 Å²	6	7.8 Å²	7.8	4%	0.039	4%	0.041	C	C	.	.	H	α-helix	trans	-52.7	-43.3	-178.6	-26.5	32	0	0	0	114.3	L788 H827 M1123 A1124 Y1157	L788-P1121 HydrophobicContact CD2-CB 4.25Å; L788-P1121 HydrophobicContact CD2-CG 4.08Å; H827-P1121 VanDerWaalsContact CG-CD 3.46Å; P1121-M1123 PolarHBondContact O-N 3.27Å; P1121-A1124 VanDerWaalsContact O-CB 3.32Å; P1121-A1124 WeakPolarHBondContact O-CB 3.39Å; P1121-A1124 PolarHBondContact O-N 3.26Å; P1121-A1124 VanDerWaalsContact O-N 3.11Å; P1121-Y1157 HydrophobicContact CG-CD1 4.07Å; P1121-Y1157 HydrophobicContact CG-CD2 3.98Å; P1121-Y1157 HydrophobicContact CG-CG 3.72Å
1122	E	93.3	Very high	94.5	Very high	26 Å²	26	8 Å²	8	12%	0.121	4%	0.042	C	C	.	.	H	α-helix	trans	-63.3	-26.2	178.1	-158.7	75.4	167.9	0	0	113.5	M790 Q1083 M1112 H1120 A1124 L1125 I1126	M790-E1122 HydrophobicContact SD-CG 4.4Å; Q1083-E1122 PolarHBondContact NE2-OE1 2.86Å; M1112-E1122 HydrophobicContact CE-CB 3.77Å; M1112-E1122 HydrophobicContact CE-CG 4.39Å; H1120-E1122 VanDerWaalsContact C-N 3.31Å; H1120-E1122 VanDerWaalsContact ND1-CB 3.29Å; H1120-E1122 WeakPolarHBondContact ND1-CB 3.4Å; H1120-E1122 PolarHBondContact ND1-N 2.95Å; H1120-E1122 PolarHBondContact O-N 3.36Å; E1122-A1124 PolarHBondContact O-N 2.84Å; E1122-L1125 WeakPolarHBondContact O-CB 3.22Å; E1122-L1125 PolarHBondContact O-N 2.97Å; E1122-I1126 PolarHBondContact O-N 2.95Å; E1122-I1126 VanDerWaalsContact O-N 3.16Å
1123	M	95.8	Very high	94.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-61.7	-35.4	175.3	-172.2	62.1	74.3	0	0	110.8	R1109 M1112 L1113 G1117 E1118 H1120 P1121 L1125 I1126 D1127	R1109-M1123 HydrophobicContact CG-CE 4.49Å; R1109-M1123 HydrophobicContact CG-SD 3.73Å; M1112-M1123 HydrophobicContact CB-CE 3.78Å; M1112-M1123 HydrophobicContact CG-CE 3.55Å; M1112-M1123 HydrophobicContact CG-SD 4.45Å; L1113-M1123 HydrophobicContact CD2-CE 3.77Å; L1113-M1123 HydrophobicContact CG-CE 3.91Å; G1117-M1123 WeakPolarHBondContact O-CE 3.46Å; E1118-M1123 WeakPolarHBondContact O-CG 3.43Å; H1120-M1123 VanDerWaalsContact O-CB 3.22Å; H1120-M1123 WeakPolarHBondContact O-CB 3.49Å; H1120-M1123 PolarHBondContact O-N 3.06Å; P1121-M1123 PolarHBondContact O-N 3.27Å; M1123-L1125 VanDerWaalsContact C-N 3.25Å; M1123-L1125 PolarHBondContact O-N 3.48Å; M1123-I1126 PolarHBondContact O-N 3.29Å; M1123-D1127 WeakPolarHBondContact O-CB 3.32Å; M1123-D1127 PolarHBondContact O-N 3.37Å
1124	A	95.6	Very high	94.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-63.3	-32.9	176.1	0	0	0	0	0	112.2	P1121 E1122 S1128 A1150 V1153 N1154	P1121-A1124 VanDerWaalsContact O-CB 3.32Å; P1121-A1124 WeakPolarHBondContact O-CB 3.39Å; P1121-A1124 PolarHBondContact O-N 3.26Å; P1121-A1124 VanDerWaalsContact O-N 3.11Å; E1122-A1124 PolarHBondContact O-N 2.84Å; A1124-S1128 VanDerWaalsContact O-CB 3.24Å; A1124-S1128 WeakPolarHBondContact O-CB 3.17Å; A1124-S1128 PolarHBondContact O-N 3.33Å; A1124-S1128 PolarHBondContact O-OG 2.97Å; A1124-A1150 HydrophobicContact CB-CB 4.22Å; A1124-A1150 WeakPolarHBondContact O-CB 3.47Å; A1124-V1153 HydrophobicContact CB-CB 3.97Å; A1124-V1153 HydrophobicContact CB-CG1 3.81Å; A1124-N1154 VanDerWaalsContact CB-OD1 3.29Å; A1124-N1154 WeakPolarHBondContact CB-OD1 3.46Å
1125	L	94.8	Very high	94.5	Very high	39 Å²	39	8 Å²	8	20%	0.204	4%	0.042	C	C	.	.	H	α-helix	trans	-71.2	-44.8	176.6	-177.2	59.8	0	0	0	111	M1086 E1122 M1123 S1128 N1129 I1260	M1086-L1125 HydrophobicContact CE-CB 4.21Å; M1086-L1125 HydrophobicContact CE-CD2 3.69Å; M1086-L1125 HydrophobicContact CE-CG 3.6Å; E1122-L1125 WeakPolarHBondContact O-CB 3.22Å; E1122-L1125 PolarHBondContact O-N 2.97Å; M1123-L1125 VanDerWaalsContact C-N 3.25Å; M1123-L1125 PolarHBondContact O-N 3.48Å; L1125-S1128 PolarHBondContact O-N 2.91Å; L1125-N1129 PolarHBondContact O-N 2.87Å; L1125-N1129 PolarHBondContact O-ND2 3.42Å; L1125-I1260 HydrophobicContact CD1-CB 4.09Å; L1125-I1260 HydrophobicContact CD1-CD1 4.26Å; L1125-I1260 HydrophobicContact CD1-CG1 4.22Å; L1125-I1260 WeakPolarHBondContact CD1-O 3.49Å
1126	I	97	Very high	94.4	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-59.7	-47.8	174.8	-65.2	170.8	0	0	0	110.6	I1082 M1086 R1109 M1112 E1122 M1123 S1128 N1129 I1130	I1082-I1126 HydrophobicContact CG2-CD1 4.31Å; M1086-I1126 HydrophobicContact CE-CG1 3.67Å; M1086-I1126 HydrophobicContact CG-CG1 4.05Å; M1086-I1126 HydrophobicContact SD-CD1 3.89Å; M1086-I1126 HydrophobicContact SD-CG1 3.32Å; M1086-I1126 WeakPolarHBondContact SD-CG1 3.22Å; R1109-I1126 HydrophobicContact CB-CG2 3.69Å; R1109-I1126 HydrophobicContact CG-CG2 3.98Å; M1112-I1126 HydrophobicContact CB-CD1 3.84Å; M1112-I1126 HydrophobicContact CG-CD1 4.01Å; E1122-I1126 PolarHBondContact O-N 2.95Å; E1122-I1126 VanDerWaalsContact O-N 3.16Å; M1123-I1126 PolarHBondContact O-N 3.29Å; I1126-S1128 VanDerWaalsContact C-N 3.33Å; I1126-S1128 PolarHBondContact O-N 2.58Å; I1126-N1129 WeakPolarHBondContact O-CB 3.47Å; I1126-N1129 PolarHBondContact O-N 2.87Å; I1126-I1130 HydrophobicContact CG2-CD1 3.85Å; I1126-I1130 HydrophobicContact CG2-CG1 4.47Å; I1126-I1130 WeakPolarHBondContact O-CG1 3.49Å; I1126-I1130 PolarHBondContact O-N 3.01Å
1127	D	98	Very high	94.4	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-66.7	-35.1	-179.5	-75.6	-7.8	0	0	0	112.1	R1109 M1123 I1130 G1131 F1146 N1149 A1150	R1109-D1127 WeakPolarHBondContact CD-OD1 3.2Å; R1109-D1127 IonicContact CZ-OD1 2.98Å; R1109-D1127 IonicContact CZ-OD2 2.73Å; R1109-D1127 IonicContact NE-OD1 3.95Å; R1109-D1127 PolarHBondContact NE-OD1 3.3Å; R1109-D1127 IonicContact NE-OD2 2.72Å; R1109-D1127 IonicContact NH2-OD1 3.8Å; R1109-D1127 IonicContact NH2-OD2 3.01Å; R1109-D1127 PolarHBondContact NH2-OD2 3.38Å; R1109-D1127 VanDerWaalsContact NH2-OD2 3.17Å; M1123-D1127 WeakPolarHBondContact O-CB 3.32Å; M1123-D1127 PolarHBondContact O-N 3.37Å; D1127-I1130 PolarHBondContact O-N 2.96Å; D1127-G1131 PolarHBondContact O-N 3.16Å; D1127-F1146 HydrophobicContact CB-CB 4.34Å; D1127-F1146 HydrophobicContact CB-CD1 4.31Å; D1127-F1146 WeakPolarHBondContact OD1-CD1 3.5Å; D1127-N1149 PolarHBondContact OD2-ND2 2.78Å; D1127-A1150 HydrophobicContact CB-CB 4.01Å
1128	S	97.8	Very high	94.4	Very high	4 Å²	4	13.9 Å²	13.9	3%	0.028	7%	0.073	C	C	.	.	H	α-helix	trans	-63.4	-42.1	172	-61.6	0	0	0	0	111.9	A1124 L1125 I1126 L1132 A1150	A1124-S1128 VanDerWaalsContact O-CB 3.24Å; A1124-S1128 WeakPolarHBondContact O-CB 3.17Å; A1124-S1128 PolarHBondContact O-N 3.33Å; A1124-S1128 PolarHBondContact O-OG 2.97Å; L1125-S1128 PolarHBondContact O-N 2.91Å; I1126-S1128 VanDerWaalsContact C-N 3.33Å; I1126-S1128 PolarHBondContact O-N 2.58Å; S1128-L1132 WeakPolarHBondContact O-CB 3.44Å; S1128-L1132 VanDerWaalsContact O-CG 3.29Å; S1128-L1132 WeakPolarHBondContact O-CG 3.09Å; S1128-L1132 PolarHBondContact O-N 3.37Å; S1128-A1150 WeakPolarHBondContact OG-CB 3.48Å
1129	N	97.8	Very high	94.5	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.011	8%	0.084	C	C	.	.	H	α-helix	trans	-62.5	-50	175.1	-83.4	-82.8	0	0	0	111.4	L1105 L1125 I1126 G1131 L1132 V1133 L1257 I1260 N1261	L1105-N1129 HydrophobicContact CD1-CB 4.02Å; L1105-N1129 HydrophobicContact CD2-CB 3.69Å; L1125-N1129 PolarHBondContact O-N 2.87Å; L1125-N1129 PolarHBondContact O-ND2 3.42Å; I1126-N1129 WeakPolarHBondContact O-CB 3.47Å; I1126-N1129 PolarHBondContact O-N 2.87Å; N1129-G1131 PolarHBondContact O-N 2.78Å; N1129-L1132 PolarHBondContact O-N 2.91Å; N1129-V1133 WeakPolarHBondContact O-CG2 3.22Å; N1129-V1133 PolarHBondContact O-N 2.9Å; N1129-L1257 HydrophobicContact CB-CD2 4.31Å; N1129-L1257 VanDerWaalsContact OD1-CD2 3.3Å; N1129-L1257 WeakPolarHBondContact OD1-CD2 3.46Å; N1129-I1260 HydrophobicContact CB-CD1 4.48Å; N1129-N1261 PolarHBondContact ND2-ND2 2.85Å; N1129-N1261 PolarHBondContact ND2-OD1 3.03Å; N1129-N1261 PolarHBondContact OD1-ND2 2.93Å
1130	I	97.6	Very high	94.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-58.9	-48.8	177.9	-68.8	169.3	0	0	0	110.4	L1105 Y1106 R1109 I1126 D1127 L1132 V1133 L1134 F1146	L1105-I1130 HydrophobicContact CB-CD1 4.25Å; L1105-I1130 HydrophobicContact CB-CG1 3.6Å; L1105-I1130 HydrophobicContact CD1-CG1 4.14Å; L1105-I1130 HydrophobicContact CG-CG1 4.35Å; Y1106-I1130 HydrophobicContact CD1-CD1 4.08Å; Y1106-I1130 HydrophobicContact CD1-CG1 4.38Å; Y1106-I1130 HydrophobicContact CE1-CD1 4.38Å; Y1106-I1130 HydrophobicContact CE1-CG1 4.41Å; Y1106-I1130 HydrophobicContact CE1-CG2 3.81Å; R1109-I1130 HydrophobicContact CB-CD1 4.04Å; R1109-I1130 HydrophobicContact CG-CD1 4.34Å; I1126-I1130 HydrophobicContact CG2-CD1 3.85Å; I1126-I1130 HydrophobicContact CG2-CG1 4.47Å; I1126-I1130 WeakPolarHBondContact O-CG1 3.49Å; I1126-I1130 PolarHBondContact O-N 3.01Å; D1127-I1130 PolarHBondContact O-N 2.96Å; I1130-L1132 VanDerWaalsContact C-N 3.34Å; I1130-L1132 PolarHBondContact O-N 3.2Å; I1130-V1133 PolarHBondContact O-N 2.75Å; I1130-L1134 HydrophobicContact CG2-CD1 3.59Å; I1130-L1134 HydrophobicContact CG2-CG 4.23Å; I1130-L1134 WeakPolarHBondContact O-CB 3.28Å; I1130-L1134 VanDerWaalsContact O-CG 3.3Å; I1130-L1134 WeakPolarHBondContact O-CG 3.16Å; I1130-L1134 PolarHBondContact O-N 2.78Å; I1130-F1146 HydrophobicContact CB-CD1 4.16Å; I1130-F1146 HydrophobicContact CB-CE1 4.5Å; I1130-F1146 HydrophobicContact CB-CG 4.2Å; I1130-F1146 HydrophobicContact CD1-CD1 4.22Å; I1130-F1146 HydrophobicContact CD1-CE1 3.96Å; I1130-F1146 HydrophobicContact CG2-CB 4.34Å; I1130-F1146 HydrophobicContact CG2-CD1 3.81Å; I1130-F1146 HydrophobicContact CG2-CD2 3.53Å; I1130-F1146 HydrophobicContact CG2-CE1 3.9Å; I1130-F1146 HydrophobicContact CG2-CE2 3.65Å; I1130-F1146 HydrophobicContact CG2-CG 3.63Å; I1130-F1146 HydrophobicContact CG2-CZ 3.84Å
1131	G	96.8	Very high	94.7	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.8	-42.6	-179.6	0	0	0	0	0	112.9	D1127 N1129 H1135 S1143	D1127-G1131 PolarHBondContact O-N 3.16Å; N1129-G1131 PolarHBondContact O-N 2.78Å; G1131-H1135 WeakPolarHBondContact O-CB 3.34Å; G1131-H1135 PolarHBondContact O-N 3.44Å; G1131-S1143 WeakPolarHBondContact O-CB 3.29Å; G1131-S1143 PolarHBondContact O-OG 3.47Å
1132	L	96.4	Very high	94.7	Very high	4 Å²	4	22 Å²	22	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-68	-42.6	176.9	-78.5	175	0	0	0	113.1	S1128 N1129 I1130 L1134 H1135 G1136 L1171 I1253 Q1256 L1257 I1260	S1128-L1132 WeakPolarHBondContact O-CB 3.44Å; S1128-L1132 VanDerWaalsContact O-CG 3.29Å; S1128-L1132 WeakPolarHBondContact O-CG 3.09Å; S1128-L1132 PolarHBondContact O-N 3.37Å; N1129-L1132 PolarHBondContact O-N 2.91Å; I1130-L1132 VanDerWaalsContact C-N 3.34Å; I1130-L1132 PolarHBondContact O-N 3.2Å; L1132-L1134 VanDerWaalsContact C-N 3.34Å; L1132-H1135 WeakPolarHBondContact O-CB 3.32Å; L1132-H1135 PolarHBondContact O-N 3.19Å; L1132-G1136 PolarHBondContact O-N 3.37Å; L1132-G1136 VanDerWaalsContact O-N 3.14Å; L1132-L1171 HydrophobicContact CD1-CD1 4.23Å; L1132-L1171 HydrophobicContact CD2-CD1 4.31Å; L1132-L1171 HydrophobicContact CD2-CD2 3.91Å; L1132-L1171 HydrophobicContact CG-CD1 4.34Å; L1132-I1253 HydrophobicContact CB-CG2 4.19Å; L1132-I1253 WeakPolarHBondContact O-CG2 3.42Å; L1132-Q1256 HydrophobicContact CD1-CB 3.81Å; L1132-Q1256 HydrophobicContact CD2-CB 3.93Å; L1132-L1257 HydrophobicContact CB-CD2 3.78Å; L1132-L1257 HydrophobicContact CB-CG 4.17Å; L1132-L1257 HydrophobicContact CD1-CD2 3.81Å; L1132-L1257 HydrophobicContact CD1-CG 4.05Å; L1132-L1257 HydrophobicContact CG-CD2 4.47Å; L1132-I1260 HydrophobicContact CD1-CD1 3.66Å; L1132-I1260 HydrophobicContact CD1-CG1 4.25Å
1133	V	95.1	Very high	94.9	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.012	11%	0.105	C	C	.	.	H	α-helix	trans	-64.7	-42	176.8	179	0	0	0	0	110.4	F1093 L1102 L1105 N1129 I1130 H1135 G1136 V1137 L1257	F1093-V1133 HydrophobicContact CD2-CB 4.37Å; F1093-V1133 HydrophobicContact CD2-CG1 3.96Å; F1093-V1133 HydrophobicContact CD2-CG2 3.75Å; F1093-V1133 HydrophobicContact CE2-CB 4.43Å; F1093-V1133 HydrophobicContact CE2-CG1 4.14Å; F1093-V1133 HydrophobicContact CE2-CG2 4.13Å; F1093-V1133 HydrophobicContact CG-CG2 4.49Å; L1102-V1133 HydrophobicContact CD1-CG1 4.28Å; L1102-V1133 HydrophobicContact CD2-CB 3.93Å; L1102-V1133 HydrophobicContact CD2-CG1 3.57Å; L1102-V1133 HydrophobicContact CG-CG1 3.63Å; L1105-V1133 HydrophobicContact CD1-CG2 3.95Å; N1129-V1133 WeakPolarHBondContact O-CG2 3.22Å; N1129-V1133 PolarHBondContact O-N 2.9Å; I1130-V1133 PolarHBondContact O-N 2.75Å; V1133-H1135 VanDerWaalsContact C-N 3.34Å; V1133-H1135 PolarHBondContact O-N 3.5Å; V1133-G1136 PolarHBondContact O-N 3.28Å; V1133-G1136 VanDerWaalsContact O-N 3.13Å; V1133-V1137 PolarHBondContact O-N 3.35Å; V1133-L1257 HydrophobicContact CG2-CD1 4.22Å; V1133-L1257 HydrophobicContact CG2-CD2 4.4Å
1134	L	94.7	Very high	94.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-37.4	173.8	-73.1	172	0	0	0	113	C178 L1102 I1130 L1132 G1136 V1137 M1138 E1139 L1142 F1146	C178-L1134 HydrophobicContact CB-CD2 4.05Å; L1102-L1134 HydrophobicContact CD1-CD2 4.3Å; L1102-L1134 HydrophobicContact CD2-CD2 4.19Å; L1102-L1134 HydrophobicContact CD2-CG 4.16Å; I1130-L1134 HydrophobicContact CG2-CD1 3.59Å; I1130-L1134 HydrophobicContact CG2-CG 4.23Å; I1130-L1134 WeakPolarHBondContact O-CB 3.28Å; I1130-L1134 VanDerWaalsContact O-CG 3.3Å; I1130-L1134 WeakPolarHBondContact O-CG 3.16Å; I1130-L1134 PolarHBondContact O-N 2.78Å; L1132-L1134 VanDerWaalsContact C-N 3.34Å; L1134-G1136 PolarHBondContact O-N 2.97Å; L1134-V1137 HydrophobicContact CD2-CG2 4.22Å; L1134-V1137 VanDerWaalsContact O-CG2 3.3Å; L1134-V1137 WeakPolarHBondContact O-CG2 3.37Å; L1134-V1137 PolarHBondContact O-N 2.63Å; L1134-M1138 PolarHBondContact O-N 2.84Å; L1134-E1139 HydrophobicContact CB-CB 4.34Å; L1134-E1139 HydrophobicContact CD2-CB 3.97Å; L1134-E1139 HydrophobicContact CD2-CG 4.44Å; L1134-E1139 PolarHBondContact O-N 3.04Å; L1134-L1142 HydrophobicContact CD1-CB 3.76Å; L1134-F1146 HydrophobicContact CD1-CD2 3.7Å; L1134-F1146 HydrophobicContact CD1-CE2 3.88Å
