A0A077ZAH2_TRITR Loading...

NOGCT and Ank 2 and MMR HSR1 domain containing pr otein

AlphaFold DB , UniProt , Accession A0A077ZAH2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,142 aa.

						>A0A077ZAH2_TRITR|A0A077ZAH2
MISGAQSHALLEGTNNFLFFFHIIVRKFLDLESSIISWLDRGDVKNLEKLVLLGFGDMMLGLIDQARHRASIKFLRQLPSYQAKIDAIHHAVERKDLQTLKQLVKKNKLALARDRFGTTVLQKAVMNNDFNTVVWLLNKFPRVVDVQDNNKRTALHYAAVLSSHQGDKIYQFLLNAGANLQIRDRDGRTPKDYLQNPHLVDHLIHRTDSNKQEQTLPQHFNYLLSLWLREGRVMKLAQLVFSGCGDVLLGRQSSHPASQSFLQEVSFHLEKINKIHEAVKNGDMAATQMLATAKKWAIARNRQGETPLHTAVNNDRLDILKYLLQQFPETVNAKDYQLRTPLHYAAGKGVENECYKYLLETGADENSKDCDGRKPKYYITHAECLRVKLSRSPTAIVHNNSNASSLDSQDSLEISTSSGTGKGNKRQNPVKMLLQDTDRSTATPLLEYKMELARSLPLSPNLRAAFQIVGLPLMETLVNVAIQRPLHPIRYIASMLKERAKMVHYNFKGITVVPSSKQLKEIFLSKTQRKTPTVIHRHYAISRIRQFYSRKVKFMQQSIHDRLSLILDEFPKLDEIHPFYADLMNILYDRDHYKIALGQISIARNLVDNVSKEYTRLMKYGDSLYRCKMLKRAALGRMCKILTRQKDSLTYLEQVRQHLSRLPSIDPNTRTLIICGFPNVGKSSLINKLTRADVEVQPYAFTTKSLYVGHMDYKYLRWQVIDTPGILDQPLEERNTIEMQAITALAHIRAAVLYIMDITLFESIQPLFANKPVLVGLNKCDIRKVEELPPEKQKLLEVFSSSSVPIFSISTVTLEGIMNMRNQACDLLLESRIEEKLNSKTGSSLANRLHVAVPAKVEGLQRPPFIPEAVLRKRSAMVIDEQKEKKLLVIIRRFDTYYSPLKIVFNIQERDIELQLGDDYTLDLKKNYLLREEEKYDKIPEIWEGHNIVDFMDPTNLEKIKALEEEEKLREKAGFYDSDMEVDDEETAELLKQAALIRKRQMLITKESRERRMSSRPRLPRQGRVGERNVDRLRKELADRGLEIGRKRLRHLTESEVSRPSSQKRVRFSSSTDRSRSSSKVPPRDEQGVNEKVKKKVVSMGRKAQKPLQRKARIGESDRRIPCKKPKHLFAGKRGIGKNQRR
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	30.1	Very low	227 Å²	227	126.5 Å²	126.5	100%	1.118	75%	0.748	S	S	*	*				0	32.3	0	-61.8	-166.7	-169.4	0	0	114.2
2	I	28.6	Very low	30.3	Very low	178 Å²	178	126.8 Å²	126.8	91%	0.913	74%	0.736	S	S	*	*			trans	-139.3	87.4	136.6	-56.8	-176.9	0	0	0	103.8
3	S	28.3	Very low	30.6	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	72%	0.724	S	S	*	*			trans	-142.4	117.9	-169.7	45.8	0	0	0	0	108.7
4	G	31.3	Very low	31	Very low	77 Å²	77	119.7 Å²	119.7	79%	0.794	72%	0.716	S	S	*	*	S	Bend	trans	82	86.9	179.5	0	0	0	0	0	114.2
5	A	30.2	Very low	31.3	Very low	94 Å²	94	117.1 Å²	117.1	78%	0.777	70%	0.697	S	S	*	*	S	Bend	trans	-173.9	-43.3	156.3	0	0	0	0	0	112.7
6	Q	29.6	Very low	31.4	Very low	156 Å²	156	115.9 Å²	115.9	73%	0.729	69%	0.686	S	S	*	*	S	Bend	trans	-110.5	4.5	-165.1	-69.5	-178.3	-18.8	0	0	115.6	H8	Q6-H8 VanDerWaalsContact C-N 3.3Å; Q6-H8 PolarHBondContact O-N 3.4Å
7	S	30.2	Very low	31.4	Very low	78 Å²	78	119.2 Å²	119.2	55%	0.545	69%	0.69	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-14.3	-179	44	0	0	0	0	114.7
8	H	30.7	Very low	31.6	Very low	161 Å²	161	119.9 Å²	119.9	75%	0.745	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-35.2	-177.3	-103.4	-92.2	0	0	0	114.4	Q6	Q6-H8 VanDerWaalsContact C-N 3.3Å; Q6-H8 PolarHBondContact O-N 3.4Å
9	A	30.9	Very low	31.6	Very low	74 Å²	74	119.4 Å²	119.4	61%	0.612	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-30.9	-177.4	0	0	0	0	0	113.7	L11	A9-L11 VanDerWaalsContact C-N 3.31Å; A9-L11 PolarHBondContact O-N 3.03Å
10	L	30.2	Very low	31.5	Very low	143 Å²	143	120.2 Å²	120.2	75%	0.749	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-9.3	-176.2	-68.5	169.9	0	0	0	114
11	L	33.3	Very low	31.4	Very low	98 Å²	98	121.2 Å²	121.2	51%	0.513	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-17.8	174.9	-87.4	166.6	0	0	0	113.3	A9 N15	A9-L11 VanDerWaalsContact C-N 3.31Å; A9-L11 PolarHBondContact O-N 3.03Å; L11-N15 WeakPolarHBondContact O-CB 3.34Å; L11-N15 VanDerWaalsContact O-CG 3.3Å; L11-N15 PolarHBondContact O-N 3.15Å; L11-N15 PolarHBondContact O-ND2 3.12Å
12	E	31.6	Very low	31.6	Very low	130 Å²	130	115.8 Å²	115.8	61%	0.607	64%	0.644	S	S	*	*	H	α-helix	trans	-76.9	-39	-171.1	-60	-169.7	141.4	0	0	113	N16	E12-N16 WeakPolarHBondContact O-CB 3.44Å; E12-N16 PolarHBondContact O-N 3.35Å; E12-N16 PolarHBondContact O-ND2 2.88Å
13	G	34.9	Very low	31.7	Very low	56 Å²	56	109.3 Å²	109.3	58%	0.577	61%	0.611	S	S	*	*	H	α-helix	trans	-68	-40	-178.1	0	0	0	0	0	114.6
14	T	36.7	Very low	31.8	Very low	99 Å²	99	108.7 Å²	108.7	61%	0.607	60%	0.598	S	S	*	*	H	α-helix	trans	-84.5	-31.7	179.7	52.5	0	0	0	0	112.5	N16	T14-N16 VanDerWaalsContact C-N 3.34Å
15	N	35.6	Very low	31.9	Very low	81 Å²	81	108.4 Å²	108.4	43%	0.433	58%	0.581	S	S	.	*	H	α-helix	trans	-58.8	-48.3	164.7	-82	-49.7	0	0	0	109.6	L11 F17 L18 F19	L11-N15 WeakPolarHBondContact O-CB 3.34Å; L11-N15 VanDerWaalsContact O-CG 3.3Å; L11-N15 PolarHBondContact O-N 3.15Å; L11-N15 PolarHBondContact O-ND2 3.12Å; N15-F17 PolarHBondContact O-N 2.95Å; N15-L18 PolarHBondContact O-N 3.46Å; N15-L18 VanDerWaalsContact O-N 3.14Å; N15-F19 WeakPolarHBondContact O-CA 3.26Å; N15-F19 WeakPolarHBondContact O-CB 3.2Å; N15-F19 PolarHBondContact O-N 3.06Å
16	N	31.7	Very low	31.9	Very low	98 Å²	98	110.3 Å²	110.3	52%	0.524	57%	0.568	S	S	.	*	H	α-helix	trans	-51.9	-32.8	-173.5	-84.8	-28.7	0	0	0	116	E12 T14 F20	E12-N16 WeakPolarHBondContact O-CB 3.44Å; E12-N16 PolarHBondContact O-N 3.35Å; E12-N16 PolarHBondContact O-ND2 2.88Å; T14-N16 VanDerWaalsContact C-N 3.34Å; N16-F20 VanDerWaalsContact O-CB 3.29Å; N16-F20 WeakPolarHBondContact O-CB 3.4Å; N16-F20 PolarHBondContact O-N 3.07Å
17	F	31.1	Very low	32.1	Very low	171 Å²	171	109.5 Å²	109.5	75%	0.75	56%	0.562	S	S	*	*	H	α-helix	trans	-83	-42.7	177.8	-150	-93.6	0	0	0	113.8	N15 F19 F20 F21	N15-F17 PolarHBondContact O-N 2.95Å; F17-F19 VanDerWaalsContact C-N 3.35Å; F17-F20 WeakPolarHBondContact O-CB 3.5Å; F17-F20 PolarHBondContact O-N 3.14Å; F17-F21 PolarHBondContact O-N 3.19Å
18	L	36	Very low	32.4	Very low	132 Å²	132	112.1 Å²	112.1	69%	0.691	56%	0.564	S	S	*	*	H	α-helix	trans	-67.9	-37.5	172.9	-94.9	161.1	0	0	0	111.3	N15 F21 H22	N15-L18 PolarHBondContact O-N 3.46Å; N15-L18 VanDerWaalsContact O-N 3.14Å; L18-F21 PolarHBondContact O-N 2.97Å; L18-H22 WeakPolarHBondContact O-CA 3.44Å; L18-H22 WeakPolarHBondContact O-CB 3.46Å; L18-H22 PolarHBondContact O-N 2.98Å
19	F	32.3	Very low	33.1	Very low	110 Å²	110	109.5 Å²	109.5	48%	0.482	56%	0.555	S	S	.	*	H	α-helix	trans	-65.1	-36.8	170	-158.4	-111.2	0	0	0	110.2	N15 F17 H22 I23	N15-F19 WeakPolarHBondContact O-CA 3.26Å; N15-F19 WeakPolarHBondContact O-CB 3.2Å; N15-F19 PolarHBondContact O-N 3.06Å; F17-F19 VanDerWaalsContact C-N 3.35Å; F19-H22 CarbonylContact O-C 3.38Å; F19-I23 HydrophobicContact CD1-CD1 3.35Å; F19-I23 HydrophobicContact CD1-CG1 4.19Å; F19-I23 HydrophobicContact CE1-CD1 3.6Å; F19-I23 HydrophobicContact CE1-CG1 4.42Å; F19-I23 HydrophobicContact CG-CD1 4.12Å; F19-I23 WeakPolarHBondContact O-CA 3.32Å; F19-I23 WeakPolarHBondContact O-CB 3.45Å; F19-I23 WeakPolarHBondContact O-CD1 3.41Å; F19-I23 WeakPolarHBondContact O-CG1 3.38Å; F19-I23 PolarHBondContact O-N 3.22Å