1135	H	93	Very high	95	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.019	13%	0.133	C	C	.	.	H	α-helix	trans	-58.8	-40.6	173.1	-176.3	-157.7	0	0	0	110.7	G1131 L1132 V1133 M1138 Y1140 V1175 S1178 P1248	G1131-H1135 WeakPolarHBondContact O-CB 3.34Å; G1131-H1135 PolarHBondContact O-N 3.44Å; L1132-H1135 WeakPolarHBondContact O-CB 3.32Å; L1132-H1135 PolarHBondContact O-N 3.19Å; V1133-H1135 VanDerWaalsContact C-N 3.34Å; V1133-H1135 PolarHBondContact O-N 3.5Å; H1135-M1138 PolarHBondContact O-N 3.42Å; H1135-M1138 VanDerWaalsContact O-N 3.14Å; H1135-Y1140 AromaticContact CD2-CD1 3.85Å; H1135-Y1140 AromaticContact CD2-CE1 3.74Å; H1135-V1175 HydrophobicContact CB-CG2 4.19Å; H1135-S1178 PolarHBondContact NE2-OG 3.12Å; H1135-P1248 VanDerWaalsContact O-CG 3.26Å; H1135-P1248 WeakPolarHBondContact O-CG 3.43Å
1136	G	90.3	Very high	95.1	Very high	5 Å²	5	26 Å²	26	5%	0.052	12%	0.123	C	C	.	.	H	α-helix	trans	-65.7	-41.5	178.4	0	0	0	0	0	114.4	L1132 V1133 L1134 M1138 M1250	L1132-G1136 PolarHBondContact O-N 3.37Å; L1132-G1136 VanDerWaalsContact O-N 3.14Å; V1133-G1136 PolarHBondContact O-N 3.28Å; V1133-G1136 VanDerWaalsContact O-N 3.13Å; L1134-G1136 PolarHBondContact O-N 2.97Å; G1136-M1138 PolarHBondContact O-N 3.05Å; G1136-M1250 VanDerWaalsContact C-CE 3.45Å; G1136-M1250 WeakPolarHBondContact O-CE 3.1Å
1137	V	90.2	Very high	95.2	Very high	24 Å²	24	26.1 Å²	26.1	15%	0.145	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	7.4	174.9	-61.3	0	0	0	0	113.1	C178 L1098 V1133 L1134 E1139	C178-V1137 HydrophobicContact CB-CG2 4.38Å; L1098-V1137 HydrophobicContact CB-CG1 4.48Å; L1098-V1137 HydrophobicContact CD1-CG1 4.02Å; V1133-V1137 PolarHBondContact O-N 3.35Å; L1134-V1137 HydrophobicContact CD2-CG2 4.22Å; L1134-V1137 VanDerWaalsContact O-CG2 3.3Å; L1134-V1137 WeakPolarHBondContact O-CG2 3.37Å; L1134-V1137 PolarHBondContact O-N 2.63Å; V1137-E1139 VanDerWaalsContact C-N 3.3Å; V1137-E1139 HydrophobicContact CG2-CB 4.25Å; V1137-E1139 HydrophobicContact CG2-CG 4.05Å; V1137-E1139 PolarHBondContact O-N 3.28Å
1138	M	90.6	Very high	95.2	Very high	104 Å²	104	29.4 Å²	29.4	51%	0.512	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	20.2	176.2	-50.9	173.2	61.3	0	0	115	L1134 H1135 G1136 Y1140	L1134-M1138 PolarHBondContact O-N 2.84Å; H1135-M1138 PolarHBondContact O-N 3.42Å; H1135-M1138 VanDerWaalsContact O-N 3.14Å; G1136-M1138 PolarHBondContact O-N 3.05Å; M1138-Y1140 VanDerWaalsContact C-N 3.29Å; M1138-Y1140 HydrophobicContact CB-CE1 4.21Å; M1138-Y1140 HydrophobicContact CB-CE2 4.47Å; M1138-Y1140 PolarHBondContact O-N 3.38Å; M1138-Y1140 VanDerWaalsContact O-N 3.11Å
1139	E	92.3	Very high	95.1	Very high	86 Å²	86	30.7 Å²	30.7	40%	0.402	15%	0.145	S	C	.	.			trans	-86.4	66.2	174.2	-72	-62	157	0	0	110.7	C178 L1134 V1137 D1141 L1142 S1143	C178-E1139 HydrophobicContact CB-CG 4.18Å; L1134-E1139 HydrophobicContact CB-CB 4.34Å; L1134-E1139 HydrophobicContact CD2-CB 3.97Å; L1134-E1139 HydrophobicContact CD2-CG 4.44Å; L1134-E1139 PolarHBondContact O-N 3.04Å; V1137-E1139 VanDerWaalsContact C-N 3.3Å; V1137-E1139 HydrophobicContact CG2-CB 4.25Å; V1137-E1139 HydrophobicContact CG2-CG 4.05Å; V1137-E1139 PolarHBondContact O-N 3.28Å; E1139-D1141 PolarHBondContact O-N 3.31Å; E1139-L1142 HydrophobicContact CB-CD1 4.47Å; E1139-L1142 PolarHBondContact O-N 2.88Å; E1139-S1143 VanDerWaalsContact O-CB 3.29Å; E1139-S1143 WeakPolarHBondContact O-CB 3.46Å; E1139-S1143 PolarHBondContact O-N 2.82Å
1140	Y	93.3	Very high	95.1	Very high	40 Å²	40	30.6 Å²	30.6	16%	0.157	15%	0.145	C	C	.	.	H	α-helix	trans	-61.9	-38.1	-169.3	-53.3	-47.5	0	0	0	114	H1135 M1138 S1143 L1144 V1175	H1135-Y1140 AromaticContact CD2-CD1 3.85Å; H1135-Y1140 AromaticContact CD2-CE1 3.74Å; M1138-Y1140 VanDerWaalsContact C-N 3.29Å; M1138-Y1140 HydrophobicContact CB-CE1 4.21Å; M1138-Y1140 HydrophobicContact CB-CE2 4.47Å; M1138-Y1140 PolarHBondContact O-N 3.38Å; M1138-Y1140 VanDerWaalsContact O-N 3.11Å; Y1140-S1143 PolarHBondContact O-N 2.85Å; Y1140-L1144 WeakPolarHBondContact O-CB 3.34Å; Y1140-L1144 WeakPolarHBondContact O-CG 3.31Å; Y1140-L1144 PolarHBondContact O-N 3.09Å; Y1140-V1175 HydrophobicContact CD1-CG1 4.18Å; Y1140-V1175 HydrophobicContact CG-CG1 4.47Å
1141	D	94.4	Very high	95.1	Very high	94 Å²	94	31.4 Å²	31.4	50%	0.503	15%	0.149	S	C	.	.	H	α-helix	trans	-66.6	-43	-179.9	-80.7	-71.4	0	0	0	112.4	E1139 R1145 K1179	E1139-D1141 PolarHBondContact O-N 3.31Å; D1141-R1145 WeakPolarHBondContact O-CG 3.27Å; D1141-R1145 PolarHBondContact O-N 3.25Å; D1141-K1179 IonicContact OD1-NZ 3.37Å; D1141-K1179 PolarHBondContact OD1-NZ 2.81Å; D1141-K1179 IonicContact OD2-NZ 3.57Å; D1141-K1179 PolarHBondContact OD2-NZ 3.4Å
1142	L	94.9	Very high	95.2	Very high	28 Å²	28	35.8 Å²	35.8	15%	0.147	18%	0.176	C	C	.	.	H	α-helix	trans	-69	-43.3	174.7	-67.9	171.8	0	0	0	110.3	P180 L185 L1134 E1139 L1144 R1145 F1146	P180-L1142 HydrophobicContact CG-CD1 4.44Å; P180-L1142 HydrophobicContact CG-CD2 4.12Å; L185-L1142 HydrophobicContact CD2-CD2 4.13Å; L1134-L1142 HydrophobicContact CD1-CB 3.76Å; E1139-L1142 HydrophobicContact CB-CD1 4.47Å; E1139-L1142 PolarHBondContact O-N 2.88Å; L1142-L1144 VanDerWaalsContact C-N 3.35Å; L1142-L1144 PolarHBondContact O-N 3.35Å; L1142-R1145 WeakPolarHBondContact O-CB 3.22Å; L1142-R1145 PolarHBondContact O-N 3.38Å; L1142-R1145 VanDerWaalsContact O-N 3.15Å; L1142-F1146 VanDerWaalsContact O-CD2 3.25Å; L1142-F1146 WeakPolarHBondContact O-CD2 3.39Å; L1142-F1146 PolarHBondContact O-N 3.36Å
1143	S	96.4	Very high	95.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-53.1	-49.1	176.1	178.8	0	0	0	0	112.3	G1131 E1139 Y1140 R1145 F1146 L1147	G1131-S1143 WeakPolarHBondContact O-CB 3.29Å; G1131-S1143 PolarHBondContact O-OG 3.47Å; E1139-S1143 VanDerWaalsContact O-CB 3.29Å; E1139-S1143 WeakPolarHBondContact O-CB 3.46Å; E1139-S1143 PolarHBondContact O-N 2.82Å; Y1140-S1143 PolarHBondContact O-N 2.85Å; S1143-R1145 PolarHBondContact O-N 3.13Å; S1143-F1146 PolarHBondContact O-N 3.07Å; S1143-L1147 WeakPolarHBondContact O-CG 3.33Å; S1143-L1147 PolarHBondContact O-N 3.25Å
1144	L	97.1	Very high	95.2	Very high	10 Å²	10	36.5 Å²	36.5	5%	0.052	18%	0.18	C	C	.	.	H	α-helix	trans	-58.7	-44.8	176.9	-77.2	171.5	0	0	0	112.2	Y1140 L1142 F1146 L1147 E1148 V1172 V1175 Y1176 K1179	Y1140-L1144 WeakPolarHBondContact O-CB 3.34Å; Y1140-L1144 WeakPolarHBondContact O-CG 3.31Å; Y1140-L1144 PolarHBondContact O-N 3.09Å; L1142-L1144 VanDerWaalsContact C-N 3.35Å; L1142-L1144 PolarHBondContact O-N 3.35Å; L1144-F1146 VanDerWaalsContact C-N 3.31Å; L1144-F1146 PolarHBondContact O-N 2.83Å; L1144-L1147 PolarHBondContact O-N 3.03Å; L1144-E1148 VanDerWaalsContact O-CB 3.27Å; L1144-E1148 WeakPolarHBondContact O-CB 3.37Å; L1144-E1148 VanDerWaalsContact O-CG 3.26Å; L1144-E1148 WeakPolarHBondContact O-CG 3.38Å; L1144-E1148 PolarHBondContact O-N 3.22Å; L1144-V1172 HydrophobicContact CD2-CG1 4.13Å; L1144-V1175 HydrophobicContact CD1-CG1 4.37Å; L1144-V1175 HydrophobicContact CD2-CB 3.85Å; L1144-V1175 HydrophobicContact CD2-CG1 3.9Å; L1144-V1175 HydrophobicContact CG-CB 4.21Å; L1144-V1175 HydrophobicContact CG-CG1 3.67Å; L1144-Y1176 HydrophobicContact CD1-CD1 4.03Å; L1144-Y1176 HydrophobicContact CD1-CE1 3.69Å; L1144-Y1176 HydrophobicContact CD2-CD1 4.39Å; L1144-Y1176 HydrophobicContact CD2-CD2 3.88Å; L1144-Y1176 HydrophobicContact CD2-CE1 4.22Å; L1144-Y1176 HydrophobicContact CD2-CE2 3.66Å; L1144-Y1176 HydrophobicContact CD2-CG 4.22Å; L1144-K1179 HydrophobicContact CD1-CD 4.31Å
1145	R	96.6	Very high	95.3	Very high	139 Å²	139	38.8 Å²	38.8	53%	0.525	19%	0.194	S	C	.	.	H	α-helix	trans	-56.3	-44.5	179.1	-70.5	179.9	-170.6	-167.1	3.8	112.4	D1141 L1142 S1143 N1149	D1141-R1145 WeakPolarHBondContact O-CG 3.27Å; D1141-R1145 PolarHBondContact O-N 3.25Å; L1142-R1145 WeakPolarHBondContact O-CB 3.22Å; L1142-R1145 PolarHBondContact O-N 3.38Å; L1142-R1145 VanDerWaalsContact O-N 3.15Å; S1143-R1145 PolarHBondContact O-N 3.13Å; R1145-N1149 PolarHBondContact O-N 3.24Å
1146	F	97.9	Very high	95.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-72.1	-45.3	178.5	-73.3	-81	0	0	0	111.9	P180 L185 P186 D1127 I1130 L1134 L1142 S1143 L1144 E1148 N1149 A1150	P180-F1146 HydrophobicContact CB-CZ 4.36Å; P180-F1146 HydrophobicContact CG-CE2 4.29Å; P180-F1146 HydrophobicContact CG-CZ 4.42Å; L185-F1146 HydrophobicContact CD2-CE2 4.26Å; L185-F1146 HydrophobicContact CD2-CZ 4.25Å; P186-F1146 HydrophobicContact CG-CD1 3.57Å; P186-F1146 HydrophobicContact CG-CE1 3.81Å; P186-F1146 HydrophobicContact CG-CG 4.02Å; P186-F1146 HydrophobicContact CG-CZ 4.42Å; D1127-F1146 HydrophobicContact CB-CB 4.34Å; D1127-F1146 HydrophobicContact CB-CD1 4.31Å; D1127-F1146 WeakPolarHBondContact OD1-CD1 3.5Å; I1130-F1146 HydrophobicContact CB-CD1 4.16Å; I1130-F1146 HydrophobicContact CB-CE1 4.5Å; I1130-F1146 HydrophobicContact CB-CG 4.2Å; I1130-F1146 HydrophobicContact CD1-CD1 4.22Å; I1130-F1146 HydrophobicContact CD1-CE1 3.96Å; I1130-F1146 HydrophobicContact CG2-CB 4.34Å; I1130-F1146 HydrophobicContact CG2-CD1 3.81Å; I1130-F1146 HydrophobicContact CG2-CD2 3.53Å; I1130-F1146 HydrophobicContact CG2-CE1 3.9Å; I1130-F1146 HydrophobicContact CG2-CE2 3.65Å; I1130-F1146 HydrophobicContact CG2-CG 3.63Å; I1130-F1146 HydrophobicContact CG2-CZ 3.84Å; L1134-F1146 HydrophobicContact CD1-CD2 3.7Å; L1134-F1146 HydrophobicContact CD1-CE2 3.88Å; L1142-F1146 VanDerWaalsContact O-CD2 3.25Å; L1142-F1146 WeakPolarHBondContact O-CD2 3.39Å; L1142-F1146 PolarHBondContact O-N 3.36Å; S1143-F1146 PolarHBondContact O-N 3.07Å; L1144-F1146 VanDerWaalsContact C-N 3.31Å; L1144-F1146 PolarHBondContact O-N 2.83Å; F1146-E1148 PolarHBondContact O-N 2.77Å; F1146-N1149 PolarHBondContact O-N 2.87Å; F1146-A1150 PolarHBondContact O-N 2.79Å
1147	L	98	Very high	95.6	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-35	-179.4	-67.7	179.6	0	0	0	113.3	S1143 L1144 A1150 L1151 L1171 V1172 V1175	S1143-L1147 WeakPolarHBondContact O-CG 3.33Å; S1143-L1147 PolarHBondContact O-N 3.25Å; L1144-L1147 PolarHBondContact O-N 3.03Å; L1147-A1150 PolarHBondContact O-N 2.84Å; L1147-L1151 WeakPolarHBondContact O-CB 3.48Å; L1147-L1151 PolarHBondContact O-N 3.36Å; L1147-L1171 HydrophobicContact CD1-CB 4.24Å; L1147-L1171 HydrophobicContact CD2-CB 4.41Å; L1147-L1171 HydrophobicContact CD2-CD1 4.37Å; L1147-V1172 HydrophobicContact CB-CG2 3.74Å; L1147-V1175 HydrophobicContact CD1-CG2 3.55Å
1148	E	97.6	Very high	95.7	Very high	69 Å²	69	42.2 Å²	42.2	32%	0.322	21%	0.206	S	C	.	.	H	α-helix	trans	-69.4	-36.4	175.2	-72.3	178	164.3	0	0	111.7	L1144 F1146 L1151 T1152 V1172 Y1176	L1144-E1148 VanDerWaalsContact O-CB 3.27Å; L1144-E1148 WeakPolarHBondContact O-CB 3.37Å; L1144-E1148 VanDerWaalsContact O-CG 3.26Å; L1144-E1148 WeakPolarHBondContact O-CG 3.38Å; L1144-E1148 PolarHBondContact O-N 3.22Å; F1146-E1148 PolarHBondContact O-N 2.77Å; E1148-L1151 PolarHBondContact O-N 2.88Å; E1148-T1152 WeakPolarHBondContact O-CB 3.49Å; E1148-T1152 PolarHBondContact O-N 3.5Å; E1148-T1152 PolarHBondContact O-OG1 2.83Å; E1148-V1172 HydrophobicContact CG-CG2 4.46Å; E1148-Y1176 PolarHBondContact OE1-OH 2.95Å
1149	N	97.3	Very high	95.8	Very high	30 Å²	30	38 Å²	38	16%	0.16	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-46.3	171	-167.5	57.1	0	0	0	111	P186 D1127 R1145 F1146 L1151 T1152 V1153	P186-N1149 HydrophobicContact CB-CB 3.81Å; P186-N1149 HydrophobicContact CG-CB 4.19Å; D1127-N1149 PolarHBondContact OD2-ND2 2.78Å; R1145-N1149 PolarHBondContact O-N 3.24Å; F1146-N1149 PolarHBondContact O-N 2.87Å; N1149-L1151 VanDerWaalsContact C-N 3.32Å; N1149-L1151 PolarHBondContact O-N 3.26Å; N1149-T1152 WeakPolarHBondContact O-CB 3.26Å; N1149-T1152 PolarHBondContact O-N 2.62Å; N1149-T1152 VanDerWaalsContact O-N 3.13Å; N1149-V1153 WeakPolarHBondContact O-CG2 3.42Å; N1149-V1153 PolarHBondContact O-N 3.5Å
1150	A	97.8	Very high	95.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.1	-42.8	175.3	0	0	0	0	0	112.3	A1124 D1127 S1128 F1146 L1147 V1153 N1154	A1124-A1150 HydrophobicContact CB-CB 4.22Å; A1124-A1150 WeakPolarHBondContact O-CB 3.47Å; D1127-A1150 HydrophobicContact CB-CB 4.01Å; S1128-A1150 WeakPolarHBondContact OG-CB 3.48Å; F1146-A1150 PolarHBondContact O-N 2.79Å; L1147-A1150 PolarHBondContact O-N 2.84Å; A1150-V1153 PolarHBondContact O-N 3.43Å; A1150-N1154 VanDerWaalsContact O-CB 3.25Å; A1150-N1154 WeakPolarHBondContact O-CB 3.34Å; A1150-N1154 PolarHBondContact O-N 2.9Å; A1150-N1154 PolarHBondContact O-ND2 2.81Å