20	F	28.8	Very low	34.4	Very low	136 Å²	136	109.3 Å²	109.3	60%	0.596	54%	0.543	S	S	*	.	H	α-helix	trans	-63.8	-47.4	171.3	-125.1	-99	0	0	0	112.7	N16 F17 I23 I24	N16-F20 VanDerWaalsContact O-CB 3.29Å; N16-F20 WeakPolarHBondContact O-CB 3.4Å; N16-F20 PolarHBondContact O-N 3.07Å; F17-F20 WeakPolarHBondContact O-CB 3.5Å; F17-F20 PolarHBondContact O-N 3.14Å; F20-I23 WeakPolarHBondContact O-CB 3.41Å; F20-I23 PolarHBondContact O-N 3.23Å; F20-I24 HydrophobicContact CD1-CD1 4.02Å; F20-I24 WeakPolarHBondContact O-CG1 3.38Å; F20-I24 PolarHBondContact O-N 3.32Å
21	F	29.7	Very low	36.1	Very low	142 Å²	142	104.7 Å²	104.7	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-68	-40.9	179.3	-154.2	-91.7	0	0	0	111.1	F17 L18 I23 I24 V25	F17-F21 PolarHBondContact O-N 3.19Å; L18-F21 PolarHBondContact O-N 2.97Å; F21-I23 VanDerWaalsContact C-N 3.32Å; F21-I23 PolarHBondContact O-N 3.44Å; F21-I24 PolarHBondContact O-N 3.13Å; F21-V25 HydrophobicContact CD1-CG2 4.21Å; F21-V25 HydrophobicContact CE1-CG2 4.15Å; F21-V25 WeakPolarHBondContact O-CG2 3.48Å; F21-V25 PolarHBondContact O-N 3.11Å
22	H	31.9	Very low	37.8	Very low	112 Å²	112	103.5 Å²	103.5	52%	0.519	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-27.4	173.3	-161.1	-39.1	0	0	0	112	L18 F19 R26	L18-H22 WeakPolarHBondContact O-CA 3.44Å; L18-H22 WeakPolarHBondContact O-CB 3.46Å; L18-H22 PolarHBondContact O-N 2.98Å; F19-H22 CarbonylContact O-C 3.38Å; H22-R26 WeakPolarHBondContact O-CA 3.42Å; H22-R26 WeakPolarHBondContact O-CB 3.24Å; H22-R26 WeakPolarHBondContact O-CG 3.5Å; H22-R26 PolarHBondContact O-N 3.09Å
23	I	30	Very low	39.7	Very low	43 Å²	43	100.4 Å²	100.4	22%	0.221	50%	0.504	C	S	.	.	H	α-helix	trans	-72.3	-38.3	170.3	-82.9	165.2	0	0	0	110.7	F19 F20 F21 K27	F19-I23 HydrophobicContact CD1-CD1 3.35Å; F19-I23 HydrophobicContact CD1-CG1 4.19Å; F19-I23 HydrophobicContact CE1-CD1 3.6Å; F19-I23 HydrophobicContact CE1-CG1 4.42Å; F19-I23 HydrophobicContact CG-CD1 4.12Å; F19-I23 WeakPolarHBondContact O-CA 3.32Å; F19-I23 WeakPolarHBondContact O-CB 3.45Å; F19-I23 WeakPolarHBondContact O-CD1 3.41Å; F19-I23 WeakPolarHBondContact O-CG1 3.38Å; F19-I23 PolarHBondContact O-N 3.22Å; F20-I23 WeakPolarHBondContact O-CB 3.41Å; F20-I23 PolarHBondContact O-N 3.23Å; F21-I23 VanDerWaalsContact C-N 3.32Å; F21-I23 PolarHBondContact O-N 3.44Å; I23-K27 HydrophobicContact CG2-CD 3.77Å; I23-K27 HydrophobicContact CG2-CG 4.25Å; I23-K27 WeakPolarHBondContact O-CB 3.41Å; I23-K27 WeakPolarHBondContact O-CG 3.32Å; I23-K27 PolarHBondContact O-N 3.43Å
24	I	30.3	Very low	41.9	Very low	92 Å²	92	99.7 Å²	99.7	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-71.4	-42.7	179	-70.3	164.6	0	0	0	110	F20 F21 K27 F28	F20-I24 HydrophobicContact CD1-CD1 4.02Å; F20-I24 WeakPolarHBondContact O-CG1 3.38Å; F20-I24 PolarHBondContact O-N 3.32Å; F21-I24 PolarHBondContact O-N 3.13Å; I24-K27 PolarHBondContact O-N 3.12Å; I24-F28 PolarHBondContact O-N 3.09Å
25	V	33.6	Very low	44	Very low	70 Å²	70	95.2 Å²	95.2	42%	0.424	46%	0.462	S	S	.	.	H	α-helix	trans	-70.8	-38.2	174.1	178	0	0	0	0	111.6	F21 F28 L29	F21-V25 HydrophobicContact CD1-CG2 4.21Å; F21-V25 HydrophobicContact CE1-CG2 4.15Å; F21-V25 WeakPolarHBondContact O-CG2 3.48Å; F21-V25 PolarHBondContact O-N 3.11Å; V25-F28 PolarHBondContact O-N 3.35Å; V25-L29 HydrophobicContact CG1-CD1 4.06Å; V25-L29 PolarHBondContact O-N 3.16Å; V25-L29 VanDerWaalsContact O-N 3.16Å
26	R	31.3	Very low	46.1	Very low	134 Å²	134	94.8 Å²	94.8	51%	0.506	46%	0.459	S	S	.	.	H	α-helix	trans	-57.8	-57.2	167.7	-102.7	-179.4	152.9	155.9	-6.5	110.1	H22 F28 L29 D30	H22-R26 WeakPolarHBondContact O-CA 3.42Å; H22-R26 WeakPolarHBondContact O-CB 3.24Å; H22-R26 WeakPolarHBondContact O-CG 3.5Å; H22-R26 PolarHBondContact O-N 3.09Å; R26-F28 CarbonylContact O-C 3.58Å; R26-F28 PolarHBondContact O-N 3.2Å; R26-L29 CarbonylContact O-C 3.55Å; R26-L29 WeakPolarHBondContact O-CA 3.36Å; R26-L29 PolarHBondContact O-N 3.13Å; R26-D30 WeakPolarHBondContact CB-OD2 3.31Å; R26-D30 WeakPolarHBondContact O-CA 3.33Å; R26-D30 WeakPolarHBondContact O-CB 3.33Å; R26-D30 PolarHBondContact O-N 3.41Å
27	K	32.5	Very low	48.6	Very low	139 Å²	139	91.9 Å²	91.9	60%	0.604	45%	0.447	S	S	*	.	H	α-helix	trans	-53.4	-28.1	-177.2	-81.8	174.9	176.8	173.8	0	113.6	I23 I24 L31	I23-K27 HydrophobicContact CG2-CD 3.77Å; I23-K27 HydrophobicContact CG2-CG 4.25Å; I23-K27 WeakPolarHBondContact O-CB 3.41Å; I23-K27 WeakPolarHBondContact O-CG 3.32Å; I23-K27 PolarHBondContact O-N 3.43Å; I24-K27 PolarHBondContact O-N 3.12Å; K27-L31 WeakPolarHBondContact O-CB 3.19Å; K27-L31 PolarHBondContact O-N 2.86Å; K27-L31 VanDerWaalsContact O-N 3.15Å
28	F	37.5	Very low	51.2	Low	134 Å²	134	86.3 Å²	86.3	59%	0.588	42%	0.421	S	S	*	.	H	α-helix	trans	-77.5	-45.5	172.1	-117.5	-87.2	0	0	0	113.6	I24 V25 R26 L31 E32	I24-F28 PolarHBondContact O-N 3.09Å; V25-F28 PolarHBondContact O-N 3.35Å; R26-F28 CarbonylContact O-C 3.58Å; R26-F28 PolarHBondContact O-N 3.2Å; F28-L31 WeakPolarHBondContact O-CB 3.33Å; F28-L31 PolarHBondContact O-N 3.04Å; F28-E32 PolarHBondContact O-N 3.42Å; F28-E32 VanDerWaalsContact O-N 3.16Å
29	L	45.2	Very low	53.5	Low	105 Å²	105	80 Å²	80	55%	0.55	39%	0.388	S	S	.	.	H	α-helix	trans	-68.4	-36.8	175	-70.6	165.5	0	0	0	112.7	V25 R26 L31 E32 S33	V25-L29 HydrophobicContact CG1-CD1 4.06Å; V25-L29 PolarHBondContact O-N 3.16Å; V25-L29 VanDerWaalsContact O-N 3.16Å; R26-L29 CarbonylContact O-C 3.55Å; R26-L29 WeakPolarHBondContact O-CA 3.36Å; R26-L29 PolarHBondContact O-N 3.13Å; L29-L31 VanDerWaalsContact C-N 3.27Å; L29-L31 PolarHBondContact O-N 2.95Å; L29-E32 PolarHBondContact O-N 3.49Å; L29-S33 WeakPolarHBondContact O-CB 3.32Å; L29-S33 PolarHBondContact O-N 2.92Å; L29-S33 PolarHBondContact O-OG 3.37Å
30	D	57.9	Low	56	Low	70 Å²	70	77.9 Å²	77.9	37%	0.374	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-31.7	171.5	-63.8	-15.9	0	0	0	110.2	R26 S33 S34	R26-D30 WeakPolarHBondContact CB-OD2 3.31Å; R26-D30 WeakPolarHBondContact O-CA 3.33Å; R26-D30 WeakPolarHBondContact O-CB 3.33Å; R26-D30 PolarHBondContact O-N 3.41Å; D30-S33 VanDerWaalsContact CA-OG 3.26Å; D30-S33 WeakPolarHBondContact CA-OG 3.3Å; D30-S33 PolarHBondContact O-OG 2.97Å; D30-S34 WeakPolarHBondContact O-CA 3.41Å; D30-S34 WeakPolarHBondContact O-CB 3.45Å; D30-S34 PolarHBondContact O-N 2.87Å; D30-S34 PolarHBondContact O-OG 2.93Å
31	L	67.3	Low	58.6	Low	47 Å²	47	80.6 Å²	80.6	25%	0.246	39%	0.388	C	S	.	.	H	α-helix	trans	-72.9	-46.6	174.4	-160.1	78.7	0	0	0	111.6	K27 F28 L29 S34 I35 L50 M58	K27-L31 WeakPolarHBondContact O-CB 3.19Å; K27-L31 PolarHBondContact O-N 2.86Å; K27-L31 VanDerWaalsContact O-N 3.15Å; F28-L31 WeakPolarHBondContact O-CB 3.33Å; F28-L31 PolarHBondContact O-N 3.04Å; L29-L31 VanDerWaalsContact C-N 3.27Å; L29-L31 PolarHBondContact O-N 2.95Å; L31-S34 PolarHBondContact O-N 3.35Å; L31-I35 HydrophobicContact CG-CD1 4.23Å; L31-I35 WeakPolarHBondContact O-CB 3.45Å; L31-I35 WeakPolarHBondContact O-CD1 3.45Å; L31-I35 VanDerWaalsContact O-CG1 3.22Å; L31-I35 WeakPolarHBondContact O-CG1 3.3Å; L31-I35 PolarHBondContact O-N 2.94Å; L31-L50 HydrophobicContact CD1-CD2 4.46Å; L31-M58 HydrophobicContact CD2-CE 4.18Å; L31-M58 HydrophobicContact CD2-SD 4.23Å
32	E	67.4	Low	61.2	Low	73 Å²	73	74.6 Å²	74.6	34%	0.341	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-44.7	175.4	-74.7	-171.7	166.6	0	0	111.2	F28 L29 I35 I36 M58 Y222	F28-E32 PolarHBondContact O-N 3.42Å; F28-E32 VanDerWaalsContact O-N 3.16Å; L29-E32 PolarHBondContact O-N 3.49Å; E32-I35 PolarHBondContact O-N 3.32Å; E32-I36 WeakPolarHBondContact O-CG1 3.41Å; E32-I36 PolarHBondContact O-N 3.05Å; E32-M58 HydrophobicContact CG-CE 4.36Å; E32-Y222 PolarHBondContact OE1-OH 3.17Å
33	S	72.8	Confident	63.9	Low	65 Å²	65	71.4 Å²	71.4	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-69.3	-32.8	175.8	56.8	0	0	0	0	113.4	L29 D30 I36 S37	L29-S33 WeakPolarHBondContact O-CB 3.32Å; L29-S33 PolarHBondContact O-N 2.92Å; L29-S33 PolarHBondContact O-OG 3.37Å; D30-S33 VanDerWaalsContact CA-OG 3.26Å; D30-S33 WeakPolarHBondContact CA-OG 3.3Å; D30-S33 PolarHBondContact O-OG 2.97Å; S33-I36 PolarHBondContact O-N 3.35Å; S33-S37 VanDerWaalsContact O-CB 3.27Å; S33-S37 WeakPolarHBondContact O-CB 3.26Å; S33-S37 PolarHBondContact O-N 2.83Å
34	S	79.7	Confident	66.6	Low	41 Å²	41	71.5 Å²	71.5	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-66.5	-39.7	170.1	-67.3	0	0	0	0	112	D30 L31 S37 W38	D30-S34 WeakPolarHBondContact O-CA 3.41Å; D30-S34 WeakPolarHBondContact O-CB 3.45Å; D30-S34 PolarHBondContact O-N 2.87Å; D30-S34 PolarHBondContact O-OG 2.93Å; L31-S34 PolarHBondContact O-N 3.35Å; S34-S37 WeakPolarHBondContact O-CB 3.38Å; S34-S37 PolarHBondContact O-N 3.27Å; S34-W38 WeakPolarHBondContact O-CB 3.38Å; S34-W38 VanDerWaalsContact O-CD2 3.29Å; S34-W38 PolarHBondContact O-N 3.35Å
35	I	80.5	Confident	69.3	Low	4 Å²	4	75.2 Å²	75.2	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-60.9	-47.6	174.4	-72.2	161.7	0	0	0	109.9	L31 E32 S37 W38 L39 L47 L50 M58 M59 L62	L31-I35 HydrophobicContact CG-CD1 4.23Å; L31-I35 WeakPolarHBondContact O-CB 3.45Å; L31-I35 WeakPolarHBondContact O-CD1 3.45Å; L31-I35 VanDerWaalsContact O-CG1 3.22Å; L31-I35 WeakPolarHBondContact O-CG1 3.3Å; L31-I35 PolarHBondContact O-N 2.94Å; E32-I35 PolarHBondContact O-N 3.32Å; I35-S37 PolarHBondContact O-N 3Å; I35-W38 HydrophobicContact CG1-CE3 4.49Å; I35-W38 PolarHBondContact O-N 3.43Å; I35-L39 HydrophobicContact CG2-CD1 3.93Å; I35-L39 HydrophobicContact CG2-CG 4.31Å; I35-L39 WeakPolarHBondContact O-CB 3.34Å; I35-L39 VanDerWaalsContact O-CG 3.24Å; I35-L39 WeakPolarHBondContact O-CG 3.33Å; I35-L39 PolarHBondContact O-N 2.86Å; I35-L47 HydrophobicContact CG2-CD2 4.44Å; I35-L50 HydrophobicContact CD1-CD1 3.77Å; I35-L50 HydrophobicContact CG1-CD1 3.49Å; I35-L50 VanDerWaalsContact CG1-CD1 3.49Å; I35-M58 HydrophobicContact CD1-CE 4.18Å; I35-M59 HydrophobicContact CG2-CG 4.26Å; I35-L62 HydrophobicContact CG2-CD1 3.86Å
36	I	81	Confident	71.8	Confident	72 Å²	72	74.5 Å²	74.5	37%	0.369	36%	0.361	S	S	.	.	H	α-helix	trans	-60.9	-45.4	176.4	-65.6	164.6	0	0	0	110.5	E32 S33 W38 L39 D40	E32-I36 WeakPolarHBondContact O-CG1 3.41Å; E32-I36 PolarHBondContact O-N 3.05Å; S33-I36 PolarHBondContact O-N 3.35Å; I36-W38 PolarHBondContact O-N 3.35Å; I36-L39 PolarHBondContact O-N 3.37Å; I36-D40 PolarHBondContact O-N 3.04Å
37	S	83.1	Confident	74.5	Confident	38 Å²	38	68.1 Å²	68.1	27%	0.266	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-41.5	174.9	-176.4	0	0	0	0	112.7	S33 S34 I35 R41	S33-S37 VanDerWaalsContact O-CB 3.27Å; S33-S37 WeakPolarHBondContact O-CB 3.26Å; S33-S37 PolarHBondContact O-N 2.83Å; S34-S37 WeakPolarHBondContact O-CB 3.38Å; S34-S37 PolarHBondContact O-N 3.27Å; I35-S37 PolarHBondContact O-N 3Å; S37-R41 VanDerWaalsContact O-CB 3.26Å; S37-R41 WeakPolarHBondContact O-CB 3.48Å; S37-R41 WeakPolarHBondContact O-CG 3.46Å; S37-R41 PolarHBondContact O-N 2.87Å; S37-R41 PolarHBondContact OG-NE 3.08Å; S37-R41 VanDerWaalsContact OG-NE 3.15Å
38	W	85.8	Confident	77.1	Confident	53 Å²	53	63.3 Å²	63.3	20%	0.201	32%	0.317	C	S	.	.	H	α-helix	trans	-71.2	-36.2	175.9	-63.5	-23.1	0	0	0	112.5	S34 I35 I36 G42 D43 N46 L47 L50	S34-W38 WeakPolarHBondContact O-CB 3.38Å; S34-W38 VanDerWaalsContact O-CD2 3.29Å; S34-W38 PolarHBondContact O-N 3.35Å; I35-W38 HydrophobicContact CG1-CE3 4.49Å; I35-W38 PolarHBondContact O-N 3.43Å; I36-W38 PolarHBondContact O-N 3.35Å; W38-G42 PolarHBondContact O-N 2.84Å; W38-D43 HydrophobicContact CB-CB 4.15Å; W38-D43 HydrophobicContact CG-CB 4.37Å; W38-D43 PolarHBondContact O-N 2.84Å; W38-N46 HydrophobicContact CD2-CB 3.71Å; W38-N46 HydrophobicContact CE3-CB 3.8Å; W38-N46 HydrophobicContact CG-CB 4.25Å; W38-N46 HydrophobicContact CH2-CB 4.22Å; W38-N46 HydrophobicContact CZ2-CB 4.14Å; W38-N46 HydrophobicContact CZ3-CB 4.05Å; W38-L47 HydrophobicContact CB-CD2 4.05Å; W38-L47 HydrophobicContact CB-CG 4.18Å; W38-L47 HydrophobicContact CE3-CD2 4.41Å; W38-L50 HydrophobicContact CE3-CD1 4.17Å; W38-L50 HydrophobicContact CZ3-CD1 3.69Å; W38-L50 HydrophobicContact CZ3-CG 4.08Å
39	L	86	Confident	79.4	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-41.2	174.1	-73.9	173.9	0	0	0	111.6	I35 I36 L47 L62 A66 H68 S71 L75	I35-L39 HydrophobicContact CG2-CD1 3.93Å; I35-L39 HydrophobicContact CG2-CG 4.31Å; I35-L39 WeakPolarHBondContact O-CB 3.34Å; I35-L39 VanDerWaalsContact O-CG 3.24Å; I35-L39 WeakPolarHBondContact O-CG 3.33Å; I35-L39 PolarHBondContact O-N 2.86Å; I36-L39 PolarHBondContact O-N 3.37Å; L39-L47 HydrophobicContact CD2-CD1 3.75Å; L39-L47 HydrophobicContact CD2-CD2 4.13Å; L39-L47 HydrophobicContact CG-CD1 4.44Å; L39-L47 HydrophobicContact CG-CD2 4.24Å; L39-L62 HydrophobicContact CD1-CB 4Å; L39-L62 HydrophobicContact CD1-CD1 3.96Å; L39-A66 HydrophobicContact CB-CB 4.09Å; L39-A66 HydrophobicContact CD1-CB 4.46Å; L39-A66 HydrophobicContact CD2-CB 4.03Å; L39-A66 HydrophobicContact CG-CB 4.42Å; L39-H68 WeakPolarHBondContact O-CB 3.2Å; L39-S71 WeakPolarHBondContact O-CB 3.4Å; L39-S71 PolarHBondContact O-OG 3.5Å; L39-L75 HydrophobicContact CD2-CD1 3.77Å; L39-L75 HydrophobicContact CD2-CD2 4.24Å; L39-L75 HydrophobicContact CD2-CG 4.1Å
40	D	83.1	Confident	81.3	Confident	65 Å²	65	58.7 Å²	58.7	35%	0.348	29%	0.293	S	S	.	.	H	α-helix	trans	-74	-40.4	176.3	-83.8	-18.4	0	0	0	113	I36 G42 R67	I36-D40 PolarHBondContact O-N 3.04Å; D40-G42 VanDerWaalsContact C-N 3.28Å; D40-G42 PolarHBondContact O-N 3.24Å; D40-R67 WeakPolarHBondContact OD1-CB 3.42Å; D40-R67 WeakPolarHBondContact OD1-CD 3.46Å; D40-R67 WeakPolarHBondContact OD1-CG 3.43Å
41	R	83.9	Confident	82.6	Confident	193 Å²	193	55.5 Å²	55.5	73%	0.728	28%	0.276	S	S	*	.	H	α-helix	trans	-71.6	-18.7	175.9	-70.7	173.3	-167.5	-151.7	0.2	113.9	S37	S37-R41 VanDerWaalsContact O-CB 3.26Å; S37-R41 WeakPolarHBondContact O-CB 3.48Å; S37-R41 WeakPolarHBondContact O-CG 3.46Å; S37-R41 PolarHBondContact O-N 2.87Å; S37-R41 PolarHBondContact OG-NE 3.08Å; S37-R41 VanDerWaalsContact OG-NE 3.15Å