1151	L	97.6	Very high	95.7	Very high	17 Å²	17	44 Å²	44	9%	0.089	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-44.3	174.7	174.5	62.5	0	0	0	111.6	L1147 E1148 N1149 T1155 V1165 V1172	L1147-L1151 WeakPolarHBondContact O-CB 3.48Å; L1147-L1151 PolarHBondContact O-N 3.36Å; E1148-L1151 PolarHBondContact O-N 2.88Å; N1149-L1151 VanDerWaalsContact C-N 3.32Å; N1149-L1151 PolarHBondContact O-N 3.26Å; L1151-T1155 VanDerWaalsContact O-CB 3.26Å; L1151-T1155 WeakPolarHBondContact O-CB 3.5Å; L1151-T1155 PolarHBondContact O-N 3.07Å; L1151-T1155 PolarHBondContact O-OG1 3.2Å; L1151-V1165 HydrophobicContact CD1-CG1 3.96Å; L1151-V1172 HydrophobicContact CD2-CG2 4.48Å
1152	T	97	Very high	95.6	Very high	93 Å²	93	40.9 Å²	40.9	57%	0.571	21%	0.206	S	C	*	.	H	α-helix	trans	-62	-48.5	179.1	-59.5	0	0	0	0	111.1	E1148 N1149 T1155 K1156	E1148-T1152 WeakPolarHBondContact O-CB 3.49Å; E1148-T1152 PolarHBondContact O-N 3.5Å; E1148-T1152 PolarHBondContact O-OG1 2.83Å; N1149-T1152 WeakPolarHBondContact O-CB 3.26Å; N1149-T1152 PolarHBondContact O-N 2.62Å; N1149-T1152 VanDerWaalsContact O-N 3.13Å; T1152-T1155 PolarHBondContact O-N 3.11Å; T1152-K1156 PolarHBondContact O-N 3.28Å; T1152-K1156 VanDerWaalsContact O-N 3.09Å
1153	V	96.1	Very high	95.5	Very high	8 Å²	8	42.7 Å²	42.7	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-45.3	179.2	175.6	0	0	0	0	111.2	H1120 A1124 N1149 A1150 T1155 K1156 Y1157	H1120-V1153 WeakPolarHBondContact O-CG1 3.46Å; A1124-V1153 HydrophobicContact CB-CB 3.97Å; A1124-V1153 HydrophobicContact CB-CG1 3.81Å; N1149-V1153 WeakPolarHBondContact O-CG2 3.42Å; N1149-V1153 PolarHBondContact O-N 3.5Å; A1150-V1153 PolarHBondContact O-N 3.43Å; V1153-T1155 VanDerWaalsContact C-N 3.32Å; V1153-T1155 PolarHBondContact O-N 2.82Å; V1153-K1156 PolarHBondContact O-N 3Å; V1153-Y1157 HydrophobicContact CG1-CD2 3.66Å; V1153-Y1157 HydrophobicContact CG1-CE2 3.97Å; V1153-Y1157 WeakPolarHBondContact O-CD2 3.07Å; V1153-Y1157 PolarHBondContact O-N 3.31Å
1154	N	96.3	Very high	95.3	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-40.2	175.9	-80.4	-25.9	0	0	0	112.1	A1124 A1150 K1156 H1158 V1165 S1168	A1124-N1154 VanDerWaalsContact CB-OD1 3.29Å; A1124-N1154 WeakPolarHBondContact CB-OD1 3.46Å; A1150-N1154 VanDerWaalsContact O-CB 3.25Å; A1150-N1154 WeakPolarHBondContact O-CB 3.34Å; A1150-N1154 PolarHBondContact O-N 2.9Å; A1150-N1154 PolarHBondContact O-ND2 2.81Å; N1154-K1156 VanDerWaalsContact C-N 3.32Å; N1154-K1156 PolarHBondContact O-N 3.34Å; N1154-H1158 WeakPolarHBondContact O-CA 3.33Å; N1154-H1158 WeakPolarHBondContact O-CB 3.35Å; N1154-H1158 PolarHBondContact O-N 2.9Å; N1154-H1158 PolarHBondContact OD1-CD2 3.03Å; N1154-V1165 HydrophobicContact CB-CG2 4.18Å; N1154-S1168 PolarHBondContact ND2-OG 2.91Å
1155	T	96.3	Very high	95.2	Very high	48 Å²	48	47.3 Å²	47.3	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-40.4	177.6	-61.1	0	0	0	0	111.5	L1151 T1152 V1153 G1159 A1160	L1151-T1155 VanDerWaalsContact O-CB 3.26Å; L1151-T1155 WeakPolarHBondContact O-CB 3.5Å; L1151-T1155 PolarHBondContact O-N 3.07Å; L1151-T1155 PolarHBondContact O-OG1 3.2Å; T1152-T1155 PolarHBondContact O-N 3.11Å; V1153-T1155 VanDerWaalsContact C-N 3.32Å; V1153-T1155 PolarHBondContact O-N 2.82Å; T1155-G1159 CarbonylContact O-C 3.42Å; T1155-G1159 WeakPolarHBondContact O-CA 3.16Å; T1155-G1159 PolarHBondContact O-N 2.89Å; T1155-A1160 HydrophobicContact CG2-CB 4.02Å
1156	K	95.3	Very high	95.1	Very high	67 Å²	67	40.7 Å²	40.7	29%	0.291	21%	0.211	S	C	.	.	H	α-helix	trans	-66	-51	177.4	-178.9	179.5	176.1	-179.4	0	112.2	E826 D1119 T1152 V1153 N1154	E826-K1156 WeakPolarHBondContact OE2-CE 3.44Å; E826-K1156 IonicContact OE2-NZ 3.09Å; E826-K1156 PolarHBondContact OE2-NZ 2.84Å; D1119-K1156 IonicContact OD1-NZ 2.62Å; D1119-K1156 PolarHBondContact OD1-NZ 3.16Å; D1119-K1156 IonicContact OD2-NZ 3.08Å; D1119-K1156 PolarHBondContact OD2-NZ 3.44Å; T1152-K1156 PolarHBondContact O-N 3.28Å; T1152-K1156 VanDerWaalsContact O-N 3.09Å; V1153-K1156 PolarHBondContact O-N 3Å; N1154-K1156 VanDerWaalsContact C-N 3.32Å; N1154-K1156 PolarHBondContact O-N 3.34Å
1157	Y	95	Very high	94.9	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-91.2	-38.6	-168.1	-70.7	-64.4	0	0	0	114.8	H785 Q824 E826 H827 D1119 P1121 V1153	H785-Y1157 PolarHBondContact CE1-O 2.85Å; Q824-Y1157 VanDerWaalsContact O-CD1 3.27Å; Q824-Y1157 WeakPolarHBondContact O-CD1 3.5Å; E826-Y1157 HydrophobicContact CB-CE1 4.34Å; H827-Y1157 HydrophobicContact CB-CE1 4Å; H827-Y1157 AromaticContact ND1-CD1 3.57Å; H827-Y1157 AromaticContact ND1-CE1 3.42Å; H827-Y1157 WeakPolarHBondContact ND1-CE1 3.42Å; D1119-Y1157 PolarHBondContact O-OH 3.04Å; D1119-Y1157 VanDerWaalsContact O-OH 3.12Å; D1119-Y1157 VanDerWaalsContact OD1-CE2 3.28Å; D1119-Y1157 WeakPolarHBondContact OD1-CE2 3.48Å; D1119-Y1157 PolarHBondContact OD1-OH 2.89Å; D1119-Y1157 PolarHBondContact OD2-OH 2.96Å; D1119-Y1157 VanDerWaalsContact OD2-OH 3.05Å; P1121-Y1157 HydrophobicContact CG-CD1 4.07Å; P1121-Y1157 HydrophobicContact CG-CD2 3.98Å; P1121-Y1157 HydrophobicContact CG-CG 3.72Å; V1153-Y1157 HydrophobicContact CG1-CD2 3.66Å; V1153-Y1157 HydrophobicContact CG1-CE2 3.97Å; V1153-Y1157 WeakPolarHBondContact O-CD2 3.07Å; V1153-Y1157 PolarHBondContact O-N 3.31Å
1158	H	92.4	Very high	94.9	Very high	36 Å²	36	42.1 Å²	42.1	17%	0.167	22%	0.219	C	C	.	.	H	α-helix	trans	-90.6	-14.2	176.5	-63.9	-65	0	0	0	112.8	H785 N1154 S1162 K1164	H785-H1158 AromaticContact CD2-CE1 3.23Å; H785-H1158 PolarHBondContact CD2-CE1 2.88Å; H785-H1158 AromaticContact CD2-ND1 3.83Å; H785-H1158 AromaticContact CE1-CE1 3.63Å; H785-H1158 AromaticContact CE1-ND1 3.4Å; H785-H1158 PolarHBondContact CE1-ND1 2.87Å; H785-H1158 AromaticContact CG-CE1 3.45Å; H785-H1158 VanDerWaalsContact CG-CE1 3.45Å; H785-H1158 AromaticContact CG-ND1 3.86Å; H785-H1158 AromaticContact ND1-CE1 3.66Å; H785-H1158 AromaticContact ND1-ND1 3.58Å; H785-H1158 AromaticContact NE2-CE1 3.35Å; H785-H1158 PolarHBondContact NE2-CE1 2.8Å; H785-H1158 VanDerWaalsContact NE2-CE1 3.35Å; H785-H1158 AromaticContact NE2-ND1 3.53Å; N1154-H1158 WeakPolarHBondContact O-CA 3.33Å; N1154-H1158 WeakPolarHBondContact O-CB 3.35Å; N1154-H1158 PolarHBondContact O-N 2.9Å; N1154-H1158 PolarHBondContact OD1-CD2 3.03Å; H1158-S1162 WeakPolarHBondContact O-CB 3.45Å; H1158-K1164 VanDerWaalsContact CD2-CD 3.45Å; H1158-K1164 WeakPolarHBondContact CD2-CD 3.08Å; H1158-K1164 PolarHBondContact CE1-NZ 3.01Å; H1158-K1164 VanDerWaalsContact CE1-NZ 3.33Å; H1158-K1164 VanDerWaalsContact NE2-CD 3.26Å; H1158-K1164 WeakPolarHBondContact NE2-CD 3.25Å; H1158-K1164 PolarHBondContact NE2-NZ 3.05Å; H1158-K1164 VanDerWaalsContact NE2-NZ 3.13Å
1159	G	91.8	Very high	94.9	Very high	15 Å²	15	40 Å²	40	16%	0.155	21%	0.209	C	C	.	.			trans	87.5	146.9	-178.6	0	0	0	0	0	113.2	T1155 R1161 S1162 V1165	T1155-G1159 CarbonylContact O-C 3.42Å; T1155-G1159 WeakPolarHBondContact O-CA 3.16Å; T1155-G1159 PolarHBondContact O-N 2.89Å; G1159-R1161 PolarHBondContact O-N 2.94Å; G1159-S1162 VanDerWaalsContact O-CB 3.28Å; G1159-S1162 WeakPolarHBondContact O-CB 3.36Å; G1159-S1162 PolarHBondContact O-N 2.86Å; G1159-V1165 VanDerWaalsContact O-CG2 3.32Å; G1159-V1165 WeakPolarHBondContact O-CG2 3.34Å
1160	A	91.8	Very high	94.8	Very high	61 Å²	61	40 Å²	40	50%	0.504	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.5	-173	0	0	0	0	0	115.8	T1155 I1195	T1155-A1160 HydrophobicContact CG2-CB 4.02Å; A1160-I1195 WeakPolarHBondContact O-CD1 3.33Å
1161	R	91.9	Very high	94.7	Very high	192 Å²	192	40.1 Å²	40.1	73%	0.725	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.8	9.4	177.5	-59.6	-175.8	-179.7	174	0.5	113	G1159 I1195 Q1199	G1159-R1161 PolarHBondContact O-N 2.94Å; R1161-I1195 WeakPolarHBondContact O-CG2 3.38Å; R1161-Q1199 WeakPolarHBondContact O-CG 3.36Å; R1161-Q1199 PolarHBondContact O-NE2 3.34Å
1162	S	92.9	Very high	94.7	Very high	28 Å²	28	39.3 Å²	39.3	20%	0.196	20%	0.204	C	C	.	.	S	Bend	trans	-75.4	148.2	179.9	175.7	0	0	0	0	112.1	H1158 G1159 K1164 V1165 A1166	H1158-S1162 WeakPolarHBondContact O-CB 3.45Å; G1159-S1162 VanDerWaalsContact O-CB 3.28Å; G1159-S1162 WeakPolarHBondContact O-CB 3.36Å; G1159-S1162 PolarHBondContact O-N 2.86Å; S1162-K1164 PolarHBondContact O-N 3.27Å; S1162-K1164 PolarHBondContact OG-N 3.23Å; S1162-V1165 WeakPolarHBondContact O-CB 3.43Å; S1162-V1165 PolarHBondContact O-N 2.8Å; S1162-A1166 PolarHBondContact O-N 3.36Å; S1162-A1166 VanDerWaalsContact O-N 3.12Å
1163	L	92.4	Very high	94.6	Very high	66 Å²	66	34.9 Å²	34.9	35%	0.346	18%	0.177	S	C	.	.	H	α-helix	trans	-59.7	-31.1	173.7	-60.5	169.2	0	0	0	112.3	V1165 A1166 L1167 Y1196 Q1199 M1200	L1163-V1165 VanDerWaalsContact C-N 3.31Å; L1163-V1165 PolarHBondContact O-N 3.44Å; L1163-A1166 WeakPolarHBondContact O-CB 3.39Å; L1163-A1166 PolarHBondContact O-N 3.19Å; L1163-L1167 PolarHBondContact O-N 2.73Å; L1163-Y1196 HydrophobicContact CD2-CD1 3.86Å; L1163-Y1196 HydrophobicContact CD2-CE1 4.09Å; L1163-Q1199 HydrophobicContact CD2-CB 3.94Å; L1163-Q1199 HydrophobicContact CD2-CG 4.47Å; L1163-M1200 HydrophobicContact CD1-CE 3.21Å; L1163-M1200 HydrophobicContact CD1-SD 3.91Å; L1163-M1200 HydrophobicContact CD2-CE 3.8Å; L1163-M1200 HydrophobicContact CD2-CG 3.7Å; L1163-M1200 HydrophobicContact CD2-SD 3.88Å; L1163-M1200 HydrophobicContact CG-CE 4.13Å; L1163-M1200 HydrophobicContact CG-SD 4.48Å
1164	K	91.8	Very high	94.5	Very high	106 Å²	106	36.5 Å²	36.5	46%	0.461	18%	0.182	S	C	.	.	H	α-helix	trans	-64.2	-37.1	174.1	-73.2	-172.3	174.1	-165.1	0	112	H1158 S1162 L1167 S1168	H1158-K1164 VanDerWaalsContact CD2-CD 3.45Å; H1158-K1164 WeakPolarHBondContact CD2-CD 3.08Å; H1158-K1164 PolarHBondContact CE1-NZ 3.01Å; H1158-K1164 VanDerWaalsContact CE1-NZ 3.33Å; H1158-K1164 VanDerWaalsContact NE2-CD 3.26Å; H1158-K1164 WeakPolarHBondContact NE2-CD 3.25Å; H1158-K1164 PolarHBondContact NE2-NZ 3.05Å; H1158-K1164 VanDerWaalsContact NE2-NZ 3.13Å; S1162-K1164 PolarHBondContact O-N 3.27Å; S1162-K1164 PolarHBondContact OG-N 3.23Å; K1164-L1167 PolarHBondContact O-N 3.2Å; K1164-S1168 PolarHBondContact O-N 2.89Å; K1164-S1168 PolarHBondContact O-OG 3.42Å
1165	V	95.4	Very high	94.4	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-69.8	-39.9	176.1	177	0	0	0	0	110.8	L1151 N1154 G1159 S1162 L1163 L1167 S1168 H1169 I1195	L1151-V1165 HydrophobicContact CD1-CG1 3.96Å; N1154-V1165 HydrophobicContact CB-CG2 4.18Å; G1159-V1165 VanDerWaalsContact O-CG2 3.32Å; G1159-V1165 WeakPolarHBondContact O-CG2 3.34Å; S1162-V1165 WeakPolarHBondContact O-CB 3.43Å; S1162-V1165 PolarHBondContact O-N 2.8Å; L1163-V1165 VanDerWaalsContact C-N 3.31Å; L1163-V1165 PolarHBondContact O-N 3.44Å; V1165-L1167 VanDerWaalsContact C-N 3.31Å; V1165-L1167 PolarHBondContact O-N 2.69Å; V1165-S1168 PolarHBondContact O-N 3.29Å; V1165-H1169 PolarHBondContact O-CD2 3.22Å; V1165-H1169 PolarHBondContact O-N 3.27Å; V1165-I1195 HydrophobicContact CB-CD1 4.42Å; V1165-I1195 HydrophobicContact CG1-CD1 3.97Å
1166	A	95.1	Very high	94.3	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59	-43.7	173.5	0	0	0	0	0	111.7	S1162 L1163 H1169 H1170 I1195 Y1196	S1162-A1166 PolarHBondContact O-N 3.36Å; S1162-A1166 VanDerWaalsContact O-N 3.12Å; L1163-A1166 WeakPolarHBondContact O-CB 3.39Å; L1163-A1166 PolarHBondContact O-N 3.19Å; A1166-H1169 PolarHBondContact O-N 2.84Å; A1166-H1170 PolarHBondContact O-N 3.11Å; A1166-I1195 HydrophobicContact CB-CB 3.83Å; A1166-I1195 HydrophobicContact CB-CD1 4.3Å; A1166-I1195 HydrophobicContact CB-CG2 3.77Å; A1166-Y1196 HydrophobicContact CB-CD1 4.03Å; A1166-Y1196 HydrophobicContact CB-CD2 3.97Å; A1166-Y1196 HydrophobicContact CB-CE1 3.74Å; A1166-Y1196 HydrophobicContact CB-CE2 3.69Å; A1166-Y1196 HydrophobicContact CB-CG 4.13Å
1167	L	94	Very high	94.1	Very high	28 Å²	28	32.7 Å²	32.7	15%	0.147	16%	0.161	C	C	.	.	H	α-helix	trans	-63.7	-46.5	174.3	-178	59.8	0	0	0	111.8	L1163 K1164 V1165 H1169 H1170 L1171 Y1196 I1259 I1260	L1163-L1167 PolarHBondContact O-N 2.73Å; K1164-L1167 PolarHBondContact O-N 3.2Å; V1165-L1167 VanDerWaalsContact C-N 3.31Å; V1165-L1167 PolarHBondContact O-N 2.69Å; L1167-H1169 VanDerWaalsContact C-N 3.3Å; L1167-H1169 PolarHBondContact O-N 2.96Å; L1167-H1170 WeakPolarHBondContact O-CB 3.28Å; L1167-H1170 PolarHBondContact O-N 3.19Å; L1167-H1170 VanDerWaalsContact O-N 3.09Å; L1167-L1171 HydrophobicContact CD1-CD2 4.41Å; L1167-L1171 HydrophobicContact CD1-CG 4.37Å; L1167-L1171 HydrophobicContact CG-CG 4.45Å; L1167-L1171 WeakPolarHBondContact O-CG 3.47Å; L1167-L1171 PolarHBondContact O-N 3.27Å; L1167-Y1196 PolarHBondContact N-OH 3.47Å; L1167-I1259 HydrophobicContact CD2-CG2 3.87Å; L1167-I1260 HydrophobicContact CD2-CG2 3.79Å
1168	S	96.5	Very high	93.9	Very high	5 Å²	5	33.5 Å²	33.5	4%	0.035	17%	0.167	C	C	.	.	H	α-helix	trans	-57.8	-41.8	176.2	-68.1	0	0	0	0	112.5	N1154 K1164 V1165 L1171 V1172	N1154-S1168 PolarHBondContact ND2-OG 2.91Å; K1164-S1168 PolarHBondContact O-N 2.89Å; K1164-S1168 PolarHBondContact O-OG 3.42Å; V1165-S1168 PolarHBondContact O-N 3.29Å; S1168-L1171 PolarHBondContact O-N 3.31Å; S1168-V1172 WeakPolarHBondContact O-CG2 3.3Å; S1168-V1172 PolarHBondContact O-N 3.29Å
1169	H	97.6	Very high	93.8	Very high	24 Å²	24	34.7 Å²	34.7	11%	0.111	17%	0.171	C	C	.	.	H	α-helix	trans	-60.7	-44	173.3	-86.2	-50.1	0	0	0	112.6	V1165 A1166 L1167 V1172 A1173 H1188	V1165-H1169 PolarHBondContact O-CD2 3.22Å; V1165-H1169 PolarHBondContact O-N 3.27Å; A1166-H1169 PolarHBondContact O-N 2.84Å; L1167-H1169 VanDerWaalsContact C-N 3.3Å; L1167-H1169 PolarHBondContact O-N 2.96Å; H1169-V1172 PolarHBondContact O-N 3.46Å; H1169-A1173 WeakPolarHBondContact O-CB 3.33Å; H1169-A1173 PolarHBondContact O-N 3.5Å; H1169-H1188 WeakPolarHBondContact CB-O 3.34Å; H1169-H1188 AromaticContact CE1-ND1 3.7Å; H1169-H1188 AromaticContact ND1-ND1 3.19Å; H1169-H1188 PolarHBondContact ND1-ND1 2.87Å; H1169-H1188 VanDerWaalsContact ND1-ND1 3.19Å