42	G	84.5	Confident	83.4	Confident	15 Å²	15	54.4 Å²	54.4	16%	0.155	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	19.6	-175.9	0	0	0	0	0	115.5	W38 D40 V44 H68 S71	W38-G42 PolarHBondContact O-N 2.84Å; D40-G42 VanDerWaalsContact C-N 3.28Å; D40-G42 PolarHBondContact O-N 3.24Å; G42-V44 VanDerWaalsContact C-N 3.3Å; G42-V44 PolarHBondContact O-N 2.94Å; G42-H68 WeakPolarHBondContact CA-ND1 3.38Å; G42-S71 WeakPolarHBondContact CA-OG 3.49Å
43	D	87.8	Confident	84	Confident	46 Å²	46	53.6 Å²	53.6	25%	0.246	27%	0.268	C	S	.	.			trans	-79.9	74.4	-173.5	-169.8	-5.6	0	0	0	112.7	W38 K45 N46 L47	W38-D43 HydrophobicContact CB-CB 4.15Å; W38-D43 HydrophobicContact CG-CB 4.37Å; W38-D43 PolarHBondContact O-N 2.84Å; D43-K45 PolarHBondContact O-N 3.43Å; D43-K45 VanDerWaalsContact O-N 3.14Å; D43-K45 WeakPolarHBondContact OD1-CB 3.34Å; D43-K45 PolarHBondContact OD1-N 2.97Å; D43-K45 VanDerWaalsContact OD1-N 3.17Å; D43-N46 PolarHBondContact O-N 2.95Å; D43-N46 PolarHBondContact OD1-N 3.44Å; D43-N46 PolarHBondContact OD2-ND2 3.37Å; D43-L47 VanDerWaalsContact O-CG 3.32Å; D43-L47 WeakPolarHBondContact O-CG 3.3Å; D43-L47 PolarHBondContact O-N 3.46Å
44	V	87.3	Confident	84	Confident	44 Å²	44	51.5 Å²	51.5	27%	0.267	26%	0.256	S	S	.	.	H	α-helix	trans	-60.3	-21.2	177.1	-178.4	0	0	0	0	112.4	G42 E48 A70 F74	G42-V44 VanDerWaalsContact C-N 3.3Å; G42-V44 PolarHBondContact O-N 2.94Å; V44-E48 WeakPolarHBondContact O-CB 3.42Å; V44-E48 PolarHBondContact O-N 3.21Å; V44-A70 HydrophobicContact CG2-CB 3.88Å; V44-F74 HydrophobicContact CG1-CB 4.11Å; V44-F74 HydrophobicContact CG1-CD2 3.6Å; V44-F74 HydrophobicContact CG1-CE2 4.17Å; V44-F74 HydrophobicContact CG1-CG 3.87Å; V44-F74 HydrophobicContact CG2-CB 4.28Å
45	K	87.8	Confident	83.8	Confident	171 Å²	171	53.2 Å²	53.2	74%	0.743	26%	0.259	S	S	*	.	H	α-helix	trans	-71.9	-46.6	-179.9	-66.2	177.7	-178.1	172	0	111.4	D43 E48 K49	D43-K45 PolarHBondContact O-N 3.43Å; D43-K45 VanDerWaalsContact O-N 3.14Å; D43-K45 WeakPolarHBondContact OD1-CB 3.34Å; D43-K45 PolarHBondContact OD1-N 2.97Å; D43-K45 VanDerWaalsContact OD1-N 3.17Å; K45-E48 PolarHBondContact O-N 2.96Å; K45-K49 WeakPolarHBondContact O-CB 3.45Å; K45-K49 PolarHBondContact O-N 3.39Å
46	N	86	Confident	83.4	Confident	54 Å²	54	53 Å²	53	29%	0.289	26%	0.258	S	S	.	.	H	α-helix	trans	-70.9	-35.4	177.5	-80.5	-37.2	0	0	0	111.8	W38 D43 K49 L50	W38-N46 HydrophobicContact CD2-CB 3.71Å; W38-N46 HydrophobicContact CE3-CB 3.8Å; W38-N46 HydrophobicContact CG-CB 4.25Å; W38-N46 HydrophobicContact CH2-CB 4.22Å; W38-N46 HydrophobicContact CZ2-CB 4.14Å; W38-N46 HydrophobicContact CZ3-CB 4.05Å; D43-N46 PolarHBondContact O-N 2.95Å; D43-N46 PolarHBondContact OD1-N 3.44Å; D43-N46 PolarHBondContact OD2-ND2 3.37Å; N46-K49 WeakPolarHBondContact O-CB 3.26Å; N46-K49 PolarHBondContact O-N 3.28Å; N46-L50 PolarHBondContact O-N 3.38Å
47	L	86.9	Confident	83	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-45.5	171.7	-60.1	167.4	0	0	0	111.9	I35 W38 L39 D43 K49 L50 V51 M59 F74	I35-L47 HydrophobicContact CG2-CD2 4.44Å; W38-L47 HydrophobicContact CB-CD2 4.05Å; W38-L47 HydrophobicContact CB-CG 4.18Å; W38-L47 HydrophobicContact CE3-CD2 4.41Å; L39-L47 HydrophobicContact CD2-CD1 3.75Å; L39-L47 HydrophobicContact CD2-CD2 4.13Å; L39-L47 HydrophobicContact CG-CD1 4.44Å; L39-L47 HydrophobicContact CG-CD2 4.24Å; D43-L47 VanDerWaalsContact O-CG 3.32Å; D43-L47 WeakPolarHBondContact O-CG 3.3Å; D43-L47 PolarHBondContact O-N 3.46Å; L47-K49 VanDerWaalsContact C-N 3.3Å; L47-K49 PolarHBondContact O-N 2.87Å; L47-L50 PolarHBondContact O-N 2.93Å; L47-V51 WeakPolarHBondContact O-CG2 3.48Å; L47-V51 PolarHBondContact O-N 2.94Å; L47-V51 VanDerWaalsContact O-N 3.15Å; L47-M59 HydrophobicContact CB-SD 4.13Å; L47-M59 HydrophobicContact CD2-SD 3.63Å; L47-M59 HydrophobicContact CG-SD 4.45Å; L47-F74 HydrophobicContact CB-CD1 4.08Å; L47-F74 HydrophobicContact CB-CE1 3.7Å; L47-F74 HydrophobicContact CB-CZ 4.42Å
48	E	88.2	Confident	82.4	Confident	38 Å²	38	51.8 Å²	51.8	18%	0.178	25%	0.248	C	C	.	.	H	α-helix	trans	-61.4	-37.2	174.1	-170.7	-171	-174.7	0	0	111.8	V44 K45 V51 L52 F74 Y81 K108	V44-E48 WeakPolarHBondContact O-CB 3.42Å; V44-E48 PolarHBondContact O-N 3.21Å; K45-E48 PolarHBondContact O-N 2.96Å; E48-V51 PolarHBondContact O-N 3.41Å; E48-L52 HydrophobicContact CG-CD1 4.42Å; E48-L52 WeakPolarHBondContact O-CG 3.49Å; E48-L52 PolarHBondContact O-N 3.49Å; E48-F74 HydrophobicContact CB-CE2 4.17Å; E48-F74 HydrophobicContact CB-CZ 4.17Å; E48-Y81 PolarHBondContact OE1-OH 2.92Å; E48-K108 VanDerWaalsContact OE1-CD 3.27Å; E48-K108 WeakPolarHBondContact OE1-CD 3.31Å; E48-K108 IonicContact OE1-NZ 3.41Å; E48-K108 PolarHBondContact OE1-NZ 3.46Å; E48-K108 IonicContact OE2-NZ 3.64Å; E48-K108 PolarHBondContact OE2-NZ 3.31Å
49	K	85.6	Confident	81.9	Confident	130 Å²	130	49.3 Å²	49.3	57%	0.565	24%	0.239	S	C	*	.	H	α-helix	trans	-63.4	-41.3	175.3	-169.7	-178.9	178.9	-174	0	112	K45 N46 L47 L52 L53	K45-K49 WeakPolarHBondContact O-CB 3.45Å; K45-K49 PolarHBondContact O-N 3.39Å; N46-K49 WeakPolarHBondContact O-CB 3.26Å; N46-K49 PolarHBondContact O-N 3.28Å; L47-K49 VanDerWaalsContact C-N 3.3Å; L47-K49 PolarHBondContact O-N 2.87Å; K49-L52 PolarHBondContact O-N 3.02Å; K49-L53 HydrophobicContact CG-CD1 4.34Å; K49-L53 VanDerWaalsContact O-CG 3.31Å; K49-L53 WeakPolarHBondContact O-CG 3.42Å; K49-L53 PolarHBondContact O-N 3.48Å; K49-L53 VanDerWaalsContact O-N 3.09Å
50	L	84.2	Confident	81.2	Confident	12 Å²	12	53.5 Å²	53.5	6%	0.063	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-42.3	173.4	-81.6	179.3	0	0	0	112.6	L31 I35 W38 N46 L47 L52 L53 G54 F55 M59	L31-L50 HydrophobicContact CD1-CD2 4.46Å; I35-L50 HydrophobicContact CD1-CD1 3.77Å; I35-L50 HydrophobicContact CG1-CD1 3.49Å; I35-L50 VanDerWaalsContact CG1-CD1 3.49Å; W38-L50 HydrophobicContact CE3-CD1 4.17Å; W38-L50 HydrophobicContact CZ3-CD1 3.69Å; W38-L50 HydrophobicContact CZ3-CG 4.08Å; N46-L50 PolarHBondContact O-N 3.38Å; L47-L50 PolarHBondContact O-N 2.93Å; L50-L52 VanDerWaalsContact C-N 3.35Å; L50-L52 PolarHBondContact O-N 3.04Å; L50-L53 PolarHBondContact O-N 3.22Å; L50-G54 PolarHBondContact O-N 3.47Å; L50-F55 HydrophobicContact CD2-CB 4.3Å; L50-F55 HydrophobicContact CD2-CD2 4.17Å; L50-F55 PolarHBondContact O-N 3.22Å; L50-M59 HydrophobicContact CB-CE 3.79Å; L50-M59 HydrophobicContact CD1-CE 4.36Å
51	V	85.4	Confident	80.8	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.018	27%	0.272	C	S	.	.	I	π-helix	trans	-61.4	-44.5	176.8	-178	0	0	0	0	111.1	L47 E48 L53 G54 M59 F74 L78 Y81 I85	L47-V51 WeakPolarHBondContact O-CG2 3.48Å; L47-V51 PolarHBondContact O-N 2.94Å; L47-V51 VanDerWaalsContact O-N 3.15Å; E48-V51 PolarHBondContact O-N 3.41Å; V51-L53 PolarHBondContact O-N 3.17Å; V51-G54 PolarHBondContact O-N 2.92Å; V51-G54 VanDerWaalsContact O-N 3.09Å; V51-M59 HydrophobicContact CG2-CE 3.6Å; V51-F74 HydrophobicContact CG2-CE1 4.21Å; V51-F74 HydrophobicContact CG2-CZ 3.87Å; V51-L78 HydrophobicContact CG2-CD1 3.47Å; V51-L78 VanDerWaalsContact CG2-CD1 3.47Å; V51-L78 HydrophobicContact CG2-CG 4.39Å; V51-Y81 HydrophobicContact CG1-CD1 3.73Å; V51-Y81 HydrophobicContact CG1-CE1 4.05Å; V51-I85 HydrophobicContact CG1-CD1 3.91Å
52	L	85.1	Confident	80.5	Confident	24 Å²	24	45.5 Å²	45.5	13%	0.126	25%	0.246	C	C	.	.	I	π-helix	trans	-66.3	-24.9	178.4	-67.9	173	0	0	0	113.4	E48 K49 L50 G54 Y81 I85 K108 A112 R113	E48-L52 HydrophobicContact CG-CD1 4.42Å; E48-L52 WeakPolarHBondContact O-CG 3.49Å; E48-L52 PolarHBondContact O-N 3.49Å; K49-L52 PolarHBondContact O-N 3.02Å; L50-L52 VanDerWaalsContact C-N 3.35Å; L50-L52 PolarHBondContact O-N 3.04Å; L52-G54 VanDerWaalsContact C-N 3.26Å; L52-G54 PolarHBondContact O-N 2.86Å; L52-Y81 HydrophobicContact CD2-CE1 4.11Å; L52-I85 HydrophobicContact CD2-CD1 4.45Å; L52-K108 HydrophobicContact CD1-CB 3.99Å; L52-K108 HydrophobicContact CD1-CD 4.2Å; L52-K108 HydrophobicContact CD1-CG 4.33Å; L52-K108 WeakPolarHBondContact CD2-O 3.38Å; L52-A112 HydrophobicContact CD2-CB 3.96Å; L52-A112 WeakPolarHBondContact O-CA 3.48Å; L52-R113 PolarHBondContact O-N 3.2Å
53	L	78.7	Confident	80.2	Confident	57 Å²	57	48 Å²	48	30%	0.298	26%	0.255	S	S	.	.	I	π-helix	trans	-79.2	-2.8	174.1	-72.8	168.3	0	0	0	113.8	K49 L50 V51 F55	K49-L53 HydrophobicContact CG-CD1 4.34Å; K49-L53 VanDerWaalsContact O-CG 3.31Å; K49-L53 WeakPolarHBondContact O-CG 3.42Å; K49-L53 PolarHBondContact O-N 3.48Å; K49-L53 VanDerWaalsContact O-N 3.09Å; L50-L53 PolarHBondContact O-N 3.22Å; V51-L53 PolarHBondContact O-N 3.17Å; L53-F55 HydrophobicContact CB-CD2 3.73Å; L53-F55 HydrophobicContact CB-CE2 3.99Å
54	G	73.3	Confident	79.7	Confident	20 Å²	20	53.3 Å²	53.3	21%	0.206	28%	0.284	C	S	.	.	I	π-helix	trans	94.7	-0.6	-178.4	0	0	0	0	0	114.6	L50 V51 L52 G56	L50-G54 PolarHBondContact O-N 3.47Å; V51-G54 PolarHBondContact O-N 2.92Å; V51-G54 VanDerWaalsContact O-N 3.09Å; L52-G54 VanDerWaalsContact C-N 3.26Å; L52-G54 PolarHBondContact O-N 2.86Å; G54-G56 VanDerWaalsContact C-N 3.3Å; G54-G56 PolarHBondContact O-N 3.42Å
55	F	75.3	Confident	79	Confident	77 Å²	77	56.3 Å²	56.3	34%	0.338	29%	0.294	S	S	.	.	I	π-helix	trans	-91	22.6	-178.4	-58.1	-69	0	0	0	113.8	L50 L53 D57 M58	L50-F55 HydrophobicContact CD2-CB 4.3Å; L50-F55 HydrophobicContact CD2-CD2 4.17Å; L50-F55 PolarHBondContact O-N 3.22Å; L53-F55 HydrophobicContact CB-CD2 3.73Å; L53-F55 HydrophobicContact CB-CE2 3.99Å; F55-D57 VanDerWaalsContact C-N 3.26Å; F55-D57 PolarHBondContact O-N 3.46Å; F55-M58 HydrophobicContact CB-SD 4.17Å; F55-M58 HydrophobicContact CD1-SD 4.17Å; F55-M58 HydrophobicContact CG-SD 4.48Å; F55-M58 PolarHBondContact O-N 3.13Å
56	G	72.3	Confident	78.5	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.01	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-57.3	-38.2	178.7	0	0	0	0	0	113.2	G54 M58 M59	G54-G56 VanDerWaalsContact C-N 3.3Å; G54-G56 PolarHBondContact O-N 3.42Å; G56-M58 PolarHBondContact O-N 3.31Å; G56-M59 PolarHBondContact O-N 3.06Å
57	D	72.1	Confident	78.1	Confident	45 Å²	45	55.9 Å²	55.9	24%	0.241	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-58.1	-31.5	-178.6	-70.3	-18.1	0	0	0	114	F55 M59 L60 Q82 H219	F55-D57 VanDerWaalsContact C-N 3.26Å; F55-D57 PolarHBondContact O-N 3.46Å; D57-M59 PolarHBondContact O-N 2.91Å; D57-L60 WeakPolarHBondContact O-CB 3.49Å; D57-L60 PolarHBondContact O-N 3.43Å; D57-Q82 PolarHBondContact OD1-NE2 3.22Å; D57-H219 WeakPolarHBondContact CB-ND1 3.29Å
58	M	71.2	Confident	78.1	Confident	38 Å²	38	59.7 Å²	59.7	19%	0.187	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-64.5	-22.1	179.9	-66.5	-176.7	74.2	0	0	113	L31 E32 I35 F55 G56 L62	L31-M58 HydrophobicContact CD2-CE 4.18Å; L31-M58 HydrophobicContact CD2-SD 4.23Å; E32-M58 HydrophobicContact CG-CE 4.36Å; I35-M58 HydrophobicContact CD1-CE 4.18Å; F55-M58 HydrophobicContact CB-SD 4.17Å; F55-M58 HydrophobicContact CD1-SD 4.17Å; F55-M58 HydrophobicContact CG-SD 4.48Å; F55-M58 PolarHBondContact O-N 3.13Å; G56-M58 PolarHBondContact O-N 3.31Å; M58-L62 WeakPolarHBondContact O-CD1 3.44Å
59	M	75.2	Confident	78	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.01	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-94.8	-8.2	180	-74.5	175.8	-83.3	0	0	113.4	I35 L47 L50 V51 G56 D57 G61 L62 L75 L78	I35-M59 HydrophobicContact CG2-CG 4.26Å; L47-M59 HydrophobicContact CB-SD 4.13Å; L47-M59 HydrophobicContact CD2-SD 3.63Å; L47-M59 HydrophobicContact CG-SD 4.45Å; L50-M59 HydrophobicContact CB-CE 3.79Å; L50-M59 HydrophobicContact CD1-CE 4.36Å; V51-M59 HydrophobicContact CG2-CE 3.6Å; G56-M59 PolarHBondContact O-N 3.06Å; D57-M59 PolarHBondContact O-N 2.91Å; M59-G61 PolarHBondContact O-N 3.12Å; M59-L62 HydrophobicContact CG-CD1 4.47Å; M59-L62 PolarHBondContact O-N 3.34Å; M59-L75 HydrophobicContact CB-CD2 3.8Å; M59-L75 HydrophobicContact CG-CD2 4.38Å; M59-L78 HydrophobicContact CB-CD1 4.18Å; M59-L78 HydrophobicContact CB-CD2 4.25Å; M59-L78 HydrophobicContact CE-CD1 4.24Å; M59-L78 HydrophobicContact SD-CD1 4.3Å
60	L	71.8	Confident	78.2	Confident	89 Å²	89	63.9 Å²	63.9	47%	0.466	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	112.6	178.1	-69.5	173.7	0	0	0	110.4	D57 L78 P79	D57-L60 WeakPolarHBondContact O-CB 3.49Å; D57-L60 PolarHBondContact O-N 3.43Å; L60-L78 HydrophobicContact CD2-CD2 3.61Å; L60-L78 HydrophobicContact CG-CD2 4.02Å; L60-P79 HydrophobicContact CD2-CG 4.1Å
61	G	74.2	Confident	78.4	Confident	57 Å²	57	63.3 Å²	63.3	59%	0.588	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.6	-9.5	-178.4	0	0	0	0	0	115	M59 I63	M59-G61 PolarHBondContact O-N 3.12Å; G61-I63 PolarHBondContact O-N 2.92Å; G61-I63 VanDerWaalsContact O-N 3.08Å
62	L	78.7	Confident	78.4	Confident	33 Å²	33	65.4 Å²	65.4	17%	0.173	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-76.2	11.6	177	-56.2	-173.5	0	0	0	114.1	I35 L39 M58 M59 D64 Q65 A66 L75	I35-L62 HydrophobicContact CG2-CD1 3.86Å; L39-L62 HydrophobicContact CD1-CB 4Å; L39-L62 HydrophobicContact CD1-CD1 3.96Å; M58-L62 WeakPolarHBondContact O-CD1 3.44Å; M59-L62 HydrophobicContact CG-CD1 4.47Å; M59-L62 PolarHBondContact O-N 3.34Å; L62-D64 PolarHBondContact O-N 3.31Å; L62-Q65 PolarHBondContact O-N 3.2Å; L62-Q65 VanDerWaalsContact O-N 3.15Å; L62-A66 PolarHBondContact O-N 2.83Å; L62-L75 HydrophobicContact CB-CD1 4.45Å
63	I	77.3	Confident	78.6	Confident	66 Å²	66	70.8 Å²	70.8	34%	0.338	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-58.7	-37.2	-179.7	-64.7	172.5	0	0	0	111	G61 Q65 L75	G61-I63 PolarHBondContact O-N 2.92Å; G61-I63 VanDerWaalsContact O-N 3.08Å; I63-Q65 VanDerWaalsContact C-N 3.32Å; I63-L75 HydrophobicContact CG1-CB 3.93Å; I63-L75 HydrophobicContact CG1-CD1 4.3Å