1170	H	95.3	Very high	93.6	Very high	29 Å²	29	35.3 Å²	35.3	13%	0.134	18%	0.175	C	C	.	.	H	α-helix	trans	-60.2	-46	175.6	179.4	69.8	0	0	0	111.9	A1166 L1167 V1172 A1173 R1174 E1189 Y1213	A1166-H1170 PolarHBondContact O-N 3.11Å; L1167-H1170 WeakPolarHBondContact O-CB 3.28Å; L1167-H1170 PolarHBondContact O-N 3.19Å; L1167-H1170 VanDerWaalsContact O-N 3.09Å; H1170-V1172 PolarHBondContact O-N 2.87Å; H1170-A1173 WeakPolarHBondContact O-CB 3.45Å; H1170-A1173 PolarHBondContact O-N 2.94Å; H1170-R1174 WeakPolarHBondContact O-CG 3.2Å; H1170-R1174 PolarHBondContact O-N 3.09Å; H1170-E1189 WeakPolarHBondContact CA-OE2 3.48Å; H1170-E1189 IonicContact CE1-OE2 2.96Å; H1170-E1189 IonicContact CG-OE2 2.79Å; H1170-E1189 IonicContact ND1-OE1 3.37Å; H1170-E1189 PolarHBondContact ND1-OE1 3.05Å; H1170-E1189 IonicContact ND1-OE2 2.73Å; H1170-E1189 PolarHBondContact ND1-OE2 3.1Å; H1170-Y1213 AromaticContact CE1-CD1 3.8Å
1171	L	95.8	Very high	93.6	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-46.1	178	-64.9	-174	0	0	0	112	L1132 L1147 L1167 S1168 A1173 R1174 V1175 Q1256 I1260	L1132-L1171 HydrophobicContact CD1-CD1 4.23Å; L1132-L1171 HydrophobicContact CD2-CD1 4.31Å; L1132-L1171 HydrophobicContact CD2-CD2 3.91Å; L1132-L1171 HydrophobicContact CG-CD1 4.34Å; L1147-L1171 HydrophobicContact CD1-CB 4.24Å; L1147-L1171 HydrophobicContact CD2-CB 4.41Å; L1147-L1171 HydrophobicContact CD2-CD1 4.37Å; L1167-L1171 HydrophobicContact CD1-CD2 4.41Å; L1167-L1171 HydrophobicContact CD1-CG 4.37Å; L1167-L1171 HydrophobicContact CG-CG 4.45Å; L1167-L1171 WeakPolarHBondContact O-CG 3.47Å; L1167-L1171 PolarHBondContact O-N 3.27Å; S1168-L1171 PolarHBondContact O-N 3.31Å; L1171-A1173 VanDerWaalsContact C-N 3.33Å; L1171-A1173 PolarHBondContact O-N 3.33Å; L1171-R1174 PolarHBondContact O-N 2.84Å; L1171-V1175 PolarHBondContact O-N 3.45Å; L1171-Q1256 HydrophobicContact CD2-CB 4.23Å; L1171-Q1256 HydrophobicContact CD2-CG 4.02Å; L1171-I1260 HydrophobicContact CD1-CG2 4.19Å
1172	V	97.3	Very high	93.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-42.2	175.7	171.7	0	0	0	0	111.1	L1144 L1147 E1148 L1151 S1168 H1169 H1170 R1174 V1175 Y1176	L1144-V1172 HydrophobicContact CD2-CG1 4.13Å; L1147-V1172 HydrophobicContact CB-CG2 3.74Å; E1148-V1172 HydrophobicContact CG-CG2 4.46Å; L1151-V1172 HydrophobicContact CD2-CG2 4.48Å; S1168-V1172 WeakPolarHBondContact O-CG2 3.3Å; S1168-V1172 PolarHBondContact O-N 3.29Å; H1169-V1172 PolarHBondContact O-N 3.46Å; H1170-V1172 PolarHBondContact O-N 2.87Å; V1172-R1174 VanDerWaalsContact C-N 3.3Å; V1172-R1174 PolarHBondContact O-N 3.36Å; V1172-V1175 PolarHBondContact O-N 3.26Å; V1172-Y1176 HydrophobicContact CG1-CD2 3.6Å; V1172-Y1176 HydrophobicContact CG1-CE2 3.42Å; V1172-Y1176 VanDerWaalsContact CG1-CE2 3.42Å; V1172-Y1176 WeakPolarHBondContact O-CD2 3.27Å; V1172-Y1176 PolarHBondContact O-N 2.89Å
1173	A	95.9	Very high	93.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-38	177.3	0	0	0	0	0	112.6	H1169 H1170 L1171 Y1176 E1177 A1185 H1188 E1189	H1169-A1173 WeakPolarHBondContact O-CB 3.33Å; H1169-A1173 PolarHBondContact O-N 3.5Å; H1170-A1173 WeakPolarHBondContact O-CB 3.45Å; H1170-A1173 PolarHBondContact O-N 2.94Å; L1171-A1173 VanDerWaalsContact C-N 3.33Å; L1171-A1173 PolarHBondContact O-N 3.33Å; A1173-Y1176 PolarHBondContact O-N 2.74Å; A1173-E1177 WeakPolarHBondContact O-CB 3.31Å; A1173-E1177 PolarHBondContact O-N 3.26Å; A1173-A1185 WeakPolarHBondContact CB-O 3.42Å; A1173-A1185 WeakPolarHBondContact O-CB 3.44Å; A1173-H1188 HydrophobicContact CB-CB 4.02Å; A1173-E1189 HydrophobicContact CB-CB 3.97Å
1174	R	93.4	Very high	93.5	Very high	41 Å²	41	34.8 Å²	34.8	16%	0.155	16%	0.16	C	C	.	.	H	α-helix	trans	-63.7	-38.3	175.3	-69.2	-171.7	70	177.7	1	112.8	H1170 L1171 V1172 E1177 S1178 Y1213 S1252	H1170-R1174 WeakPolarHBondContact O-CG 3.2Å; H1170-R1174 PolarHBondContact O-N 3.09Å; L1171-R1174 PolarHBondContact O-N 2.84Å; V1172-R1174 VanDerWaalsContact C-N 3.3Å; V1172-R1174 PolarHBondContact O-N 3.36Å; R1174-E1177 WeakPolarHBondContact O-CB 3.3Å; R1174-E1177 PolarHBondContact O-N 3.19Å; R1174-S1178 PolarHBondContact O-N 3.36Å; R1174-S1178 VanDerWaalsContact O-N 3.08Å; R1174-S1178 PolarHBondContact O-OG 3.1Å; R1174-S1178 VanDerWaalsContact O-OG 3.13Å; R1174-Y1213 HydrophobicContact CG-CE1 4.11Å; R1174-S1252 PolarHBondContact NH1-OG 3.31Å; R1174-S1252 PolarHBondContact NH2-OG 3.29Å
1175	V	94.8	Very high	93.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-71.7	-42	177.7	-173.5	0	0	0	0	111.5	H1135 Y1140 L1144 L1147 L1171 V1172 E1177 S1178 K1179	H1135-V1175 HydrophobicContact CB-CG2 4.19Å; Y1140-V1175 HydrophobicContact CD1-CG1 4.18Å; Y1140-V1175 HydrophobicContact CG-CG1 4.47Å; L1144-V1175 HydrophobicContact CD1-CG1 4.37Å; L1144-V1175 HydrophobicContact CD2-CB 3.85Å; L1144-V1175 HydrophobicContact CD2-CG1 3.9Å; L1144-V1175 HydrophobicContact CG-CB 4.21Å; L1144-V1175 HydrophobicContact CG-CG1 3.67Å; L1147-V1175 HydrophobicContact CD1-CG2 3.55Å; L1171-V1175 PolarHBondContact O-N 3.45Å; V1172-V1175 PolarHBondContact O-N 3.26Å; V1175-E1177 VanDerWaalsContact C-N 3.26Å; V1175-E1177 PolarHBondContact O-N 3.35Å; V1175-S1178 PolarHBondContact O-N 3.11Å; V1175-K1179 PolarHBondContact O-N 3.21Å
1176	Y	94.8	Very high	93.6	Very high	31 Å²	31	31.7 Å²	31.7	12%	0.122	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-35	173.1	-80.7	-62.2	0	0	0	112.7	L1144 E1148 V1172 A1173 K1179 A1180 E1181 H1188	L1144-Y1176 HydrophobicContact CD1-CD1 4.03Å; L1144-Y1176 HydrophobicContact CD1-CE1 3.69Å; L1144-Y1176 HydrophobicContact CD2-CD1 4.39Å; L1144-Y1176 HydrophobicContact CD2-CD2 3.88Å; L1144-Y1176 HydrophobicContact CD2-CE1 4.22Å; L1144-Y1176 HydrophobicContact CD2-CE2 3.66Å; L1144-Y1176 HydrophobicContact CD2-CG 4.22Å; E1148-Y1176 PolarHBondContact OE1-OH 2.95Å; V1172-Y1176 HydrophobicContact CG1-CD2 3.6Å; V1172-Y1176 HydrophobicContact CG1-CE2 3.42Å; V1172-Y1176 VanDerWaalsContact CG1-CE2 3.42Å; V1172-Y1176 WeakPolarHBondContact O-CD2 3.27Å; V1172-Y1176 PolarHBondContact O-N 2.89Å; A1173-Y1176 PolarHBondContact O-N 2.74Å; Y1176-K1179 CarbonylContact O-C 3.4Å; Y1176-K1179 PolarHBondContact O-N 3.1Å; Y1176-A1180 PolarHBondContact O-N 3.12Å; Y1176-A1180 VanDerWaalsContact O-N 3.13Å; Y1176-E1181 HydrophobicContact CD1-CB 3.91Å; Y1176-E1181 WeakPolarHBondContact CD1-OE2 3.26Å; Y1176-E1181 WeakPolarHBondContact CE1-OE2 3.39Å; Y1176-E1181 PolarHBondContact O-N 3.32Å; Y1176-H1188 AromaticContact CD2-CD2 3.79Å; Y1176-H1188 AromaticContact CE2-CD2 3.67Å; Y1176-H1188 AromaticContact CE2-NE2 3.66Å
1177	E	90.9	Very high	93.6	Very high	18 Å²	18	37.7 Å²	37.7	8%	0.084	18%	0.176	C	C	.	.	H	α-helix	trans	-62.2	-48	172.2	179.9	-96	-179.8	0	0	111.7	A1173 R1174 V1175 K1179 A1180 F1182 A1185 Y1216 L1217 T1246	A1173-E1177 WeakPolarHBondContact O-CB 3.31Å; A1173-E1177 PolarHBondContact O-N 3.26Å; R1174-E1177 WeakPolarHBondContact O-CB 3.3Å; R1174-E1177 PolarHBondContact O-N 3.19Å; V1175-E1177 VanDerWaalsContact C-N 3.26Å; V1175-E1177 PolarHBondContact O-N 3.35Å; E1177-K1179 PolarHBondContact O-N 2.66Å; E1177-A1180 WeakPolarHBondContact O-CA 3.35Å; E1177-A1180 PolarHBondContact O-N 2.84Å; E1177-F1182 HydrophobicContact CG-CE1 4.06Å; E1177-A1185 HydrophobicContact CB-CB 4.43Å; E1177-Y1216 HydrophobicContact CG-CE1 4.44Å; E1177-Y1216 PolarHBondContact OE1-OH 2.77Å; E1177-L1217 HydrophobicContact CB-CD2 3.82Å; E1177-L1217 HydrophobicContact CG-CD2 3.63Å; E1177-T1246 PolarHBondContact OE1-OG1 3.15Å; E1177-T1246 VanDerWaalsContact OE1-OG1 3.09Å
1178	S	90.4	Very high	93.8	Very high	18 Å²	18	37.9 Å²	37.9	13%	0.126	18%	0.176	C	C	.	.	H	α-helix	trans	-63.9	-27.3	176.7	-57.7	0	0	0	0	112.9	H1135 R1174 V1175 A1180	H1135-S1178 PolarHBondContact NE2-OG 3.12Å; R1174-S1178 PolarHBondContact O-N 3.36Å; R1174-S1178 VanDerWaalsContact O-N 3.08Å; R1174-S1178 PolarHBondContact O-OG 3.1Å; R1174-S1178 VanDerWaalsContact O-OG 3.13Å; V1175-S1178 PolarHBondContact O-N 3.11Å; S1178-A1180 VanDerWaalsContact C-N 3.31Å
1179	K	90.4	Very high	93.8	Very high	61 Å²	61	37.7 Å²	37.7	27%	0.265	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.6	172.3	-167.7	166.4	173	141.3	0	113.8	D1141 L1144 V1175 Y1176 E1177 E1181	D1141-K1179 IonicContact OD1-NZ 3.37Å; D1141-K1179 PolarHBondContact OD1-NZ 2.81Å; D1141-K1179 IonicContact OD2-NZ 3.57Å; D1141-K1179 PolarHBondContact OD2-NZ 3.4Å; L1144-K1179 HydrophobicContact CD1-CD 4.31Å; V1175-K1179 PolarHBondContact O-N 3.21Å; Y1176-K1179 CarbonylContact O-C 3.4Å; Y1176-K1179 PolarHBondContact O-N 3.1Å; E1177-K1179 PolarHBondContact O-N 2.66Å; K1179-E1181 VanDerWaalsContact C-N 3.26Å; K1179-E1181 WeakPolarHBondContact CE-OE1 3.27Å; K1179-E1181 HydrophobicContact CG-CG 4.27Å; K1179-E1181 PolarHBondContact O-N 2.99Å
1180	A	87.3	Confident	93.7	Very high	28 Å²	28	43.1 Å²	43.1	23%	0.231	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	22	-176	0	0	0	0	0	115.4	Y1176 E1177 S1178 F1182 F1245	Y1176-A1180 PolarHBondContact O-N 3.12Å; Y1176-A1180 VanDerWaalsContact O-N 3.13Å; E1177-A1180 WeakPolarHBondContact O-CA 3.35Å; E1177-A1180 PolarHBondContact O-N 2.84Å; S1178-A1180 VanDerWaalsContact C-N 3.31Å; A1180-F1182 HydrophobicContact CB-CE2 4.15Å; A1180-F1182 WeakPolarHBondContact O-CD2 3.26Å; A1180-F1182 PolarHBondContact O-N 3.15Å; A1180-F1245 HydrophobicContact CB-CD1 4.47Å; A1180-F1245 HydrophobicContact CB-CE1 3.9Å
1181	E	90.9	Very high	93.8	Very high	79 Å²	79	46.4 Å²	46.4	37%	0.369	21%	0.213	S	C	.	.			trans	-93	64.2	174.9	-68.8	-173.2	-163.5	0	0	111.2	Y1176 K1179 R1183 S1184 A1185	Y1176-E1181 HydrophobicContact CD1-CB 3.91Å; Y1176-E1181 WeakPolarHBondContact CD1-OE2 3.26Å; Y1176-E1181 WeakPolarHBondContact CE1-OE2 3.39Å; Y1176-E1181 PolarHBondContact O-N 3.32Å; K1179-E1181 VanDerWaalsContact C-N 3.26Å; K1179-E1181 WeakPolarHBondContact CE-OE1 3.27Å; K1179-E1181 HydrophobicContact CG-CG 4.27Å; K1179-E1181 PolarHBondContact O-N 2.99Å; E1181-R1183 PolarHBondContact O-N 2.6Å; E1181-S1184 PolarHBondContact O-N 2.85Å; E1181-S1184 VanDerWaalsContact O-N 3.14Å; E1181-A1185 PolarHBondContact O-N 2.82Å; E1181-A1185 VanDerWaalsContact O-N 3.15Å
1182	F	89.9	Confident	93.7	Very high	16 Å²	16	46.2 Å²	46.2	7%	0.07	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-23.8	-170.4	-63.8	-76.9	0	0	0	115.4	E1177 A1180 L1186 L1217 Q1220 A1221 L1224	E1177-F1182 HydrophobicContact CG-CE1 4.06Å; A1180-F1182 HydrophobicContact CB-CE2 4.15Å; A1180-F1182 WeakPolarHBondContact O-CD2 3.26Å; A1180-F1182 PolarHBondContact O-N 3.15Å; F1182-L1186 WeakPolarHBondContact O-CB 3.48Å; F1182-L1186 VanDerWaalsContact O-CG 3.26Å; F1182-L1186 WeakPolarHBondContact O-CG 3.04Å; F1182-L1186 PolarHBondContact O-N 3.47Å; F1182-L1217 HydrophobicContact CD1-CD2 4.22Å; F1182-Q1220 HydrophobicContact CD1-CB 3.97Å; F1182-Q1220 HydrophobicContact CE1-CB 3.47Å; F1182-Q1220 VanDerWaalsContact CE1-CB 3.47Å; F1182-Q1220 HydrophobicContact CE1-CG 4.24Å; F1182-Q1220 HydrophobicContact CZ-CB 3.81Å; F1182-A1221 HydrophobicContact CB-CB 3.7Å; F1182-A1221 HydrophobicContact CG-CB 4.24Å; F1182-L1224 HydrophobicContact CD2-CB 4.41Å; F1182-L1224 HydrophobicContact CD2-CD2 3.62Å; F1182-L1224 HydrophobicContact CE2-CB 4.33Å; F1182-L1224 HydrophobicContact CE2-CD2 3.82Å
1183	R	91.1	Very high	93.7	Very high	207 Å²	207	48.5 Å²	48.5	78%	0.781	22%	0.221	S	C	*	.	H	α-helix	trans	-65.4	-48.3	175.8	-73.2	-175.6	-176.3	157.4	3.7	111.4	E1181 L1186 Q1187	E1181-R1183 PolarHBondContact O-N 2.6Å; R1183-L1186 PolarHBondContact O-N 3.06Å; R1183-Q1187 PolarHBondContact O-N 3.47Å; R1183-Q1187 VanDerWaalsContact O-N 3.1Å
1184	S	94.6	Very high	93.7	Very high	34 Å²	34	51 Å²	51	24%	0.238	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-42.8	177.3	-50.8	0	0	0	0	110.5	E1181 L1186 Q1187 H1188	E1181-S1184 PolarHBondContact O-N 2.85Å; E1181-S1184 VanDerWaalsContact O-N 3.14Å; S1184-L1186 PolarHBondContact O-N 3.4Å; S1184-Q1187 PolarHBondContact O-N 2.89Å; S1184-H1188 PolarHBondContact O-CD2 3.25Å; S1184-H1188 VanDerWaalsContact O-CD2 3.29Å; S1184-H1188 PolarHBondContact O-N 3.05Å; S1184-H1188 VanDerWaalsContact O-N 3.07Å
1185	A	94.1	Very high	93.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.7	-47.8	175.7	0	0	0	0	0	112.4	A1173 E1177 E1181 Q1187 H1188 E1189 L1217	A1173-A1185 WeakPolarHBondContact CB-O 3.42Å; A1173-A1185 WeakPolarHBondContact O-CB 3.44Å; E1177-A1185 HydrophobicContact CB-CB 4.43Å; E1181-A1185 PolarHBondContact O-N 2.82Å; E1181-A1185 VanDerWaalsContact O-N 3.15Å; A1185-Q1187 VanDerWaalsContact C-N 3.32Å; A1185-Q1187 PolarHBondContact O-N 2.96Å; A1185-H1188 PolarHBondContact O-N 3.04Å; A1185-E1189 WeakPolarHBondContact O-CB 3.21Å; A1185-E1189 PolarHBondContact O-N 3.45Å; A1185-L1217 HydrophobicContact CB-CD1 4.21Å; A1185-L1217 HydrophobicContact CB-CD2 4.13Å
1186	L	95.3	Very high	93.8	Very high	42 Å²	42	50.5 Å²	50.5	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-37.9	177.3	-79.7	168.3	0	0	0	112.7	F1182 R1183 S1184 K1190 L1214 L1217 T1218 A1221	F1182-L1186 WeakPolarHBondContact O-CB 3.48Å; F1182-L1186 VanDerWaalsContact O-CG 3.26Å; F1182-L1186 WeakPolarHBondContact O-CG 3.04Å; F1182-L1186 PolarHBondContact O-N 3.47Å; R1183-L1186 PolarHBondContact O-N 3.06Å; S1184-L1186 PolarHBondContact O-N 3.4Å; L1186-K1190 WeakPolarHBondContact O-CB 3.49Å; L1186-K1190 PolarHBondContact O-N 3Å; L1186-L1214 HydrophobicContact CD2-CD2 4.22Å; L1186-L1217 HydrophobicContact CD2-CB 3.55Å; L1186-L1217 HydrophobicContact CD2-CD1 4.45Å; L1186-L1217 HydrophobicContact CG-CB 4.02Å; L1186-T1218 WeakPolarHBondContact CD2-OG1 3.33Å; L1186-A1221 HydrophobicContact CD1-CB 4.09Å
1187	Q	96.1	Very high	93.7	Very high	126 Å²	126	52.7 Å²	52.7	59%	0.589	25%	0.246	S	C	*	.	H	α-helix	trans	-63.6	-51.4	178.4	-179.7	175.5	-9.2	0	0	111.1	R1183 S1184 A1185 K1190 E1191	R1183-Q1187 PolarHBondContact O-N 3.47Å; R1183-Q1187 VanDerWaalsContact O-N 3.1Å; S1184-Q1187 PolarHBondContact O-N 2.89Å; A1185-Q1187 VanDerWaalsContact C-N 3.32Å; A1185-Q1187 PolarHBondContact O-N 2.96Å; Q1187-K1190 PolarHBondContact O-N 2.59Å; Q1187-E1191 PolarHBondContact O-N 3.33Å
1188	H	97.1	Very high	93.9	Very high	33 Å²	33	57.1 Å²	57.1	15%	0.153	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-44.3	-179.9	-74.5	-63.3	0	0	0	112.4	H1169 A1173 Y1176 S1184 A1185 K1190 E1191 G1192	H1169-H1188 WeakPolarHBondContact CB-O 3.34Å; H1169-H1188 AromaticContact CE1-ND1 3.7Å; H1169-H1188 AromaticContact ND1-ND1 3.19Å; H1169-H1188 PolarHBondContact ND1-ND1 2.87Å; H1169-H1188 VanDerWaalsContact ND1-ND1 3.19Å; A1173-H1188 HydrophobicContact CB-CB 4.02Å; Y1176-H1188 AromaticContact CD2-CD2 3.79Å; Y1176-H1188 AromaticContact CE2-CD2 3.67Å; Y1176-H1188 AromaticContact CE2-NE2 3.66Å; S1184-H1188 PolarHBondContact O-CD2 3.25Å; S1184-H1188 VanDerWaalsContact O-CD2 3.29Å; S1184-H1188 PolarHBondContact O-N 3.05Å; S1184-H1188 VanDerWaalsContact O-N 3.07Å; A1185-H1188 PolarHBondContact O-N 3.04Å; H1188-K1190 PolarHBondContact O-N 3.49Å; H1188-E1191 WeakPolarHBondContact O-CB 3.16Å; H1188-E1191 PolarHBondContact O-N 3.2Å; H1188-G1192 PolarHBondContact O-N 2.9Å
1189	E	96.4	Very high	93.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-33.7	178.6	-171.4	64.5	-156.4	0	0	111.6	H1170 A1173 A1185 G1192 Y1193 S1210 Y1213 L1214 L1217	H1170-E1189 WeakPolarHBondContact CA-OE2 3.48Å; H1170-E1189 IonicContact CE1-OE2 2.96Å; H1170-E1189 IonicContact CG-OE2 2.79Å; H1170-E1189 IonicContact ND1-OE1 3.37Å; H1170-E1189 PolarHBondContact ND1-OE1 3.05Å; H1170-E1189 IonicContact ND1-OE2 2.73Å; H1170-E1189 PolarHBondContact ND1-OE2 3.1Å; A1173-E1189 HydrophobicContact CB-CB 3.97Å; A1185-E1189 WeakPolarHBondContact O-CB 3.21Å; A1185-E1189 PolarHBondContact O-N 3.45Å; E1189-G1192 PolarHBondContact O-N 2.68Å; E1189-Y1193 WeakPolarHBondContact O-CB 3.45Å; E1189-Y1193 PolarHBondContact O-N 2.73Å; E1189-S1210 WeakPolarHBondContact OE1-CA 3.48Å; E1189-S1210 VanDerWaalsContact OE1-CB 3.27Å; E1189-S1210 WeakPolarHBondContact OE1-CB 3.38Å; E1189-S1210 PolarHBondContact OE1-OG 2.97Å; E1189-Y1213 HydrophobicContact CG-CD1 3.89Å; E1189-L1214 HydrophobicContact CB-CD2 3.68Å; E1189-L1214 HydrophobicContact CB-CG 4.29Å; E1189-L1214 HydrophobicContact CG-CD2 3.58Å; E1189-L1214 HydrophobicContact CG-CG 3.61Å; E1189-L1217 HydrophobicContact CB-CD1 3.91Å; E1189-L1217 HydrophobicContact CG-CD1 4.21Å
1190	K	96.8	Very high	94	Very high	139 Å²	139	62 Å²	62	60%	0.604	29%	0.293	S	S	*	.	H	α-helix	trans	-66.4	-39.8	176.8	-176.3	-176.8	177.3	-172.3	0	112.1	L1186 Q1187 H1188 T1194 L1214	L1186-K1190 WeakPolarHBondContact O-CB 3.49Å; L1186-K1190 PolarHBondContact O-N 3Å; Q1187-K1190 PolarHBondContact O-N 2.59Å; H1188-K1190 PolarHBondContact O-N 3.49Å; K1190-T1194 WeakPolarHBondContact O-CB 3.47Å; K1190-T1194 PolarHBondContact O-N 3.3Å; K1190-T1194 PolarHBondContact O-OG1 2.74Å; K1190-L1214 HydrophobicContact CB-CD2 4.3Å
1191	E	96.4	Very high	94.1	Very high	97 Å²	97	62 Å²	62	45%	0.453	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-49.9	172.2	-68.2	-71.8	171.6	0	0	110.1	Q1187 H1188 Y1193 T1194 I1195	Q1187-E1191 PolarHBondContact O-N 3.33Å; H1188-E1191 WeakPolarHBondContact O-CB 3.16Å; H1188-E1191 PolarHBondContact O-N 3.2Å; E1191-Y1193 PolarHBondContact O-N 2.72Å; E1191-T1194 WeakPolarHBondContact O-CB 3.2Å; E1191-T1194 PolarHBondContact O-N 3.25Å; E1191-T1194 VanDerWaalsContact O-N 3.15Å; E1191-I1195 WeakPolarHBondContact O-CG1 3.45Å; E1191-I1195 PolarHBondContact O-N 2.76Å
1192	G	94.2	Very high	94.1	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.1	-49.8	176.7	0	0	0	0	0	113.3	H1188 E1189 T1194 I1195 Y1196	H1188-G1192 PolarHBondContact O-N 2.9Å; E1189-G1192 PolarHBondContact O-N 2.68Å; G1192-T1194 VanDerWaalsContact C-N 3.31Å; G1192-T1194 PolarHBondContact O-N 3.05Å; G1192-I1195 PolarHBondContact O-N 2.76Å; G1192-Y1196 VanDerWaalsContact O-CD2 3.25Å; G1192-Y1196 WeakPolarHBondContact O-CD2 3.36Å; G1192-Y1196 PolarHBondContact O-N 3.24Å
1193	Y	95.9	Very high	94	Very high	48 Å²	48	66.9 Å²	66.9	19%	0.188	33%	0.333	C	S	.	.	H	α-helix	trans	-56.5	-44.2	175.1	174	-103.1	0	0	0	112.3	E1189 E1191 I1195 Y1196 K1197 T1207 S1210 L1214	E1189-Y1193 WeakPolarHBondContact O-CB 3.45Å; E1189-Y1193 PolarHBondContact O-N 2.73Å; E1191-Y1193 PolarHBondContact O-N 2.72Å; Y1193-I1195 VanDerWaalsContact C-N 3.29Å; Y1193-I1195 PolarHBondContact O-N 3.21Å; Y1193-Y1196 PolarHBondContact O-N 3.07Å; Y1193-K1197 HydrophobicContact CE1-CD 4.06Å; Y1193-K1197 VanDerWaalsContact O-CB 3.25Å; Y1193-K1197 WeakPolarHBondContact O-CB 3.37Å; Y1193-K1197 PolarHBondContact O-N 3.24Å; Y1193-T1207 HydrophobicContact CD2-CG2 4.16Å; Y1193-T1207 HydrophobicContact CE2-CG2 3.66Å; Y1193-S1210 WeakPolarHBondContact CA-OG 3.19Å; Y1193-S1210 WeakPolarHBondContact CB-OG 3.27Å; Y1193-S1210 PolarHBondContact N-OG 3.2Å; Y1193-L1214 HydrophobicContact CD1-CD1 4.09Å; Y1193-L1214 HydrophobicContact CD2-CD1 4.25Å; Y1193-L1214 HydrophobicContact CG-CD1 3.7Å
1194	T	96.2	Very high	94	Very high	54 Å²	54	60.3 Å²	60.3	33%	0.331	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-40.7	-179.7	-59.2	0	0	0	0	110.6	K1190 E1191 G1192 N1198	K1190-T1194 WeakPolarHBondContact O-CB 3.47Å; K1190-T1194 PolarHBondContact O-N 3.3Å; K1190-T1194 PolarHBondContact O-OG1 2.74Å; E1191-T1194 WeakPolarHBondContact O-CB 3.2Å; E1191-T1194 PolarHBondContact O-N 3.25Å; E1191-T1194 VanDerWaalsContact O-N 3.15Å; G1192-T1194 VanDerWaalsContact C-N 3.31Å; G1192-T1194 PolarHBondContact O-N 3.05Å; T1194-N1198 WeakPolarHBondContact O-CB 3.17Å; T1194-N1198 PolarHBondContact O-N 3Å; T1194-N1198 PolarHBondContact O-ND2 3.25Å; T1194-N1198 VanDerWaalsContact O-ND2 3.09Å
1195	I	95.1	Very high	93.8	Very high	12 Å²	12	65.5 Å²	65.5	6%	0.062	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-49.2	176	-62.1	163.3	0	0	0	110.7	A1160 R1161 V1165 A1166 E1191 G1192 Y1193 K1197 N1198 Q1199	A1160-I1195 WeakPolarHBondContact O-CD1 3.33Å; R1161-I1195 WeakPolarHBondContact O-CG2 3.38Å; V1165-I1195 HydrophobicContact CB-CD1 4.42Å; V1165-I1195 HydrophobicContact CG1-CD1 3.97Å; A1166-I1195 HydrophobicContact CB-CB 3.83Å; A1166-I1195 HydrophobicContact CB-CD1 4.3Å; A1166-I1195 HydrophobicContact CB-CG2 3.77Å; E1191-I1195 WeakPolarHBondContact O-CG1 3.45Å; E1191-I1195 PolarHBondContact O-N 2.76Å; G1192-I1195 PolarHBondContact O-N 2.76Å; Y1193-I1195 VanDerWaalsContact C-N 3.29Å; Y1193-I1195 PolarHBondContact O-N 3.21Å; I1195-K1197 PolarHBondContact O-N 3.35Å; I1195-N1198 PolarHBondContact O-N 3.08Å; I1195-Q1199 HydrophobicContact CG2-CG 4.28Å; I1195-Q1199 PolarHBondContact O-N 2.82Å
1196	Y	95.2	Very high	93.5	Very high	17 Å²	17	68.3 Å²	68.3	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-58.4	-46.8	178.3	-75.4	-53	0	0	0	112.2	L1163 A1166 L1167 G1192 Y1193 N1198 Q1199 M1200 K1206 T1207	L1163-Y1196 HydrophobicContact CD2-CD1 3.86Å; L1163-Y1196 HydrophobicContact CD2-CE1 4.09Å; A1166-Y1196 HydrophobicContact CB-CD1 4.03Å; A1166-Y1196 HydrophobicContact CB-CD2 3.97Å; A1166-Y1196 HydrophobicContact CB-CE1 3.74Å; A1166-Y1196 HydrophobicContact CB-CE2 3.69Å; A1166-Y1196 HydrophobicContact CB-CG 4.13Å; L1167-Y1196 PolarHBondContact N-OH 3.47Å; G1192-Y1196 VanDerWaalsContact O-CD2 3.25Å; G1192-Y1196 WeakPolarHBondContact O-CD2 3.36Å; G1192-Y1196 PolarHBondContact O-N 3.24Å; Y1193-Y1196 PolarHBondContact O-N 3.07Å; Y1196-N1198 VanDerWaalsContact C-N 3.31Å; Y1196-N1198 PolarHBondContact O-N 3.36Å; Y1196-Q1199 PolarHBondContact O-N 3.38Å; Y1196-M1200 WeakPolarHBondContact O-CB 3.29Å; Y1196-M1200 PolarHBondContact O-N 3.42Å; Y1196-K1206 HydrophobicContact CD1-CB 3.94Å; Y1196-K1206 HydrophobicContact CE1-CB 3.92Å; Y1196-K1206 HydrophobicContact CE1-CG 4.49Å; Y1196-K1206 HydrophobicContact CG-CB 4.34Å; Y1196-T1207 PolarHBondContact O-OG1 3.22Å
1197	K	94	Very high	93.3	Very high	78 Å²	78	66.4 Å²	66.4	34%	0.339	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-43.1	176.5	176.6	173.7	169.7	164.2	0	111.9	Y1193 I1195 G1201 E1202 T1207	Y1193-K1197 HydrophobicContact CE1-CD 4.06Å; Y1193-K1197 VanDerWaalsContact O-CB 3.25Å; Y1193-K1197 WeakPolarHBondContact O-CB 3.37Å; Y1193-K1197 PolarHBondContact O-N 3.24Å; I1195-K1197 PolarHBondContact O-N 3.35Å; K1197-G1201 VanDerWaalsContact O-CA 3.22Å; K1197-G1201 WeakPolarHBondContact O-CA 3.33Å; K1197-G1201 PolarHBondContact O-N 3.16Å; K1197-G1201 VanDerWaalsContact O-N 3.09Å; K1197-E1202 HydrophobicContact CD-CG 4.09Å; K1197-E1202 WeakPolarHBondContact CE-OE1 3.44Å; K1197-E1202 HydrophobicContact CG-CG 4.01Å; K1197-E1202 IonicContact NZ-OE1 3.98Å; K1197-E1202 PolarHBondContact NZ-OE1 3.04Å; K1197-T1207 HydrophobicContact CB-CG2 3.93Å
1198	N	94	Very high	93.1	Very high	110 Å²	110	65.4 Å²	65.4	59%	0.588	33%	0.327	S	S	*	.	H	α-helix	trans	-74.1	-35.4	-177.3	-70.7	-21.1	0	0	0	113.2	T1194 I1195 Y1196	T1194-N1198 WeakPolarHBondContact O-CB 3.17Å; T1194-N1198 PolarHBondContact O-N 3Å; T1194-N1198 PolarHBondContact O-ND2 3.25Å; T1194-N1198 VanDerWaalsContact O-ND2 3.09Å; I1195-N1198 PolarHBondContact O-N 3.08Å; Y1196-N1198 VanDerWaalsContact C-N 3.31Å; Y1196-N1198 PolarHBondContact O-N 3.36Å
1199	Q	92	Very high	92.8	Very high	104 Å²	104	68.1 Å²	68.1	49%	0.486	34%	0.34	S	S	.	.	H	α-helix	trans	-87.5	-39.6	-177.2	-69.1	-66.9	-3.9	0	0	113.5	R1161 L1163 I1195 Y1196	R1161-Q1199 WeakPolarHBondContact O-CG 3.36Å; R1161-Q1199 PolarHBondContact O-NE2 3.34Å; L1163-Q1199 HydrophobicContact CD2-CB 3.94Å; L1163-Q1199 HydrophobicContact CD2-CG 4.47Å; I1195-Q1199 HydrophobicContact CG2-CG 4.28Å; I1195-Q1199 PolarHBondContact O-N 2.82Å; Y1196-Q1199 PolarHBondContact O-N 3.38Å
1200	M	90.8	Very high	92.6	Very high	78 Å²	78	68.2 Å²	68.2	38%	0.384	34%	0.341	S	S	.	.	H	α-helix	trans	-111.6	-13	-171.7	-50.6	-59	-128.4	0	0	113.6	L1163 Y1196 H1204	L1163-M1200 HydrophobicContact CD1-CE 3.21Å; L1163-M1200 HydrophobicContact CD1-SD 3.91Å; L1163-M1200 HydrophobicContact CD2-CE 3.8Å; L1163-M1200 HydrophobicContact CD2-CG 3.7Å; L1163-M1200 HydrophobicContact CD2-SD 3.88Å; L1163-M1200 HydrophobicContact CG-CE 4.13Å; L1163-M1200 HydrophobicContact CG-SD 4.48Å; Y1196-M1200 WeakPolarHBondContact O-CB 3.29Å; Y1196-M1200 PolarHBondContact O-N 3.42Å; M1200-H1204 HydrophobicContact CB-CB 3.58Å; M1200-H1204 VanDerWaalsContact CB-CG 3.5Å
1201	G	90.3	Very high	92.4	Very high	29 Å²	29	63 Å²	63	30%	0.299	32%	0.321	S	S	.	.			trans	83.9	169.8	-173.8	0	0	0	0	0	114	K1197 A1203 T1207	K1197-G1201 VanDerWaalsContact O-CA 3.22Å; K1197-G1201 WeakPolarHBondContact O-CA 3.33Å; K1197-G1201 PolarHBondContact O-N 3.16Å; K1197-G1201 VanDerWaalsContact O-N 3.09Å; G1201-A1203 VanDerWaalsContact C-N 3.34Å; G1201-A1203 PolarHBondContact O-N 3.08Å; G1201-T1207 WeakPolarHBondContact O-CB 3.42Å; G1201-T1207 PolarHBondContact O-OG1 2.96Å
1202	E	90.5	Very high	92.3	Very high	119 Å²	119	64.5 Å²	64.5	56%	0.556	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-26.6	-176.6	-66.9	-171.2	165.5	0	0	113.8	K1197	K1197-E1202 HydrophobicContact CD-CG 4.09Å; K1197-E1202 WeakPolarHBondContact CE-OE1 3.44Å; K1197-E1202 HydrophobicContact CG-CG 4.01Å; K1197-E1202 IonicContact NZ-OE1 3.98Å; K1197-E1202 PolarHBondContact NZ-OE1 3.04Å
1203	A	88.4	Confident	92.2	Very high	78 Å²	78	66.4 Å²	66.4	65%	0.645	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-17.7	-176.2	0	0	0	0	0	113.8	G1201 K1208	G1201-A1203 VanDerWaalsContact C-N 3.34Å; G1201-A1203 PolarHBondContact O-N 3.08Å; A1203-K1208 WeakPolarHBondContact O-CE 3.46Å; A1203-K1208 PolarHBondContact O-NZ 3.49Å
1204	H	91.1	Very high	92.1	Very high	69 Å²	69	65.4 Å²	65.4	32%	0.319	33%	0.334	S	S	.	.	S	Bend	trans	-67.1	142.7	-177.1	-172.4	-87.4	0	0	0	112	M1200 K1206 T1207 K1208	M1200-H1204 HydrophobicContact CB-CB 3.58Å; M1200-H1204 VanDerWaalsContact CB-CG 3.5Å; H1204-K1206 PolarHBondContact ND1-N 3.01Å; H1204-K1206 VanDerWaalsContact ND1-N 3.18Å; H1204-K1206 PolarHBondContact O-N 3.5Å; H1204-T1207 WeakPolarHBondContact O-CB 3.4Å; H1204-T1207 PolarHBondContact O-N 2.91Å; H1204-K1208 PolarHBondContact O-N 2.95Å; H1204-K1208 VanDerWaalsContact O-N 3.11Å
1205	E	89.4	Confident	92	Very high	143 Å²	143	68.8 Å²	68.8	67%	0.668	34%	0.344	S	S	*	.	H	α-helix	trans	-56.1	-48.9	-175	-65.1	-174.7	162	0	0	112.5	T1207 K1208 E1209	E1205-T1207 VanDerWaalsContact C-N 3.26Å; E1205-T1207 PolarHBondContact O-N 3.25Å; E1205-K1208 WeakPolarHBondContact O-CA 3.46Å; E1205-K1208 WeakPolarHBondContact O-CB 3.4Å; E1205-K1208 PolarHBondContact O-N 3.32Å; E1205-E1209 WeakPolarHBondContact O-CG 3.15Å; E1205-E1209 PolarHBondContact O-N 3.47Å