64	D	76.2	Confident	79.2	Confident	159 Å²	159	69 Å²	69	85%	0.85	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-78.8	-15.6	-177.1	-57.5	-26.4	0	0	0	113.1	L62	L62-D64 PolarHBondContact O-N 3.31Å
65	Q	74.6	Confident	79.8	Confident	106 Å²	106	68.4 Å²	68.4	50%	0.495	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-25.3	178.3	-64.4	-174.2	0.3	0	0	112.8	L62 I63 R67	L62-Q65 PolarHBondContact O-N 3.2Å; L62-Q65 VanDerWaalsContact O-N 3.15Å; I63-Q65 VanDerWaalsContact C-N 3.32Å; Q65-R67 PolarHBondContact O-N 3.16Å
66	A	76.5	Confident	80.4	Confident	7 Å²	7	73.6 Å²	73.6	6%	0.058	35%	0.351	C	S	.	.			trans	-79.8	116.1	-174	0	0	0	0	0	112.5	L39 L62 I72 L75	L39-A66 HydrophobicContact CB-CB 4.09Å; L39-A66 HydrophobicContact CD1-CB 4.46Å; L39-A66 HydrophobicContact CD2-CB 4.03Å; L39-A66 HydrophobicContact CG-CB 4.42Å; L62-A66 PolarHBondContact O-N 2.83Å; A66-I72 HydrophobicContact CB-CG1 4.18Å; A66-I72 WeakPolarHBondContact O-CD1 3.36Å; A66-I72 VanDerWaalsContact O-CG1 3.3Å; A66-I72 WeakPolarHBondContact O-CG1 3.35Å; A66-L75 HydrophobicContact CB-CD1 3.86Å
67	R	77.3	Confident	81.1	Confident	210 Å²	210	78.6 Å²	78.6	79%	0.792	37%	0.374	S	S	*	.			trans	-81.5	-31.3	178.1	-62.8	175.8	179.5	-177.8	0.9	113.8	D40 Q65	D40-R67 WeakPolarHBondContact OD1-CB 3.42Å; D40-R67 WeakPolarHBondContact OD1-CD 3.46Å; D40-R67 WeakPolarHBondContact OD1-CG 3.43Å; Q65-R67 PolarHBondContact O-N 3.16Å
68	H	87.1	Confident	81.8	Confident	80 Å²	80	76.5 Å²	76.5	37%	0.37	36%	0.363	S	S	.	.	S	Bend	trans	-82.3	132.7	-171.2	-170.9	-101.9	0	0	0	113.6	L39 G42 A70 S71 I72	L39-H68 WeakPolarHBondContact O-CB 3.2Å; G42-H68 WeakPolarHBondContact CA-ND1 3.38Å; H68-A70 VanDerWaalsContact C-N 3.28Å; H68-A70 VanDerWaalsContact CE1-CB 3.49Å; H68-A70 WeakPolarHBondContact CE1-CB 3.24Å; H68-A70 WeakPolarHBondContact ND1-CB 3.47Å; H68-A70 PolarHBondContact ND1-N 2.62Å; H68-A70 PolarHBondContact O-N 3.43Å; H68-S71 WeakPolarHBondContact O-CB 3.3Å; H68-S71 PolarHBondContact O-N 2.98Å; H68-I72 PolarHBondContact O-N 3.45Å
69	R	87	Confident	82.5	Confident	217 Å²	217	78 Å²	78	82%	0.819	38%	0.376	S	S	*	.	H	α-helix	trans	-56.3	-36	-176.4	178.9	175.7	171.5	170.5	-3.2	113.9	K73	R69-K73 WeakPolarHBondContact O-CB 3.22Å; R69-K73 PolarHBondContact O-N 3.45Å; R69-K73 VanDerWaalsContact O-N 3.09Å
70	A	88.3	Confident	83.1	Confident	39 Å²	39	80.9 Å²	80.9	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-69.8	-39.9	177.6	0	0	0	0	0	111.8	V44 H68 K73 F74	V44-A70 HydrophobicContact CG2-CB 3.88Å; H68-A70 VanDerWaalsContact C-N 3.28Å; H68-A70 VanDerWaalsContact CE1-CB 3.49Å; H68-A70 WeakPolarHBondContact CE1-CB 3.24Å; H68-A70 WeakPolarHBondContact ND1-CB 3.47Å; H68-A70 PolarHBondContact ND1-N 2.62Å; H68-A70 PolarHBondContact O-N 3.43Å; A70-K73 PolarHBondContact O-N 2.93Å; A70-F74 WeakPolarHBondContact O-CB 3.26Å; A70-F74 PolarHBondContact O-N 3.07Å
71	S	88.4	Confident	83.8	Confident	0 Å²	0	79 Å²	79	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-47.8	176.1	-49	0	0	0	0	110.9	L39 G42 H68 K73 F74 L75	L39-S71 WeakPolarHBondContact O-CB 3.4Å; L39-S71 PolarHBondContact O-OG 3.5Å; G42-S71 WeakPolarHBondContact CA-OG 3.49Å; H68-S71 WeakPolarHBondContact O-CB 3.3Å; H68-S71 PolarHBondContact O-N 2.98Å; S71-K73 VanDerWaalsContact C-N 3.32Å; S71-K73 PolarHBondContact O-N 3.29Å; S71-F74 PolarHBondContact O-N 3.42Å; S71-F74 VanDerWaalsContact O-N 3.14Å; S71-L75 WeakPolarHBondContact O-CG 3.42Å; S71-L75 PolarHBondContact O-N 3.46Å
72	I	86.9	Confident	84.2	Confident	47 Å²	47	77.5 Å²	77.5	24%	0.241	36%	0.361	C	S	.	.	H	α-helix	trans	-60.4	-41.4	176.6	-60.5	162.1	0	0	0	111.2	A66 H68 R76	A66-I72 HydrophobicContact CB-CG1 4.18Å; A66-I72 WeakPolarHBondContact O-CD1 3.36Å; A66-I72 VanDerWaalsContact O-CG1 3.3Å; A66-I72 WeakPolarHBondContact O-CG1 3.35Å; H68-I72 PolarHBondContact O-N 3.45Å; I72-R76 WeakPolarHBondContact O-CB 3.41Å; I72-R76 WeakPolarHBondContact O-CG 3.4Å; I72-R76 PolarHBondContact O-N 3.24Å
73	K	89	Confident	84.6	Confident	137 Å²	137	78.6 Å²	78.6	60%	0.596	38%	0.375	S	S	*	.	H	α-helix	trans	-64.9	-39.1	176.4	-172.6	-179.2	178	-174.4	0	111.9	R69 A70 S71 Q77	R69-K73 WeakPolarHBondContact O-CB 3.22Å; R69-K73 PolarHBondContact O-N 3.45Å; R69-K73 VanDerWaalsContact O-N 3.09Å; A70-K73 PolarHBondContact O-N 2.93Å; S71-K73 VanDerWaalsContact C-N 3.32Å; S71-K73 PolarHBondContact O-N 3.29Å; K73-Q77 WeakPolarHBondContact O-CG 3.37Å; K73-Q77 PolarHBondContact O-N 3.39Å
74	F	89.9	Confident	85.1	Confident	20 Å²	20	80.9 Å²	80.9	9%	0.088	38%	0.383	C	S	.	.	H	α-helix	trans	-67.4	-50	176.1	178.9	-103.9	0	0	0	111.7	V44 L47 E48 V51 A70 S71 R76 Q77 L78	V44-F74 HydrophobicContact CG1-CB 4.11Å; V44-F74 HydrophobicContact CG1-CD2 3.6Å; V44-F74 HydrophobicContact CG1-CE2 4.17Å; V44-F74 HydrophobicContact CG1-CG 3.87Å; V44-F74 HydrophobicContact CG2-CB 4.28Å; L47-F74 HydrophobicContact CB-CD1 4.08Å; L47-F74 HydrophobicContact CB-CE1 3.7Å; L47-F74 HydrophobicContact CB-CZ 4.42Å; E48-F74 HydrophobicContact CB-CE2 4.17Å; E48-F74 HydrophobicContact CB-CZ 4.17Å; V51-F74 HydrophobicContact CG2-CE1 4.21Å; V51-F74 HydrophobicContact CG2-CZ 3.87Å; A70-F74 WeakPolarHBondContact O-CB 3.26Å; A70-F74 PolarHBondContact O-N 3.07Å; S71-F74 PolarHBondContact O-N 3.42Å; S71-F74 VanDerWaalsContact O-N 3.14Å; F74-R76 VanDerWaalsContact C-N 3.29Å; F74-R76 PolarHBondContact O-N 2.89Å; F74-Q77 CarbonylContact O-C 3.56Å; F74-Q77 WeakPolarHBondContact O-CA 3.49Å; F74-Q77 PolarHBondContact O-N 3Å; F74-L78 HydrophobicContact CD1-CD1 4.28Å; F74-L78 HydrophobicContact CE1-CD1 3.6Å; F74-L78 HydrophobicContact CZ-CD1 4.08Å; F74-L78 PolarHBondContact O-N 3.23Å
75	L	87.3	Confident	85.6	Confident	6 Å²	6	73.6 Å²	73.6	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-58.7	-36.8	177.8	-69.8	179.9	0	0	0	112.8	L39 M59 L62 I63 A66 S71 Q77 L78	L39-L75 HydrophobicContact CD2-CD1 3.77Å; L39-L75 HydrophobicContact CD2-CD2 4.24Å; L39-L75 HydrophobicContact CD2-CG 4.1Å; M59-L75 HydrophobicContact CB-CD2 3.8Å; M59-L75 HydrophobicContact CG-CD2 4.38Å; L62-L75 HydrophobicContact CB-CD1 4.45Å; I63-L75 HydrophobicContact CG1-CB 3.93Å; I63-L75 HydrophobicContact CG1-CD1 4.3Å; A66-L75 HydrophobicContact CB-CD1 3.86Å; S71-L75 WeakPolarHBondContact O-CG 3.42Å; S71-L75 PolarHBondContact O-N 3.46Å; L75-Q77 VanDerWaalsContact C-N 3.28Å; L75-Q77 PolarHBondContact O-N 3.44Å; L75-L78 HydrophobicContact CD2-CD1 4.46Å; L75-L78 WeakPolarHBondContact O-CB 3.36Å; L75-L78 PolarHBondContact O-N 3.07Å
76	R	86.9	Confident	86.2	Confident	186 Å²	186	71.4 Å²	71.4	70%	0.702	34%	0.335	S	S	*	.	H	α-helix	trans	-67.1	-25.6	172.5	-73.7	179	-177.7	-168.1	1.8	113.8	I72 F74	I72-R76 WeakPolarHBondContact O-CB 3.41Å; I72-R76 WeakPolarHBondContact O-CG 3.4Å; I72-R76 PolarHBondContact O-N 3.24Å; F74-R76 VanDerWaalsContact C-N 3.29Å; F74-R76 PolarHBondContact O-N 2.89Å