1206	K	87.9	Confident	91.8	Very high	58 Å²	58	71.4 Å²	71.4	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-59.6	-32.7	177.5	-63.6	-70.4	163.3	-143.8	0	114	Y1196 H1204 E1209 S1210	Y1196-K1206 HydrophobicContact CD1-CB 3.94Å; Y1196-K1206 HydrophobicContact CE1-CB 3.92Å; Y1196-K1206 HydrophobicContact CE1-CG 4.49Å; Y1196-K1206 HydrophobicContact CG-CB 4.34Å; H1204-K1206 PolarHBondContact ND1-N 3.01Å; H1204-K1206 VanDerWaalsContact ND1-N 3.18Å; H1204-K1206 PolarHBondContact O-N 3.5Å; K1206-E1209 WeakPolarHBondContact CD-OE2 3.5Å; K1206-E1209 VanDerWaalsContact NZ-CD 3.27Å; K1206-E1209 IonicContact NZ-OE1 2.84Å; K1206-E1209 PolarHBondContact NZ-OE1 2.89Å; K1206-E1209 IonicContact NZ-OE2 2.74Å; K1206-E1209 PolarHBondContact NZ-OE2 3.1Å; K1206-S1210 WeakPolarHBondContact O-CB 3.3Å; K1206-S1210 PolarHBondContact O-N 2.71Å; K1206-S1210 VanDerWaalsContact O-N 3.09Å
1207	T	90.9	Very high	91.5	Very high	2 Å²	2	70.6 Å²	70.6	1%	0.012	35%	0.35	C	S	.	.	H	α-helix	trans	-70.8	-39.1	175.9	-50.1	0	0	0	0	110.8	Y1193 Y1196 K1197 G1201 H1204 E1205 S1211	Y1193-T1207 HydrophobicContact CD2-CG2 4.16Å; Y1193-T1207 HydrophobicContact CE2-CG2 3.66Å; Y1196-T1207 PolarHBondContact O-OG1 3.22Å; K1197-T1207 HydrophobicContact CB-CG2 3.93Å; G1201-T1207 WeakPolarHBondContact O-CB 3.42Å; G1201-T1207 PolarHBondContact O-OG1 2.96Å; H1204-T1207 WeakPolarHBondContact O-CB 3.4Å; H1204-T1207 PolarHBondContact O-N 2.91Å; E1205-T1207 VanDerWaalsContact C-N 3.26Å; E1205-T1207 PolarHBondContact O-N 3.25Å; T1207-S1211 WeakPolarHBondContact O-CB 3.28Å; T1207-S1211 PolarHBondContact O-N 2.82Å
1208	K	92.4	Very high	91.4	Very high	106 Å²	106	70.1 Å²	70.1	46%	0.461	35%	0.354	S	S	.	.	H	α-helix	trans	-67.5	-47.3	175.8	-68.4	173.5	177	160.2	0	111.6	A1203 H1204 E1205 S1210 S1211 E1212	A1203-K1208 WeakPolarHBondContact O-CE 3.46Å; A1203-K1208 PolarHBondContact O-NZ 3.49Å; H1204-K1208 PolarHBondContact O-N 2.95Å; H1204-K1208 VanDerWaalsContact O-N 3.11Å; E1205-K1208 WeakPolarHBondContact O-CA 3.46Å; E1205-K1208 WeakPolarHBondContact O-CB 3.4Å; E1205-K1208 PolarHBondContact O-N 3.32Å; K1208-S1210 VanDerWaalsContact C-N 3.32Å; K1208-S1210 PolarHBondContact O-N 3.39Å; K1208-S1211 WeakPolarHBondContact O-CB 3.48Å; K1208-S1211 PolarHBondContact O-N 3.07Å; K1208-S1211 VanDerWaalsContact O-N 3.1Å; K1208-E1212 WeakPolarHBondContact O-CG 3.24Å; K1208-E1212 PolarHBondContact O-N 3.21Å
1209	E	90.2	Very high	91.2	Very high	89 Å²	89	71.5 Å²	71.5	42%	0.416	36%	0.357	S	S	.	.	H	α-helix	trans	-52.9	-50.3	175	-73.7	174.8	-156.3	0	0	110.7	E1205 K1206 S1211 E1212 Y1213	E1205-E1209 WeakPolarHBondContact O-CG 3.15Å; E1205-E1209 PolarHBondContact O-N 3.47Å; K1206-E1209 WeakPolarHBondContact CD-OE2 3.5Å; K1206-E1209 VanDerWaalsContact NZ-CD 3.27Å; K1206-E1209 IonicContact NZ-OE1 2.84Å; K1206-E1209 PolarHBondContact NZ-OE1 2.89Å; K1206-E1209 IonicContact NZ-OE2 2.74Å; K1206-E1209 PolarHBondContact NZ-OE2 3.1Å; E1209-S1211 PolarHBondContact O-N 3.15Å; E1209-E1212 PolarHBondContact O-N 2.78Å; E1209-Y1213 WeakPolarHBondContact O-CB 3.41Å; E1209-Y1213 PolarHBondContact O-N 3.16Å
1210	S	92.5	Very high	90.9	Very high	3 Å²	3	68.1 Å²	68.1	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-65	-37.4	178.4	-175.6	0	0	0	0	112.6	E1189 Y1193 K1206 K1208 Y1213 L1214	E1189-S1210 WeakPolarHBondContact OE1-CA 3.48Å; E1189-S1210 VanDerWaalsContact OE1-CB 3.27Å; E1189-S1210 WeakPolarHBondContact OE1-CB 3.38Å; E1189-S1210 PolarHBondContact OE1-OG 2.97Å; Y1193-S1210 WeakPolarHBondContact CA-OG 3.19Å; Y1193-S1210 WeakPolarHBondContact CB-OG 3.27Å; Y1193-S1210 PolarHBondContact N-OG 3.2Å; K1206-S1210 WeakPolarHBondContact O-CB 3.3Å; K1206-S1210 PolarHBondContact O-N 2.71Å; K1206-S1210 VanDerWaalsContact O-N 3.09Å; K1208-S1210 VanDerWaalsContact C-N 3.32Å; K1208-S1210 PolarHBondContact O-N 3.39Å; S1210-Y1213 PolarHBondContact O-N 3.08Å; S1210-L1214 WeakPolarHBondContact O-CB 3.48Å; S1210-L1214 WeakPolarHBondContact O-CG 3.33Å; S1210-L1214 PolarHBondContact O-N 2.99Å
1211	S	93.9	Very high	90.7	Very high	29 Å²	29	65.6 Å²	65.6	20%	0.203	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-43.3	174.4	-168.2	0	0	0	0	112.8	T1207 K1208 E1209 L1214 K1215	T1207-S1211 WeakPolarHBondContact O-CB 3.28Å; T1207-S1211 PolarHBondContact O-N 2.82Å; K1208-S1211 WeakPolarHBondContact O-CB 3.48Å; K1208-S1211 PolarHBondContact O-N 3.07Å; K1208-S1211 VanDerWaalsContact O-N 3.1Å; E1209-S1211 PolarHBondContact O-N 3.15Å; S1211-L1214 PolarHBondContact O-N 3.04Å; S1211-K1215 WeakPolarHBondContact O-CG 3.32Å; S1211-K1215 PolarHBondContact O-N 3.37Å; S1211-K1215 VanDerWaalsContact O-N 3.13Å
1212	E	93.6	Very high	90.7	Very high	128 Å²	128	67.4 Å²	67.4	60%	0.598	34%	0.338	S	S	*	.	H	α-helix	trans	-66.6	-42.4	177	-71.6	177.5	179.6	0	0	111	K1208 E1209 L1214 K1215 Y1216	K1208-E1212 WeakPolarHBondContact O-CG 3.24Å; K1208-E1212 PolarHBondContact O-N 3.21Å; E1209-E1212 PolarHBondContact O-N 2.78Å; E1212-L1214 PolarHBondContact O-N 3.49Å; E1212-K1215 WeakPolarHBondContact O-CB 3.39Å; E1212-K1215 PolarHBondContact O-N 3.43Å; E1212-Y1216 PolarHBondContact O-N 3.25Å
1213	Y	92.3	Very high	90.4	Very high	40 Å²	40	63.6 Å²	63.6	16%	0.157	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-39	176.3	-163	-118.1	0	0	0	112.2	H1170 R1174 E1189 E1209 S1210 K1215 Y1216 L1217	H1170-Y1213 AromaticContact CE1-CD1 3.8Å; R1174-Y1213 HydrophobicContact CG-CE1 4.11Å; E1189-Y1213 HydrophobicContact CG-CD1 3.89Å; E1209-Y1213 WeakPolarHBondContact O-CB 3.41Å; E1209-Y1213 PolarHBondContact O-N 3.16Å; S1210-Y1213 PolarHBondContact O-N 3.08Å; Y1213-K1215 PolarHBondContact O-N 3.41Å; Y1213-Y1216 AromaticContact CD2-CD1 3.99Å; Y1213-Y1216 HydrophobicContact CD2-CD1 3.99Å; Y1213-Y1216 AromaticContact CE2-CD1 3.8Å; Y1213-Y1216 HydrophobicContact CE2-CD1 3.8Å; Y1213-Y1216 HydrophobicContact CE2-CE1 4.12Å; Y1213-Y1216 WeakPolarHBondContact O-CB 3.42Å; Y1213-Y1216 PolarHBondContact O-N 3.41Å; Y1213-L1217 HydrophobicContact CD1-CD1 3.9Å; Y1213-L1217 HydrophobicContact CD1-CG 4.29Å; Y1213-L1217 HydrophobicContact CE1-CD1 3.73Å; Y1213-L1217 HydrophobicContact CE1-CD2 4.29Å; Y1213-L1217 HydrophobicContact CE1-CG 4.06Å; Y1213-L1217 WeakPolarHBondContact O-CG 3.46Å; Y1213-L1217 PolarHBondContact O-N 3.23Å
1214	L	93.6	Very high	90.1	Very high	27 Å²	27	61.7 Å²	61.7	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-58.8	-43.7	171	-81.3	172.6	0	0	0	113	L1186 E1189 K1190 Y1193 S1210 S1211 E1212 Y1216 L1217 T1218	L1186-L1214 HydrophobicContact CD2-CD2 4.22Å; E1189-L1214 HydrophobicContact CB-CD2 3.68Å; E1189-L1214 HydrophobicContact CB-CG 4.29Å; E1189-L1214 HydrophobicContact CG-CD2 3.58Å; E1189-L1214 HydrophobicContact CG-CG 3.61Å; K1190-L1214 HydrophobicContact CB-CD2 4.3Å; Y1193-L1214 HydrophobicContact CD1-CD1 4.09Å; Y1193-L1214 HydrophobicContact CD2-CD1 4.25Å; Y1193-L1214 HydrophobicContact CG-CD1 3.7Å; S1210-L1214 WeakPolarHBondContact O-CB 3.48Å; S1210-L1214 WeakPolarHBondContact O-CG 3.33Å; S1210-L1214 PolarHBondContact O-N 2.99Å; S1211-L1214 PolarHBondContact O-N 3.04Å; E1212-L1214 PolarHBondContact O-N 3.49Å; L1214-Y1216 VanDerWaalsContact C-N 3.33Å; L1214-L1217 PolarHBondContact O-N 3.32Å; L1214-T1218 WeakPolarHBondContact O-CB 3.14Å; L1214-T1218 PolarHBondContact O-N 2.79Å; L1214-T1218 PolarHBondContact O-OG1 2.91Å
1215	K	92.9	Very high	89.7	Confident	125 Å²	125	62.3 Å²	62.3	54%	0.543	31%	0.308	S	S	.	.	H	α-helix	trans	-62.3	-43.8	176.6	-70.3	168.9	-173.1	168.3	0	110.6	S1211 E1212 Y1213 T1218 Q1219	S1211-K1215 WeakPolarHBondContact O-CG 3.32Å; S1211-K1215 PolarHBondContact O-N 3.37Å; S1211-K1215 VanDerWaalsContact O-N 3.13Å; E1212-K1215 WeakPolarHBondContact O-CB 3.39Å; E1212-K1215 PolarHBondContact O-N 3.43Å; Y1213-K1215 PolarHBondContact O-N 3.41Å; K1215-T1218 PolarHBondContact O-N 3.41Å; K1215-Q1219 WeakPolarHBondContact O-CG 3.42Å; K1215-Q1219 PolarHBondContact O-N 3.17Å
1216	Y	91.1	Very high	89.5	Confident	67 Å²	67	63.5 Å²	63.5	26%	0.263	31%	0.306	S	S	.	.	H	α-helix	trans	-59.1	-53	176	167.8	-102	0	0	0	112	E1177 E1212 Y1213 L1214 T1218 Q1219 Q1220	E1177-Y1216 HydrophobicContact CG-CE1 4.44Å; E1177-Y1216 PolarHBondContact OE1-OH 2.77Å; E1212-Y1216 PolarHBondContact O-N 3.25Å; Y1213-Y1216 AromaticContact CD2-CD1 3.99Å; Y1213-Y1216 HydrophobicContact CD2-CD1 3.99Å; Y1213-Y1216 AromaticContact CE2-CD1 3.8Å; Y1213-Y1216 HydrophobicContact CE2-CD1 3.8Å; Y1213-Y1216 HydrophobicContact CE2-CE1 4.12Å; Y1213-Y1216 WeakPolarHBondContact O-CB 3.42Å; Y1213-Y1216 PolarHBondContact O-N 3.41Å; L1214-Y1216 VanDerWaalsContact C-N 3.33Å; Y1216-T1218 VanDerWaalsContact C-N 3.25Å; Y1216-T1218 PolarHBondContact O-N 3.43Å; Y1216-Q1219 PolarHBondContact O-N 3.44Å; Y1216-Q1219 VanDerWaalsContact O-N 3.13Å; Y1216-Q1220 HydrophobicContact CD2-CG 4.31Å; Y1216-Q1220 HydrophobicContact CE1-CG 4.2Å; Y1216-Q1220 HydrophobicContact CE2-CG 3.81Å; Y1216-Q1220 PolarHBondContact O-N 3.5Å; Y1216-Q1220 PolarHBondContact OH-NE2 3.24Å
1217	L	90.8	Very high	89	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.9	-38.8	178.1	-71.7	175.2	0	0	0	112.1	E1177 F1182 A1185 L1186 E1189 Y1213 L1214 Q1220 A1221	E1177-L1217 HydrophobicContact CB-CD2 3.82Å; E1177-L1217 HydrophobicContact CG-CD2 3.63Å; F1182-L1217 HydrophobicContact CD1-CD2 4.22Å; A1185-L1217 HydrophobicContact CB-CD1 4.21Å; A1185-L1217 HydrophobicContact CB-CD2 4.13Å; L1186-L1217 HydrophobicContact CD2-CB 3.55Å; L1186-L1217 HydrophobicContact CD2-CD1 4.45Å; L1186-L1217 HydrophobicContact CG-CB 4.02Å; E1189-L1217 HydrophobicContact CB-CD1 3.91Å; E1189-L1217 HydrophobicContact CG-CD1 4.21Å; Y1213-L1217 HydrophobicContact CD1-CD1 3.9Å; Y1213-L1217 HydrophobicContact CD1-CG 4.29Å; Y1213-L1217 HydrophobicContact CE1-CD1 3.73Å; Y1213-L1217 HydrophobicContact CE1-CD2 4.29Å; Y1213-L1217 HydrophobicContact CE1-CG 4.06Å; Y1213-L1217 WeakPolarHBondContact O-CG 3.46Å; Y1213-L1217 PolarHBondContact O-N 3.23Å; L1214-L1217 PolarHBondContact O-N 3.32Å; L1217-Q1220 PolarHBondContact O-N 3.39Å; L1217-A1221 WeakPolarHBondContact O-CB 3.13Å; L1217-A1221 PolarHBondContact O-N 2.89Å
1218	T	91.6	Very high	88.5	Confident	69 Å²	69	65 Å²	65	42%	0.423	32%	0.316	S	S	.	.	H	α-helix	trans	-65	-43.6	178.3	-56.5	0	0	0	0	111.4	L1186 L1214 K1215 Y1216 A1221 V1222	L1186-T1218 WeakPolarHBondContact CD2-OG1 3.33Å; L1214-T1218 WeakPolarHBondContact O-CB 3.14Å; L1214-T1218 PolarHBondContact O-N 2.79Å; L1214-T1218 PolarHBondContact O-OG1 2.91Å; K1215-T1218 PolarHBondContact O-N 3.41Å; Y1216-T1218 VanDerWaalsContact C-N 3.25Å; Y1216-T1218 PolarHBondContact O-N 3.43Å; T1218-A1221 PolarHBondContact O-N 3.43Å; T1218-V1222 VanDerWaalsContact O-CG2 3.3Å; T1218-V1222 WeakPolarHBondContact O-CG2 3.3Å; T1218-V1222 PolarHBondContact O-N 3.05Å
1219	Q	89.3	Confident	88	Confident	138 Å²	138	63.4 Å²	63.4	65%	0.645	31%	0.313	S	S	*	.	H	α-helix	trans	-62.9	-43.2	177.2	-71	173.4	10.6	0	0	111.5	K1215 Y1216 V1222 A1223	K1215-Q1219 WeakPolarHBondContact O-CG 3.42Å; K1215-Q1219 PolarHBondContact O-N 3.17Å; Y1216-Q1219 PolarHBondContact O-N 3.44Å; Y1216-Q1219 VanDerWaalsContact O-N 3.13Å; Q1219-V1222 PolarHBondContact O-N 2.97Å; Q1219-A1223 WeakPolarHBondContact O-CB 3.47Å; Q1219-A1223 PolarHBondContact O-N 3.17Å
1220	Q	86.3	Confident	87.4	Confident	34 Å²	34	63.6 Å²	63.6	16%	0.159	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-43.6	177.2	-68.5	-70.6	11.5	0	0	112.4	F1182 Y1216 L1217 V1222 A1223 L1224	F1182-Q1220 HydrophobicContact CD1-CB 3.97Å; F1182-Q1220 HydrophobicContact CE1-CB 3.47Å; F1182-Q1220 VanDerWaalsContact CE1-CB 3.47Å; F1182-Q1220 HydrophobicContact CE1-CG 4.24Å; F1182-Q1220 HydrophobicContact CZ-CB 3.81Å; Y1216-Q1220 HydrophobicContact CD2-CG 4.31Å; Y1216-Q1220 HydrophobicContact CE1-CG 4.2Å; Y1216-Q1220 HydrophobicContact CE2-CG 3.81Å; Y1216-Q1220 PolarHBondContact O-N 3.5Å; Y1216-Q1220 PolarHBondContact OH-NE2 3.24Å; L1217-Q1220 PolarHBondContact O-N 3.39Å; Q1220-V1222 VanDerWaalsContact C-N 3.33Å; Q1220-V1222 PolarHBondContact O-N 3.25Å; Q1220-A1223 PolarHBondContact O-N 3.39Å; Q1220-L1224 WeakPolarHBondContact O-CB 3.43Å; Q1220-L1224 PolarHBondContact O-N 3.12Å
1221	A	86.6	Confident	86.6	Confident	24 Å²	24	67.2 Å²	67.2	20%	0.198	33%	0.332	C	S	.	.	H	α-helix	trans	-59.5	-43.2	176.4	0	0	0	0	0	112.2	F1182 L1186 L1217 T1218 Q1225	F1182-A1221 HydrophobicContact CB-CB 3.7Å; F1182-A1221 HydrophobicContact CG-CB 4.24Å; L1186-A1221 HydrophobicContact CD1-CB 4.09Å; L1217-A1221 WeakPolarHBondContact O-CB 3.13Å; L1217-A1221 PolarHBondContact O-N 2.89Å; T1218-A1221 PolarHBondContact O-N 3.43Å; A1221-Q1225 WeakPolarHBondContact O-CB 3.42Å; A1221-Q1225 PolarHBondContact O-N 3.32Å
1222	V	89.1	Confident	85.9	Confident	68 Å²	68	74.6 Å²	74.6	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-66.5	-42	176.7	171.7	0	0	0	0	111.1	T1218 Q1219 Q1220 Q1225 R1226	T1218-V1222 VanDerWaalsContact O-CG2 3.3Å; T1218-V1222 WeakPolarHBondContact O-CG2 3.3Å; T1218-V1222 PolarHBondContact O-N 3.05Å; Q1219-V1222 PolarHBondContact O-N 2.97Å; Q1220-V1222 VanDerWaalsContact C-N 3.33Å; Q1220-V1222 PolarHBondContact O-N 3.25Å; V1222-Q1225 PolarHBondContact O-N 2.72Å; V1222-R1226 WeakPolarHBondContact O-CB 3.13Å; V1222-R1226 WeakPolarHBondContact O-CG 3.46Å; V1222-R1226 PolarHBondContact O-N 3.15Å