77	Q	87.6	Confident	86.7	Confident	106 Å²	106	73 Å²	73	50%	0.495	35%	0.348	S	S	.	.	H	α-helix	trans	-90.7	-18.6	176.6	-69.5	-178.1	-11.7	0	0	112.6	K73 F74 L75 S80 Y81	K73-Q77 WeakPolarHBondContact O-CG 3.37Å; K73-Q77 PolarHBondContact O-N 3.39Å; F74-Q77 CarbonylContact O-C 3.56Å; F74-Q77 WeakPolarHBondContact O-CA 3.49Å; F74-Q77 PolarHBondContact O-N 3Å; L75-Q77 VanDerWaalsContact C-N 3.28Å; L75-Q77 PolarHBondContact O-N 3.44Å; Q77-S80 PolarHBondContact O-N 3.02Å; Q77-S80 PolarHBondContact O-OG 2.88Å; Q77-Y81 PolarHBondContact O-N 3.46Å; Q77-Y81 VanDerWaalsContact O-N 3.08Å
78	L	86.8	Confident	87.3	Confident	1 Å²	1	63 Å²	63	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-52.2	-47.3	-174.5	-169.2	119.2	0	0	0	114	V51 M59 L60 F74 L75 S80 Y81 Q82	V51-L78 HydrophobicContact CG2-CD1 3.47Å; V51-L78 VanDerWaalsContact CG2-CD1 3.47Å; V51-L78 HydrophobicContact CG2-CG 4.39Å; M59-L78 HydrophobicContact CB-CD1 4.18Å; M59-L78 HydrophobicContact CB-CD2 4.25Å; M59-L78 HydrophobicContact CE-CD1 4.24Å; M59-L78 HydrophobicContact SD-CD1 4.3Å; L60-L78 HydrophobicContact CD2-CD2 3.61Å; L60-L78 HydrophobicContact CG-CD2 4.02Å; F74-L78 HydrophobicContact CD1-CD1 4.28Å; F74-L78 HydrophobicContact CE1-CD1 3.6Å; F74-L78 HydrophobicContact CZ-CD1 4.08Å; F74-L78 PolarHBondContact O-N 3.23Å; L75-L78 HydrophobicContact CD2-CD1 4.46Å; L75-L78 WeakPolarHBondContact O-CB 3.36Å; L75-L78 PolarHBondContact O-N 3.07Å; L78-S80 VanDerWaalsContact C-N 3.28Å; L78-S80 PolarHBondContact O-N 3.25Å; L78-Y81 WeakPolarHBondContact O-CB 3.49Å; L78-Y81 PolarHBondContact O-N 3.34Å; L78-Q82 PolarHBondContact O-N 3.2Å
79	P	85.5	Confident	87.3	Confident	69 Å²	69	59.5 Å²	59.5	45%	0.448	29%	0.294	S	S	.	.	H	α-helix	trans	-61.4	-36	177.8	-22.1	34	0	0	0	112.9	L60 Y81 A83	L60-P79 HydrophobicContact CD2-CG 4.1Å; P79-Y81 VanDerWaalsContact C-N 3.31Å; P79-Y81 PolarHBondContact O-N 3.02Å; P79-A83 VanDerWaalsContact O-CB 3.3Å; P79-A83 WeakPolarHBondContact O-CB 3.42Å; P79-A83 PolarHBondContact O-N 2.94Å
80	S	87.2	Confident	87.3	Confident	63 Å²	63	53.6 Å²	53.6	44%	0.441	28%	0.276	S	S	.	.	H	α-helix	trans	-75.9	-17.8	176.9	78.8	0	0	0	0	113.9	Q77 L78 K84	Q77-S80 PolarHBondContact O-N 3.02Å; Q77-S80 PolarHBondContact O-OG 2.88Å; L78-S80 VanDerWaalsContact C-N 3.28Å; L78-S80 PolarHBondContact O-N 3.25Å; S80-K84 WeakPolarHBondContact O-CD 3.18Å; S80-K84 WeakPolarHBondContact O-CG 3.46Å
81	Y	86.6	Confident	87.3	Confident	49 Å²	49	52 Å²	52	19%	0.192	26%	0.262	C	S	.	.	H	α-helix	trans	-85.5	-41.8	174.3	-165	-86.9	0	0	0	110.1	E48 V51 L52 Q77 L78 P79 K84 I85 L109	E48-Y81 PolarHBondContact OE1-OH 2.92Å; V51-Y81 HydrophobicContact CG1-CD1 3.73Å; V51-Y81 HydrophobicContact CG1-CE1 4.05Å; L52-Y81 HydrophobicContact CD2-CE1 4.11Å; Q77-Y81 PolarHBondContact O-N 3.46Å; Q77-Y81 VanDerWaalsContact O-N 3.08Å; L78-Y81 WeakPolarHBondContact O-CB 3.49Å; L78-Y81 PolarHBondContact O-N 3.34Å; P79-Y81 VanDerWaalsContact C-N 3.31Å; P79-Y81 PolarHBondContact O-N 3.02Å; Y81-K84 WeakPolarHBondContact O-CB 3.45Å; Y81-K84 PolarHBondContact O-N 3.2Å; Y81-I85 HydrophobicContact CD1-CD1 3.91Å; Y81-I85 HydrophobicContact CE1-CD1 3.91Å; Y81-I85 PolarHBondContact O-N 2.92Å; Y81-L109 HydrophobicContact CE1-CD2 4.43Å
82	Q	84.2	Confident	87.2	Confident	26 Å²	26	52 Å²	52	12%	0.121	26%	0.262	C	S	.	.	H	α-helix	trans	-67.7	-45.5	177.7	-161.8	162.5	-10.2	0	0	111.6	D57 L78 K84 I85 D86	D57-Q82 PolarHBondContact OD1-NE2 3.22Å; L78-Q82 PolarHBondContact O-N 3.2Å; Q82-K84 PolarHBondContact O-N 3.32Å; Q82-I85 WeakPolarHBondContact O-CA 3.48Å; Q82-I85 WeakPolarHBondContact O-CB 3.2Å; Q82-I85 PolarHBondContact O-N 2.91Å; Q82-D86 PolarHBondContact O-N 2.87Å
83	A	86.1	Confident	87.1	Confident	57 Å²	57	54.6 Å²	54.6	47%	0.471	27%	0.273	S	S	.	.	H	α-helix	trans	-57.8	-23.3	172.2	0	0	0	0	0	114	P79 A87	P79-A83 VanDerWaalsContact O-CB 3.3Å; P79-A83 WeakPolarHBondContact O-CB 3.42Å; P79-A83 PolarHBondContact O-N 2.94Å; A83-A87 WeakPolarHBondContact O-CB 3.45Å; A83-A87 PolarHBondContact O-N 3.42Å
84	K	86.9	Confident	86.8	Confident	114 Å²	114	56 Å²	56	50%	0.496	28%	0.275	S	S	.	.	H	α-helix	trans	-78.8	-34.4	171.4	-74.1	170.3	-175.4	166.8	0	112.8	S80 Y81 Q82 I88	S80-K84 WeakPolarHBondContact O-CD 3.18Å; S80-K84 WeakPolarHBondContact O-CG 3.46Å; Y81-K84 WeakPolarHBondContact O-CB 3.45Å; Y81-K84 PolarHBondContact O-N 3.2Å; Q82-K84 PolarHBondContact O-N 3.32Å; K84-I88 WeakPolarHBondContact O-CD1 3.49Å; K84-I88 VanDerWaalsContact O-CG1 3.23Å; K84-I88 WeakPolarHBondContact O-CG1 3.35Å; K84-I88 PolarHBondContact O-N 3.42Å
85	I	87.6	Confident	86.5	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-47.7	172.7	-66.3	169.9	0	0	0	108.9	V51 L52 Y81 Q82 A87 I88 H89 A112	V51-I85 HydrophobicContact CG1-CD1 3.91Å; L52-I85 HydrophobicContact CD2-CD1 4.45Å; Y81-I85 HydrophobicContact CD1-CD1 3.91Å; Y81-I85 HydrophobicContact CE1-CD1 3.91Å; Y81-I85 PolarHBondContact O-N 2.92Å; Q82-I85 WeakPolarHBondContact O-CA 3.48Å; Q82-I85 WeakPolarHBondContact O-CB 3.2Å; Q82-I85 PolarHBondContact O-N 2.91Å; I85-A87 VanDerWaalsContact C-N 3.35Å; I85-A87 PolarHBondContact O-N 2.81Å; I85-I88 WeakPolarHBondContact O-CB 3.38Å; I85-I88 PolarHBondContact O-N 3.26Å; I85-H89 PolarHBondContact O-CD2 2.76Å; I85-H89 VanDerWaalsContact O-CD2 3.3Å; I85-H89 PolarHBondContact O-N 2.86Å; I85-A112 HydrophobicContact CB-CB 4.45Å; I85-A112 HydrophobicContact CD1-CB 4.08Å; I85-A112 HydrophobicContact CG1-CB 3.89Å; I85-A112 HydrophobicContact CG2-CB 3.82Å
86	D	86.5	Confident	86.5	Confident	61 Å²	61	62.4 Å²	62.4	33%	0.326	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-43.4	177.5	-56.8	-36	0	0	0	111.1	Q82 I88 H89 H90	Q82-D86 PolarHBondContact O-N 2.87Å; D86-I88 VanDerWaalsContact C-N 3.31Å; D86-I88 PolarHBondContact O-N 3.39Å; D86-H89 PolarHBondContact O-N 2.66Å; D86-H90 WeakPolarHBondContact O-CB 3.34Å; D86-H90 PolarHBondContact O-CD2 2.96Å; D86-H90 PolarHBondContact O-N 3.08Å
87	A	88.1	Confident	86.4	Confident	39 Å²	39	55.5 Å²	55.5	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-31.9	173.9	0	0	0	0	0	113.8	A83 I85 A91 L103	A83-A87 WeakPolarHBondContact O-CB 3.45Å; A83-A87 PolarHBondContact O-N 3.42Å; I85-A87 VanDerWaalsContact C-N 3.35Å; I85-A87 PolarHBondContact O-N 2.81Å; A87-A91 WeakPolarHBondContact O-CB 3.46Å; A87-A91 PolarHBondContact O-N 3.14Å; A87-L103 HydrophobicContact CB-CD1 3.99Å