1223	A	84.4	Confident	85	Confident	38 Å²	38	76.9 Å²	76.9	31%	0.314	37%	0.365	S	S	.	.	H	α-helix	trans	-60.2	-49.3	176	0	0	0	0	0	111.2	Q1219 Q1220 Q1225 R1226 T1227	Q1219-A1223 WeakPolarHBondContact O-CB 3.47Å; Q1219-A1223 PolarHBondContact O-N 3.17Å; Q1220-A1223 PolarHBondContact O-N 3.39Å; A1223-Q1225 PolarHBondContact O-N 2.8Å; A1223-R1226 WeakPolarHBondContact O-CB 3.23Å; A1223-R1226 PolarHBondContact O-N 2.97Å; A1223-T1227 PolarHBondContact O-N 3.25Å; A1223-T1227 PolarHBondContact O-OG1 3.06Å
1224	L	82.9	Confident	83.9	Confident	39 Å²	39	80 Å²	80	20%	0.204	38%	0.384	C	S	.	.	H	α-helix	trans	-56	-49.8	176.7	179.9	66.1	0	0	0	111.6	F1182 Q1220 R1226 T1227 M1228 L1243	F1182-L1224 HydrophobicContact CD2-CB 4.41Å; F1182-L1224 HydrophobicContact CD2-CD2 3.62Å; F1182-L1224 HydrophobicContact CE2-CB 4.33Å; F1182-L1224 HydrophobicContact CE2-CD2 3.82Å; Q1220-L1224 WeakPolarHBondContact O-CB 3.43Å; Q1220-L1224 PolarHBondContact O-N 3.12Å; L1224-R1226 VanDerWaalsContact C-N 3.32Å; L1224-R1226 PolarHBondContact O-N 2.92Å; L1224-T1227 VanDerWaalsContact C-OG1 3.31Å; L1224-T1227 VanDerWaalsContact CA-OG1 3.29Å; L1224-T1227 WeakPolarHBondContact CA-OG1 3.33Å; L1224-T1227 PolarHBondContact O-N 2.67Å; L1224-T1227 PolarHBondContact O-OG1 2.8Å; L1224-M1228 HydrophobicContact CD1-CG 4.44Å; L1224-M1228 HydrophobicContact CG-SD 4.28Å; L1224-M1228 WeakPolarHBondContact O-CG 3.47Å; L1224-M1228 PolarHBondContact O-N 3.02Å; L1224-L1243 HydrophobicContact CB-CD2 3.96Å; L1224-L1243 HydrophobicContact CD1-CD1 3.47Å; L1224-L1243 VanDerWaalsContact CD1-CD1 3.47Å; L1224-L1243 HydrophobicContact CD1-CD2 3.81Å; L1224-L1243 HydrophobicContact CD1-CG 4.29Å; L1224-L1243 HydrophobicContact CG-CD2 4.48Å
1225	Q	83.2	Confident	82.6	Confident	81 Å²	81	80.8 Å²	80.8	38%	0.379	40%	0.399	S	S	.	.	H	α-helix	trans	-63.2	-37.2	-179.6	-171.3	65.8	55.9	0	0	112.2	A1221 V1222 A1223 M1228 N1229	A1221-Q1225 WeakPolarHBondContact O-CB 3.42Å; A1221-Q1225 PolarHBondContact O-N 3.32Å; V1222-Q1225 PolarHBondContact O-N 2.72Å; A1223-Q1225 PolarHBondContact O-N 2.8Å; Q1225-M1228 PolarHBondContact O-N 3.39Å; Q1225-N1229 PolarHBondContact NE2-OD1 3.01Å; Q1225-N1229 VanDerWaalsContact NE2-OD1 3.14Å; Q1225-N1229 WeakPolarHBondContact O-CB 3.38Å; Q1225-N1229 PolarHBondContact O-N 2.92Å; Q1225-N1229 PolarHBondContact O-ND2 3.35Å; Q1225-N1229 PolarHBondContact O-OD1 2.81Å
1226	R	84.5	Confident	81	Confident	168 Å²	168	81.1 Å²	81.1	63%	0.634	42%	0.417	S	S	*	.	H	α-helix	trans	-63.2	-48.8	174	-75.9	177	-177.6	-177.8	2.1	111.1	V1222 A1223 L1224 M1228 N1229 E1230	V1222-R1226 WeakPolarHBondContact O-CB 3.13Å; V1222-R1226 WeakPolarHBondContact O-CG 3.46Å; V1222-R1226 PolarHBondContact O-N 3.15Å; A1223-R1226 WeakPolarHBondContact O-CB 3.23Å; A1223-R1226 PolarHBondContact O-N 2.97Å; L1224-R1226 VanDerWaalsContact C-N 3.32Å; L1224-R1226 PolarHBondContact O-N 2.92Å; R1226-M1228 PolarHBondContact O-N 2.78Å; R1226-N1229 PolarHBondContact O-N 3.18Å; R1226-E1230 WeakPolarHBondContact O-CG 3.39Å; R1226-E1230 PolarHBondContact O-N 3.08Å
1227	T	78	Confident	79.4	Confident	15 Å²	15	85.3 Å²	85.3	9%	0.092	44%	0.444	C	S	.	.	H	α-helix	trans	-59.8	-42.9	176	32.4	0	0	0	0	112.4	A1223 L1224 N1229 E1230 I1231 I1240	A1223-T1227 PolarHBondContact O-N 3.25Å; A1223-T1227 PolarHBondContact O-OG1 3.06Å; L1224-T1227 VanDerWaalsContact C-OG1 3.31Å; L1224-T1227 VanDerWaalsContact CA-OG1 3.29Å; L1224-T1227 WeakPolarHBondContact CA-OG1 3.33Å; L1224-T1227 PolarHBondContact O-N 2.67Å; L1224-T1227 PolarHBondContact O-OG1 2.8Å; T1227-N1229 PolarHBondContact O-N 3Å; T1227-E1230 PolarHBondContact O-N 3.31Å; T1227-I1231 WeakPolarHBondContact O-CD1 3.43Å; T1227-I1231 VanDerWaalsContact O-CG1 3.25Å; T1227-I1231 WeakPolarHBondContact O-CG1 3.46Å; T1227-I1231 PolarHBondContact O-N 3.02Å; T1227-I1240 HydrophobicContact CG2-CG2 4.35Å
1228	M	79.4	Confident	77.9	Confident	76 Å²	76	86.3 Å²	86.3	37%	0.374	45%	0.452	S	S	.	.	H	α-helix	trans	-60.6	-46.1	175.7	-69.6	-177.5	91.3	0	0	111.1	L1224 Q1225 R1226 E1230 I1231 Y1232	L1224-M1228 HydrophobicContact CD1-CG 4.44Å; L1224-M1228 HydrophobicContact CG-SD 4.28Å; L1224-M1228 WeakPolarHBondContact O-CG 3.47Å; L1224-M1228 PolarHBondContact O-N 3.02Å; Q1225-M1228 PolarHBondContact O-N 3.39Å; R1226-M1228 PolarHBondContact O-N 2.78Å; M1228-E1230 VanDerWaalsContact C-N 3.31Å; M1228-E1230 PolarHBondContact O-N 2.89Å; M1228-I1231 PolarHBondContact O-N 3.13Å; M1228-Y1232 HydrophobicContact CB-CE2 4.4Å; M1228-Y1232 WeakPolarHBondContact O-CD2 3.48Å; M1228-Y1232 PolarHBondContact O-N 3.19Å
1229	N	82.4	Confident	76	Confident	74 Å²	74	88.6 Å²	88.6	40%	0.396	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-34.4	178.4	-70.1	-12.9	0	0	0	112.8	Q1225 R1226 T1227 K1233	Q1225-N1229 PolarHBondContact NE2-OD1 3.01Å; Q1225-N1229 VanDerWaalsContact NE2-OD1 3.14Å; Q1225-N1229 WeakPolarHBondContact O-CB 3.38Å; Q1225-N1229 PolarHBondContact O-N 2.92Å; Q1225-N1229 PolarHBondContact O-ND2 3.35Å; Q1225-N1229 PolarHBondContact O-OD1 2.81Å; R1226-N1229 PolarHBondContact O-N 3.18Å; T1227-N1229 PolarHBondContact O-N 3Å; N1229-K1233 WeakPolarHBondContact O-CB 3.46Å; N1229-K1233 WeakPolarHBondContact O-CG 3.49Å; N1229-K1233 PolarHBondContact O-N 3.02Å; N1229-K1233 VanDerWaalsContact O-N 3.13Å
1230	E	77.3	Confident	74.4	Confident	92 Å²	92	86.4 Å²	86.4	43%	0.43	46%	0.463	S	S	.	.	H	α-helix	trans	-69.4	-41	174.8	-76.3	175.1	-178.6	0	0	112.2	R1226 T1227 M1228 Y1232 K1233 N1234	R1226-E1230 WeakPolarHBondContact O-CG 3.39Å; R1226-E1230 PolarHBondContact O-N 3.08Å; T1227-E1230 PolarHBondContact O-N 3.31Å; M1228-E1230 VanDerWaalsContact C-N 3.31Å; M1228-E1230 PolarHBondContact O-N 2.89Å; E1230-Y1232 VanDerWaalsContact C-N 3.34Å; E1230-Y1232 PolarHBondContact O-N 2.82Å; E1230-K1233 PolarHBondContact O-N 3.3Å; E1230-N1234 PolarHBondContact O-N 2.81Å
1231	I	76.4	Confident	72.9	Confident	80 Å²	80	92 Å²	92	41%	0.41	49%	0.49	S	S	.	.	H	α-helix	trans	-60.4	-45.1	173.7	-67.8	163.6	0	0	0	110.4	T1227 M1228 K1233 G1235 I1240	T1227-I1231 WeakPolarHBondContact O-CD1 3.43Å; T1227-I1231 VanDerWaalsContact O-CG1 3.25Å; T1227-I1231 WeakPolarHBondContact O-CG1 3.46Å; T1227-I1231 PolarHBondContact O-N 3.02Å; M1228-I1231 PolarHBondContact O-N 3.13Å; I1231-K1233 VanDerWaalsContact C-N 3.28Å; I1231-K1233 PolarHBondContact O-N 3.28Å; I1231-G1235 PolarHBondContact O-N 2.9Å; I1231-I1240 HydrophobicContact CD1-CD1 4.13Å; I1231-I1240 HydrophobicContact CD1-CG1 4.48Å; I1231-I1240 HydrophobicContact CG1-CD1 4.22Å; I1231-I1240 HydrophobicContact CG1-CG1 4.31Å
1232	Y	77.4	Confident	71.3	Confident	184 Å²	184	95.6 Å²	95.6	72%	0.722	51%	0.512	S	S	*	.	H	α-helix	trans	-64.6	-29.3	176.7	-76.1	-63.1	0	0	0	113.5	M1228 E1230	M1228-Y1232 HydrophobicContact CB-CE2 4.4Å; M1228-Y1232 WeakPolarHBondContact O-CD2 3.48Å; M1228-Y1232 PolarHBondContact O-N 3.19Å; E1230-Y1232 VanDerWaalsContact C-N 3.34Å; E1230-Y1232 PolarHBondContact O-N 2.82Å
1233	K	75.4	Confident	69.8	Low	175 Å²	175	94.2 Å²	94.2	76%	0.761	50%	0.502	S	S	*	.	H	α-helix	trans	-86.7	-38.3	-178.1	-79.1	-179.8	178.6	-177.9	0	114.3	N1229 E1230 I1231	N1229-K1233 WeakPolarHBondContact O-CB 3.46Å; N1229-K1233 WeakPolarHBondContact O-CG 3.49Å; N1229-K1233 PolarHBondContact O-N 3.02Å; N1229-K1233 VanDerWaalsContact O-N 3.13Å; E1230-K1233 PolarHBondContact O-N 3.3Å; I1231-K1233 VanDerWaalsContact C-N 3.28Å; I1231-K1233 PolarHBondContact O-N 3.28Å
1234	N	69.5	Low	68.4	Low	105 Å²	105	100.6 Å²	100.6	56%	0.561	52%	0.523	S	S	*	.	H	α-helix	trans	-107.8	-3.6	-168.3	-68.8	-14.3	0	0	0	114.4	E1230 A1238	E1230-N1234 PolarHBondContact O-N 2.81Å; N1234-A1238 HydrophobicContact CB-CB 4.14Å
1235	G	66	Low	67.4	Low	44 Å²	44	105.6 Å²	105.6	45%	0.454	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	56.2	-150.5	-176.8	0	0	0	0	0	112.4	I1231 N1237 A1238	I1231-G1235 PolarHBondContact O-N 2.9Å; G1235-N1237 PolarHBondContact O-N 3.26Å; G1235-A1238 PolarHBondContact O-N 2.83Å
1236	S	58.7	Low	66.4	Low	133 Å²	133	105.1 Å²	105.1	93%	0.93	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-58.2	-9.2	-173	-29.8	0	0	0	0	116.3
1237	N	57.8	Low	65.8	Low	155 Å²	155	100.1 Å²	100.1	83%	0.829	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-101.9	9.4	-177.1	-74.4	-16.1	0	0	0	113.9	G1235 S1239	G1235-N1237 PolarHBondContact O-N 3.26Å; N1237-S1239 PolarHBondContact O-N 2.92Å
1238	A	59.1	Low	66	Low	20 Å²	20	100.1 Å²	100.1	17%	0.165	54%	0.541	C	S	.	.			trans	-67	123.8	176.2	0	0	0	0	0	111.4	N1234 G1235 I1240	N1234-A1238 HydrophobicContact CB-CB 4.14Å; G1235-A1238 PolarHBondContact O-N 2.83Å; A1238-I1240 HydrophobicContact CB-CG1 4.44Å; A1238-I1240 PolarHBondContact O-N 3.05Å; A1238-I1240 VanDerWaalsContact O-N 3.16Å
1239	S	52	Low	66.3	Low	117 Å²	117	99.7 Å²	99.7	82%	0.818	55%	0.545	S	S	*	.			trans	-76.4	97.5	168.6	-176	0	0	0	0	108.5	N1237	N1237-S1239 PolarHBondContact O-N 2.92Å
1240	I	56	Low	66.6	Low	93 Å²	93	100 Å²	100	48%	0.477	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-81.5	120.3	-176.5	-57.2	169	0	0	0	108.7	T1227 I1231 A1238 P1242	T1227-I1240 HydrophobicContact CG2-CG2 4.35Å; I1231-I1240 HydrophobicContact CD1-CD1 4.13Å; I1231-I1240 HydrophobicContact CD1-CG1 4.48Å; I1231-I1240 HydrophobicContact CG1-CD1 4.22Å; I1231-I1240 HydrophobicContact CG1-CG1 4.31Å; A1238-I1240 HydrophobicContact CB-CG1 4.44Å; A1238-I1240 PolarHBondContact O-N 3.05Å; A1238-I1240 VanDerWaalsContact O-N 3.16Å; I1240-P1242 WeakPolarHBondContact O-CD 3.5Å
1241	M	54.4	Low	67.1	Low	150 Å²	150	99.2 Å²	99.2	74%	0.739	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-68.1	121.9	163.1	-165.2	179.1	112.4	0	0	107.6	L1243	M1241-L1243 PolarHBondContact O-N 2.94Å; M1241-L1243 VanDerWaalsContact O-N 3.14Å
1242	P	53.3	Low	67.8	Low	101 Å²	101	96.4 Å²	96.4	66%	0.656	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-62.5	121.8	-175.8	22.1	-30.8	0	0	0	109.8	I1240 K1244	I1240-P1242 WeakPolarHBondContact O-CD 3.5Å; P1242-K1244 PolarHBondContact O-N 2.89Å
1243	L	57.2	Low	68.5	Low	39 Å²	39	87.8 Å²	87.8	20%	0.204	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-57.4	121.3	167.2	-81.3	137.7	0	0	0	107.7	L1224 M1241 F1245	L1224-L1243 HydrophobicContact CB-CD2 3.96Å; L1224-L1243 HydrophobicContact CD1-CD1 3.47Å; L1224-L1243 VanDerWaalsContact CD1-CD1 3.47Å; L1224-L1243 HydrophobicContact CD1-CD2 3.81Å; L1224-L1243 HydrophobicContact CD1-CG 4.29Å; L1224-L1243 HydrophobicContact CG-CD2 4.48Å; M1241-L1243 PolarHBondContact O-N 2.94Å; M1241-L1243 VanDerWaalsContact O-N 3.14Å; L1243-F1245 HydrophobicContact CB-CD2 4.29Å; L1243-F1245 HydrophobicContact CB-CE1 4.29Å; L1243-F1245 HydrophobicContact CB-CE2 3.68Å; L1243-F1245 HydrophobicContact CB-CZ 3.68Å; L1243-F1245 HydrophobicContact CD1-CZ 4.28Å; L1243-F1245 VanDerWaalsContact O-CD2 3.27Å; L1243-F1245 WeakPolarHBondContact O-CD2 3.4Å; L1243-F1245 PolarHBondContact O-N 3.02Å
1244	K	56.1	Low	69.3	Low	172 Å²	172	81 Å²	81	75%	0.748	48%	0.48	S	S	*	.			trans	-74.7	92.9	174.1	-73.8	-175.3	178.1	-178.4	0	107.8	P1242 T1246	P1242-K1244 PolarHBondContact O-N 2.89Å; K1244-T1246 PolarHBondContact O-N 3.25Å
1245	F	61.2	Low	70.3	Confident	143 Å²	143	80.8 Å²	80.8	63%	0.627	48%	0.476	S	S	*	.			trans	-75.8	108.9	167.2	-58.5	-76.7	0	0	0	108	A1180 L1243 A1247	A1180-F1245 HydrophobicContact CB-CD1 4.47Å; A1180-F1245 HydrophobicContact CB-CE1 3.9Å; L1243-F1245 HydrophobicContact CB-CD2 4.29Å; L1243-F1245 HydrophobicContact CB-CE1 4.29Å; L1243-F1245 HydrophobicContact CB-CE2 3.68Å; L1243-F1245 HydrophobicContact CB-CZ 3.68Å; L1243-F1245 HydrophobicContact CD1-CZ 4.28Å; L1243-F1245 VanDerWaalsContact O-CD2 3.27Å; L1243-F1245 WeakPolarHBondContact O-CD2 3.4Å; L1243-F1245 PolarHBondContact O-N 3.02Å; F1245-A1247 PolarHBondContact O-N 3.37Å
1246	T	62.8	Low	71.5	Confident	71 Å²	71	79.5 Å²	79.5	44%	0.436	46%	0.458	S	S	.	.			trans	-85.8	100.8	176.4	29.6	0	0	0	0	109	E1177 K1244	E1177-T1246 PolarHBondContact OE1-OG1 3.15Å; E1177-T1246 VanDerWaalsContact OE1-OG1 3.09Å; K1244-T1246 PolarHBondContact O-N 3.25Å
1247	A	71.2	Confident	73.2	Confident	63 Å²	63	73.2 Å²	73.2	52%	0.521	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-57	138.4	163.9	0	0	0	0	0	108.8	F1245 S1249	F1245-A1247 PolarHBondContact O-N 3.37Å; A1247-S1249 PolarHBondContact O-N 3.24Å
1248	P	81.6	Confident	74.8	Confident	16 Å²	16	66.3 Å²	66.3	10%	0.104	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-65.3	134	-177.4	27.8	-34.6	0	0	0	110	H1135 I1253	H1135-P1248 VanDerWaalsContact O-CG 3.26Å; H1135-P1248 WeakPolarHBondContact O-CG 3.43Å; P1248-I1253 HydrophobicContact CB-CD1 3.93Å; P1248-I1253 HydrophobicContact CB-CG1 4.3Å; P1248-I1253 HydrophobicContact CG-CD1 4.15Å
1249	S	87.1	Confident	76.3	Confident	66 Å²	66	67.1 Å²	67.1	46%	0.462	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-75.3	137	175.5	74.5	0	0	0	0	110.2	A1247 A1251 S1252 I1253	A1247-S1249 PolarHBondContact O-N 3.24Å; S1249-A1251 PolarHBondContact O-N 2.98Å; S1249-S1252 WeakPolarHBondContact O-CB 3.5Å; S1249-S1252 PolarHBondContact O-N 3.13Å; S1249-S1252 WeakPolarHBondContact OG-CB 3.05Å; S1249-S1252 PolarHBondContact OG-N 3.33Å; S1249-S1252 VanDerWaalsContact OG-N 3.16Å; S1249-I1253 PolarHBondContact O-N 2.89Å
1250	M	88	Confident	78.2	Confident	82 Å²	82	62.9 Å²	62.9	40%	0.404	35%	0.346	S	S	.	.	H	α-helix	trans	-57.4	-34.7	177.1	-67.2	-64.2	144.1	0	0	112.3	F1093 L1098 G1136 I1253 L1254	F1093-M1250 HydrophobicContact CE2-SD 4.37Å; F1093-M1250 HydrophobicContact CZ-SD 3.93Å; L1098-M1250 HydrophobicContact CD2-SD 4.47Å; G1136-M1250 VanDerWaalsContact C-CE 3.45Å; G1136-M1250 WeakPolarHBondContact O-CE 3.1Å; M1250-I1253 PolarHBondContact O-N 3.37Å; M1250-L1254 WeakPolarHBondContact O-CB 3.45Å; M1250-L1254 PolarHBondContact O-N 3.11Å
1251	A	88.8	Confident	79.8	Confident	74 Å²	74	59.6 Å²	59.6	61%	0.612	33%	0.329	S	S	*	.	H	α-helix	trans	-63.4	-41.4	174.9	0	0	0	0	0	112.2	S1249 I1253 L1254 E1255	S1249-A1251 PolarHBondContact O-N 2.98Å; A1251-I1253 VanDerWaalsContact C-N 3.35Å; A1251-L1254 PolarHBondContact O-N 2.94Å; A1251-E1255 PolarHBondContact O-N 3.17Å
1252	S	89.7	Confident	81.3	Confident	22 Å²	22	53.7 Å²	53.7	15%	0.154	31%	0.307	C	S	.	.	H	α-helix	trans	-68.5	-36.3	177.4	-172.1	0	0	0	0	111.7	R1174 S1249 E1255 Q1256	R1174-S1252 PolarHBondContact NH1-OG 3.31Å; R1174-S1252 PolarHBondContact NH2-OG 3.29Å; S1249-S1252 WeakPolarHBondContact O-CB 3.5Å; S1249-S1252 PolarHBondContact O-N 3.13Å; S1249-S1252 WeakPolarHBondContact OG-CB 3.05Å; S1249-S1252 PolarHBondContact OG-N 3.33Å; S1249-S1252 VanDerWaalsContact OG-N 3.16Å; S1252-E1255 PolarHBondContact O-N 2.96Å; S1252-Q1256 WeakPolarHBondContact O-CG 3.49Å; S1252-Q1256 PolarHBondContact O-N 2.83Å; S1252-Q1256 VanDerWaalsContact O-N 3.08Å
1253	I	92.5	Very high	82.7	Confident	2 Å²	2	49 Å²	49	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-67.3	-43.6	175.1	-65.3	175.1	0	0	0	110.7	F1093 L1132 P1248 S1249 M1250 A1251 E1255 Q1256 L1257	F1093-I1253 HydrophobicContact CE1-CB 4.34Å; F1093-I1253 HydrophobicContact CE1-CG2 3.96Å; F1093-I1253 HydrophobicContact CE2-CG2 4.13Å; F1093-I1253 HydrophobicContact CZ-CB 3.94Å; F1093-I1253 HydrophobicContact CZ-CG2 3.44Å; F1093-I1253 VanDerWaalsContact CZ-CG2 3.44Å; L1132-I1253 HydrophobicContact CB-CG2 4.19Å; L1132-I1253 WeakPolarHBondContact O-CG2 3.42Å; P1248-I1253 HydrophobicContact CB-CD1 3.93Å; P1248-I1253 HydrophobicContact CB-CG1 4.3Å; P1248-I1253 HydrophobicContact CG-CD1 4.15Å; S1249-I1253 PolarHBondContact O-N 2.89Å; M1250-I1253 PolarHBondContact O-N 3.37Å; A1251-I1253 VanDerWaalsContact C-N 3.35Å; I1253-E1255 VanDerWaalsContact C-N 3.27Å; I1253-E1255 PolarHBondContact O-N 3.11Å; I1253-Q1256 PolarHBondContact O-N 3.36Å; I1253-Q1256 VanDerWaalsContact O-N 3.14Å; I1253-L1257 HydrophobicContact CG2-CD1 3.93Å; I1253-L1257 HydrophobicContact CG2-CG 4.22Å; I1253-L1257 WeakPolarHBondContact O-CB 3.41Å; I1253-L1257 WeakPolarHBondContact O-CG 3.25Å; I1253-L1257 PolarHBondContact O-N 3.37Å
1254	L	91.9	Very high	83.1	Confident	32 Å²	32	51.7 Å²	51.7	17%	0.168	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-41.2	176.3	-176.1	63.6	0	0	0	111.5	Y1051 L1090 F1093 A1094 M1250 A1251 L1257 N1258	Y1051-L1254 WeakPolarHBondContact OH-CD1 3.44Å; L1090-L1254 HydrophobicContact CD1-CD1 4.27Å; F1093-L1254 HydrophobicContact CD1-CB 4.38Å; F1093-L1254 HydrophobicContact CD1-CD1 3.85Å; F1093-L1254 HydrophobicContact CE1-CB 4Å; F1093-L1254 HydrophobicContact CE1-CD1 4.33Å; A1094-L1254 HydrophobicContact CB-CD1 3.82Å; A1094-L1254 HydrophobicContact CB-CD2 4.22Å; M1250-L1254 WeakPolarHBondContact O-CB 3.45Å; M1250-L1254 PolarHBondContact O-N 3.11Å; A1251-L1254 PolarHBondContact O-N 2.94Å; L1254-L1257 PolarHBondContact O-N 2.86Å; L1254-N1258 WeakPolarHBondContact O-CB 3.47Å; L1254-N1258 VanDerWaalsContact O-CG 3.28Å; L1254-N1258 PolarHBondContact O-N 2.89Å; L1254-N1258 PolarHBondContact O-ND2 2.76Å
1255	E	91.1	Very high	83.3	Confident	102 Å²	102	49.7 Å²	49.7	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-59.7	-46.7	174.1	-174.4	-175.7	-172.2	0	0	111.7	A1251 S1252 I1253 L1257 N1258 I1259	A1251-E1255 PolarHBondContact O-N 3.17Å; S1252-E1255 PolarHBondContact O-N 2.96Å; I1253-E1255 VanDerWaalsContact C-N 3.27Å; I1253-E1255 PolarHBondContact O-N 3.11Å; E1255-L1257 PolarHBondContact O-N 2.81Å; E1255-N1258 PolarHBondContact O-N 2.6Å; E1255-I1259 HydrophobicContact CG-CD1 4.19Å; E1255-I1259 VanDerWaalsContact O-CG1 3.28Å; E1255-I1259 WeakPolarHBondContact O-CG1 3.22Å; E1255-I1259 PolarHBondContact O-N 3.29Å
1256	Q	92	Very high	82.8	Confident	16 Å²	16	44.9 Å²	44.9	8%	0.075	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-42.3	176.2	-64.9	-54.7	-53.9	0	0	112.1	L1132 L1171 S1252 I1253 N1258 I1259 I1260	L1132-Q1256 HydrophobicContact CD1-CB 3.81Å; L1132-Q1256 HydrophobicContact CD2-CB 3.93Å; L1171-Q1256 HydrophobicContact CD2-CB 4.23Å; L1171-Q1256 HydrophobicContact CD2-CG 4.02Å; S1252-Q1256 WeakPolarHBondContact O-CG 3.49Å; S1252-Q1256 PolarHBondContact O-N 2.83Å; S1252-Q1256 VanDerWaalsContact O-N 3.08Å; I1253-Q1256 PolarHBondContact O-N 3.36Å; I1253-Q1256 VanDerWaalsContact O-N 3.14Å; Q1256-N1258 VanDerWaalsContact C-N 3.31Å; Q1256-N1258 PolarHBondContact O-N 2.89Å; Q1256-I1259 PolarHBondContact O-N 2.75Å; Q1256-I1260 WeakPolarHBondContact O-CG1 3.2Å; Q1256-I1260 PolarHBondContact O-N 3.12Å
1257	L	93.5	Very high	81.7	Confident	1 Å²	1	45 Å²	45	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-43.3	174.9	-74.2	170.6	0	0	0	111.1	L1090 F1093 N1129 L1132 V1133 I1253 L1254 E1255 I1259 I1260 N1261	L1090-L1257 HydrophobicContact CD1-CB 3.59Å; L1090-L1257 HydrophobicContact CD1-CD1 4.27Å; L1090-L1257 HydrophobicContact CD1-CG 4.45Å; F1093-L1257 HydrophobicContact CB-CD1 4.41Å; F1093-L1257 HydrophobicContact CD1-CD1 3.48Å; F1093-L1257 VanDerWaalsContact CD1-CD1 3.48Å; F1093-L1257 HydrophobicContact CD2-CD1 4.16Å; F1093-L1257 HydrophobicContact CE1-CD1 3.69Å; F1093-L1257 HydrophobicContact CE2-CD1 4.33Å; F1093-L1257 HydrophobicContact CG-CD1 3.75Å; F1093-L1257 HydrophobicContact CZ-CD1 4.12Å; N1129-L1257 HydrophobicContact CB-CD2 4.31Å; N1129-L1257 VanDerWaalsContact OD1-CD2 3.3Å; N1129-L1257 WeakPolarHBondContact OD1-CD2 3.46Å; L1132-L1257 HydrophobicContact CB-CD2 3.78Å; L1132-L1257 HydrophobicContact CB-CG 4.17Å; L1132-L1257 HydrophobicContact CD1-CD2 3.81Å; L1132-L1257 HydrophobicContact CD1-CG 4.05Å; L1132-L1257 HydrophobicContact CG-CD2 4.47Å; V1133-L1257 HydrophobicContact CG2-CD1 4.22Å; V1133-L1257 HydrophobicContact CG2-CD2 4.4Å; I1253-L1257 HydrophobicContact CG2-CD1 3.93Å; I1253-L1257 HydrophobicContact CG2-CG 4.22Å; I1253-L1257 WeakPolarHBondContact O-CB 3.41Å; I1253-L1257 WeakPolarHBondContact O-CG 3.25Å; I1253-L1257 PolarHBondContact O-N 3.37Å; L1254-L1257 PolarHBondContact O-N 2.86Å; E1255-L1257 PolarHBondContact O-N 2.81Å; L1257-I1259 VanDerWaalsContact C-N 3.34Å; L1257-I1259 PolarHBondContact O-N 3.17Å; L1257-I1260 HydrophobicContact CD2-CD1 4.31Å; L1257-I1260 VanDerWaalsContact O-CG1 3.3Å; L1257-I1260 WeakPolarHBondContact O-CG1 3.36Å; L1257-I1260 PolarHBondContact O-N 2.82Å; L1257-N1261 WeakPolarHBondContact O-CB 3.42Å; L1257-N1261 PolarHBondContact O-N 2.8Å; L1257-N1261 VanDerWaalsContact O-N 3.11Å; L1257-N1261 PolarHBondContact O-ND2 3.06Å
1258	N	92.4	Very high	79.9	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.053	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-37.6	176.5	-77	-26.8	0	0	0	113	Y1051 L1254 E1255 Q1256 G1262 I1263 I1264	Y1051-N1258 VanDerWaalsContact CE1-OD1 3.32Å; Y1051-N1258 WeakPolarHBondContact CE1-OD1 3.23Å; Y1051-N1258 PolarHBondContact OH-ND2 2.69Å; Y1051-N1258 PolarHBondContact OH-OD1 3.33Å; L1254-N1258 WeakPolarHBondContact O-CB 3.47Å; L1254-N1258 VanDerWaalsContact O-CG 3.28Å; L1254-N1258 PolarHBondContact O-N 2.89Å; L1254-N1258 PolarHBondContact O-ND2 2.76Å; E1255-N1258 PolarHBondContact O-N 2.6Å; Q1256-N1258 VanDerWaalsContact C-N 3.31Å; Q1256-N1258 PolarHBondContact O-N 2.89Å; N1258-G1262 PolarHBondContact O-N 3.13Å; N1258-I1263 PolarHBondContact O-N 3.42Å; N1258-I1264 HydrophobicContact CB-CD1 3.55Å; N1258-I1264 HydrophobicContact CB-CG1 3.97Å
1259	I	90.3	Very high	77.2	Confident	37 Å²	37	59.5 Å²	59.5	19%	0.19	31%	0.313	C	S	.	.	H	α-helix	trans	-66.9	-50.2	177.1	-68	164.6	0	0	0	110.5	L1167 E1255 Q1256 L1257 N1261 G1262 F1265	L1167-I1259 HydrophobicContact CD2-CG2 3.87Å; E1255-I1259 HydrophobicContact CG-CD1 4.19Å; E1255-I1259 VanDerWaalsContact O-CG1 3.28Å; E1255-I1259 WeakPolarHBondContact O-CG1 3.22Å; E1255-I1259 PolarHBondContact O-N 3.29Å; Q1256-I1259 PolarHBondContact O-N 2.75Å; L1257-I1259 VanDerWaalsContact C-N 3.34Å; L1257-I1259 PolarHBondContact O-N 3.17Å; I1259-N1261 VanDerWaalsContact C-N 3.34Å; I1259-N1261 PolarHBondContact O-N 2.93Å; I1259-G1262 PolarHBondContact O-N 2.93Å; I1259-G1262 VanDerWaalsContact O-N 3.14Å; I1259-F1265 HydrophobicContact CG1-CE2 4.29Å; I1259-F1265 HydrophobicContact CG2-CE2 4.5Å
1260	I	91.4	Very high	76.8	Confident	29 Å²	29	59.2 Å²	59.2	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-67.1	-35.2	-176.1	62.9	164.5	0	0	0	112.5	L1125 N1129 L1132 L1167 L1171 Q1256 L1257 G1262	L1125-I1260 HydrophobicContact CD1-CB 4.09Å; L1125-I1260 HydrophobicContact CD1-CD1 4.26Å; L1125-I1260 HydrophobicContact CD1-CG1 4.22Å; L1125-I1260 WeakPolarHBondContact CD1-O 3.49Å; N1129-I1260 HydrophobicContact CB-CD1 4.48Å; L1132-I1260 HydrophobicContact CD1-CD1 3.66Å; L1132-I1260 HydrophobicContact CD1-CG1 4.25Å; L1167-I1260 HydrophobicContact CD2-CG2 3.79Å; L1171-I1260 HydrophobicContact CD1-CG2 4.19Å; Q1256-I1260 WeakPolarHBondContact O-CG1 3.2Å; Q1256-I1260 PolarHBondContact O-N 3.12Å; L1257-I1260 HydrophobicContact CD2-CD1 4.31Å; L1257-I1260 VanDerWaalsContact O-CG1 3.3Å; L1257-I1260 WeakPolarHBondContact O-CG1 3.36Å; L1257-I1260 PolarHBondContact O-N 2.82Å; I1260-G1262 VanDerWaalsContact C-N 3.26Å; I1260-G1262 PolarHBondContact O-N 3.43Å
1261	N	90.3	Very high	76.2	Confident	23 Å²	23	58 Å²	58	12%	0.123	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-1.3	177.6	-66.4	-67.3	0	0	0	112.6	L1090 N1129 L1257 I1259 I1263	L1090-N1261 HydrophobicContact CD2-CB 4.35Å; N1129-N1261 PolarHBondContact ND2-ND2 2.85Å; N1129-N1261 PolarHBondContact ND2-OD1 3.03Å; N1129-N1261 PolarHBondContact OD1-ND2 2.93Å; L1257-N1261 WeakPolarHBondContact O-CB 3.42Å; L1257-N1261 PolarHBondContact O-N 2.8Å; L1257-N1261 VanDerWaalsContact O-N 3.11Å; L1257-N1261 PolarHBondContact O-ND2 3.06Å; I1259-N1261 VanDerWaalsContact C-N 3.34Å; I1259-N1261 PolarHBondContact O-N 2.93Å; N1261-I1263 VanDerWaalsContact C-N 3.28Å; N1261-I1263 HydrophobicContact CB-CG1 4.04Å; N1261-I1263 PolarHBondContact O-N 2.92Å
1262	G	86.1	Confident	75.5	Confident	26 Å²	26	57.1 Å²	57.1	27%	0.268	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	31.1	177.3	0	0	0	0	0	114	R1048 N1258 I1259 I1260	R1048-G1262 PolarHBondContact NH2-O 3.35Å; N1258-G1262 PolarHBondContact O-N 3.13Å; I1259-G1262 PolarHBondContact O-N 2.93Å; I1259-G1262 VanDerWaalsContact O-N 3.14Å; I1260-G1262 VanDerWaalsContact C-N 3.26Å; I1260-G1262 PolarHBondContact O-N 3.43Å
1263	I	81.8	Confident	74.6	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	29%	0.291	C	S	.	.	S	Bend	trans	-71.3	-47.5	-176.4	-64.3	-63.9	0	0	0	111.4	R1048 Y1051 I1052 L1090 N1258 N1261	R1048-I1263 HydrophobicContact CG-CD1 4.43Å; R1048-I1263 HydrophobicContact CG-CG2 4.45Å; R1048-I1263 PolarHBondContact NE-O 2.85Å; R1048-I1263 PolarHBondContact NH2-O 3.05Å; Y1051-I1263 HydrophobicContact CD1-CG2 3.57Å; Y1051-I1263 HydrophobicContact CE1-CG2 3.82Å; I1052-I1263 WeakPolarHBondContact CD1-O 3.38Å; I1052-I1263 HydrophobicContact CG1-CG2 4.13Å; L1090-I1263 HydrophobicContact CD2-CD1 4.01Å; L1090-I1263 HydrophobicContact CD2-CG1 3.53Å; N1258-I1263 PolarHBondContact O-N 3.42Å; N1261-I1263 VanDerWaalsContact C-N 3.28Å; N1261-I1263 HydrophobicContact CB-CG1 4.04Å; N1261-I1263 PolarHBondContact O-N 2.92Å
1264	I	65.9	Low	73.5	Confident	95 Å²	95	62.8 Å²	62.8	49%	0.487	31%	0.309	S	S	.	.	S	Bend	trans	-80.5	-31.4	-172.9	-62	171.6	0	0	0	112	N1258 I1266	N1258-I1264 HydrophobicContact CB-CD1 3.55Å; N1258-I1264 HydrophobicContact CB-CG1 3.97Å; I1264-I1266 PolarHBondContact O-N 3.18Å
1265	F	59.8	Low	72.3	Confident	129 Å²	129	64.8 Å²	64.8	57%	0.566	32%	0.318	S	S	*	.			trans	-85.1	100.6	173.6	-58.9	-75.3	0	0	0	108.3	R1048 I1259 P1267	R1048-F1265 PolarHBondContact NH2-O 3.08Å; I1259-F1265 HydrophobicContact CG1-CE2 4.29Å; I1259-F1265 HydrophobicContact CG2-CE2 4.5Å; F1265-P1267 WeakPolarHBondContact O-CD 3.49Å
1266	I	51.2	Low	70.9	Confident	42 Å²	42	62.1 Å²	62.1	22%	0.215	31%	0.307	C	S	.	.			trans	-74.8	109.9	164.9	-60	169	0	0	0	105.1	V1009 L1014 I1264 L1268	V1009-I1266 HydrophobicContact CG1-CD1 4.01Å; V1009-I1266 HydrophobicContact CG1-CG2 4.37Å; L1014-I1266 HydrophobicContact CD2-CD1 3.31Å; I1264-I1266 PolarHBondContact O-N 3.18Å; I1266-L1268 PolarHBondContact O-N 3.35Å
1267	P	39.7	Very low	69.3	Low	75 Å²	75	65.7 Å²	65.7	49%	0.487	32%	0.324	S	S	.	.			trans	-62.7	114.7	176.8	25.5	-30.9	0	0	0	107.8	F1265 R1269	F1265-P1267 WeakPolarHBondContact O-CD 3.49Å; P1267-R1269 HydrophobicContact CB-CG 4.49Å; P1267-R1269 PolarHBondContact O-N 2.96Å
1268	L	32	Very low	67.3	Low	143 Å²	143	71.1 Å²	71.1	75%	0.749	35%	0.351	S	S	*	.			trans	-65.2	90.9	156.3	-69.2	159.2	0	0	0	105	Q1010 I1266	Q1010-L1268 WeakPolarHBondContact O-CD2 3.36Å; I1266-L1268 PolarHBondContact O-N 3.35Å
1269	R	26.8	Very low	65	Low	240 Å²	240	76.6 Å²	76.6	91%	0.906	38%	0.378	S	S	*	.			trans	-79.4	0	169.3	-87.7	-167.1	179.9	175.7	2.8	109.7	P1267	P1267-R1269 HydrophobicContact CB-CG 4.49Å; P1267-R1269 PolarHBondContact O-N 2.96Å

Retrieved 1,269 of 1,269 residues in 277.5 ms (Link to these results)

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