88	I	88.9	Confident	86.3	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-46	173.2	-74	160.4	0	0	0	110.2	K84 I85 D86 A91 V92 L100 L103 V104 L109 V120	K84-I88 WeakPolarHBondContact O-CD1 3.49Å; K84-I88 VanDerWaalsContact O-CG1 3.23Å; K84-I88 WeakPolarHBondContact O-CG1 3.35Å; K84-I88 PolarHBondContact O-N 3.42Å; I85-I88 WeakPolarHBondContact O-CB 3.38Å; I85-I88 PolarHBondContact O-N 3.26Å; D86-I88 VanDerWaalsContact C-N 3.31Å; D86-I88 PolarHBondContact O-N 3.39Å; I88-A91 PolarHBondContact O-N 3.23Å; I88-V92 PolarHBondContact O-N 2.71Å; I88-L100 HydrophobicContact CG2-CD1 3.99Å; I88-L103 HydrophobicContact CD1-CB 4.31Å; I88-L103 HydrophobicContact CG1-CB 3.67Å; I88-L103 HydrophobicContact CG1-CD1 4.1Å; I88-L103 HydrophobicContact CG1-CG 4.48Å; I88-V104 HydrophobicContact CD1-CG2 3.97Å; I88-V104 HydrophobicContact CG1-CG2 3.87Å; I88-V104 HydrophobicContact CG2-CG2 3.85Å; I88-L109 HydrophobicContact CD1-CB 3.97Å; I88-L109 HydrophobicContact CD1-CD1 4.44Å; I88-L109 HydrophobicContact CD1-CD2 4.45Å; I88-V120 HydrophobicContact CG2-CB 4.49Å; I88-V120 HydrophobicContact CG2-CG1 3.83Å; I88-V120 HydrophobicContact CG2-CG2 3.74Å
89	H	87.9	Confident	86.3	Confident	6 Å²	6	59.7 Å²	59.7	3%	0.028	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-41	178.3	-78.5	-74.7	0	0	0	112.4	I85 D86 A91 V92 E93 A112 D114 T118	I85-H89 PolarHBondContact O-CD2 2.76Å; I85-H89 VanDerWaalsContact O-CD2 3.3Å; I85-H89 PolarHBondContact O-N 2.86Å; D86-H89 PolarHBondContact O-N 2.66Å; H89-A91 VanDerWaalsContact C-N 3.33Å; H89-A91 PolarHBondContact O-N 3.15Å; H89-V92 PolarHBondContact O-N 2.81Å; H89-E93 PolarHBondContact O-N 3.13Å; H89-A112 PolarHBondContact NE2-O 3.26Å; H89-D114 PolarHBondContact NE2-N 3.42Å; H89-T118 PolarHBondContact CE1-O 2.62Å
90	H	85.9	Confident	86.4	Confident	93 Å²	93	56.4 Å²	56.4	43%	0.431	28%	0.284	S	S	.	.	H	α-helix	trans	-67.7	-28.8	173.7	-70.2	-49.8	0	0	0	113.3	D86 E93 R94	D86-H90 WeakPolarHBondContact O-CB 3.34Å; D86-H90 PolarHBondContact O-CD2 2.96Å; D86-H90 PolarHBondContact O-N 3.08Å; H90-E93 IonicContact CE1-OE2 2.73Å; H90-E93 IonicContact CG-OE2 3.6Å; H90-E93 IonicContact ND1-OE2 2.68Å; H90-E93 PolarHBondContact ND1-OE2 3.06Å; H90-E93 PolarHBondContact O-N 2.98Å; H90-R94 WeakPolarHBondContact O-CB 3.33Å; H90-R94 WeakPolarHBondContact O-CD 3.28Å; H90-R94 VanDerWaalsContact O-CG 3.22Å; H90-R94 WeakPolarHBondContact O-CG 3.36Å; H90-R94 PolarHBondContact O-N 3.38Å
91	A	88.2	Confident	86.4	Confident	4 Å²	4	57.9 Å²	57.9	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-66	-39.1	172	0	0	0	0	0	111.7	A87 I88 H89 R94 K95 D96 L100	A87-A91 WeakPolarHBondContact O-CB 3.46Å; A87-A91 PolarHBondContact O-N 3.14Å; I88-A91 PolarHBondContact O-N 3.23Å; H89-A91 VanDerWaalsContact C-N 3.33Å; H89-A91 PolarHBondContact O-N 3.15Å; A91-R94 PolarHBondContact O-N 3.47Å; A91-K95 PolarHBondContact O-N 2.99Å; A91-D96 PolarHBondContact O-N 3.37Å; A91-L100 HydrophobicContact CB-CB 4.31Å; A91-L100 HydrophobicContact CB-CD1 4.18Å
92	V	87.8	Confident	86.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-39.8	172.1	179.3	0	0	0	0	111.8	I88 H89 R94 K95 L100 V120 K123 A124 N127	I88-V92 PolarHBondContact O-N 2.71Å; H89-V92 PolarHBondContact O-N 2.81Å; V92-R94 VanDerWaalsContact C-N 3.3Å; V92-R94 PolarHBondContact O-N 3.39Å; V92-K95 PolarHBondContact O-N 2.78Å; V92-K95 VanDerWaalsContact O-N 3.13Å; V92-L100 HydrophobicContact CG2-CD1 3.55Å; V92-L100 HydrophobicContact CG2-CD2 4.39Å; V92-V120 HydrophobicContact CG2-CG1 3.63Å; V92-K123 HydrophobicContact CG1-CB 4.25Å; V92-K123 HydrophobicContact CG1-CG 4.41Å; V92-A124 HydrophobicContact CG1-CB 3.8Å; V92-N127 PolarHBondContact O-ND2 3.41Å; V92-N127 VanDerWaalsContact O-ND2 3.17Å
93	E	83.9	Confident	86.4	Confident	103 Å²	103	63.2 Å²	63.2	48%	0.481	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-38.1	175.9	-165.3	170.1	-145.7	0	0	112.5	H89 H90 K95 N127	H89-E93 PolarHBondContact O-N 3.13Å; H90-E93 IonicContact CE1-OE2 2.73Å; H90-E93 IonicContact CG-OE2 3.6Å; H90-E93 IonicContact ND1-OE2 2.68Å; H90-E93 PolarHBondContact ND1-OE2 3.06Å; H90-E93 PolarHBondContact O-N 2.98Å; E93-K95 VanDerWaalsContact C-N 3.31Å; E93-K95 PolarHBondContact O-N 2.94Å; E93-N127 WeakPolarHBondContact CA-ND2 3.3Å
94	R	83.6	Confident	86.3	Confident	166 Å²	166	60.5 Å²	60.5	63%	0.626	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.2	176	-66.1	167.6	-179.6	-159.5	-9.1	113.9	H90 A91 V92 D96 D371	H90-R94 WeakPolarHBondContact O-CB 3.33Å; H90-R94 WeakPolarHBondContact O-CD 3.28Å; H90-R94 VanDerWaalsContact O-CG 3.22Å; H90-R94 WeakPolarHBondContact O-CG 3.36Å; H90-R94 PolarHBondContact O-N 3.38Å; A91-R94 PolarHBondContact O-N 3.47Å; V92-R94 VanDerWaalsContact C-N 3.3Å; V92-R94 PolarHBondContact O-N 3.39Å; R94-D96 HydrophobicContact CB-CB 4.48Å; R94-D96 PolarHBondContact O-N 3.17Å; R94-D371 IonicContact CZ-OD1 2.6Å; R94-D371 IonicContact NH1-OD1 3.33Å; R94-D371 PolarHBondContact NH1-OD1 3.17Å; R94-D371 IonicContact NH2-OD1 2.79Å; R94-D371 PolarHBondContact NH2-OD1 3.2Å
95	K	83.7	Confident	85.9	Confident	106 Å²	106	62.9 Å²	62.9	46%	0.461	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	28.2	-171.1	-57.8	-169.3	176	-165.7	0	114.2	A91 V92 E93 L97 N127 D129	A91-K95 PolarHBondContact O-N 2.99Å; V92-K95 PolarHBondContact O-N 2.78Å; V92-K95 VanDerWaalsContact O-N 3.13Å; E93-K95 VanDerWaalsContact C-N 3.31Å; E93-K95 PolarHBondContact O-N 2.94Å; K95-L97 PolarHBondContact O-N 3.21Å; K95-N127 WeakPolarHBondContact CE-O 3.19Å; K95-N127 PolarHBondContact NZ-O 2.95Å; K95-D129 HydrophobicContact CD-CB 4.27Å; K95-D129 HydrophobicContact CG-CB 4.34Å
96	D	85.6	Confident	85.6	Confident	55 Å²	55	69.7 Å²	69.7	29%	0.294	33%	0.328	S	S	.	.			trans	-89.2	87	-178.7	-179.3	1.3	0	0	0	111.3	A91 R94 Q98 T99 L100	A91-D96 PolarHBondContact O-N 3.37Å; R94-D96 HydrophobicContact CB-CB 4.48Å; R94-D96 PolarHBondContact O-N 3.17Å; D96-Q98 PolarHBondContact O-N 2.91Å; D96-Q98 WeakPolarHBondContact OD1-CA 3.3Å; D96-Q98 WeakPolarHBondContact OD1-CB 3.24Å; D96-Q98 PolarHBondContact OD1-N 2.97Å; D96-T99 PolarHBondContact O-OG1 3.02Å; D96-T99 PolarHBondContact OD1-N 2.84Å; D96-T99 VanDerWaalsContact OD2-CB 3.3Å; D96-T99 WeakPolarHBondContact OD2-CB 3.32Å; D96-T99 WeakPolarHBondContact OD2-CG2 3.29Å; D96-T99 PolarHBondContact OD2-OG1 3.1Å; D96-L100 WeakPolarHBondContact O-CB 3.27Å; D96-L100 PolarHBondContact O-N 3.3Å; D96-L100 VanDerWaalsContact O-N 3.12Å
97	L	85	Confident	85.2	Confident	40 Å²	40	71.6 Å²	71.6	21%	0.209	34%	0.338	C	S	.	.	H	α-helix	trans	-60.8	-24.2	175.7	-178.7	62.5	0	0	0	113.1	K95 L100 K101 N131 T132 W135	K95-L97 PolarHBondContact O-N 3.21Å; L97-L100 HydrophobicContact CD1-CD2 4.47Å; L97-K101 HydrophobicContact CD1-CD 4.35Å; L97-K101 HydrophobicContact CD1-CG 4.39Å; L97-K101 HydrophobicContact CG-CD 4.06Å; L97-K101 VanDerWaalsContact O-CB 3.31Å; L97-K101 WeakPolarHBondContact O-CB 3.47Å; L97-K101 WeakPolarHBondContact O-CD 3.42Å; L97-K101 WeakPolarHBondContact O-CG 3.25Å; L97-K101 PolarHBondContact O-N 3.23Å; L97-N131 HydrophobicContact CD2-CB 4.46Å; L97-T132 HydrophobicContact CB-CG2 4.12Å; L97-T132 HydrophobicContact CD1-CG2 3.71Å; L97-T132 HydrophobicContact CG-CG2 4.47Å; L97-W135 HydrophobicContact CD1-CB 3.94Å; L97-W135 HydrophobicContact CD1-CD2 4.15Å; L97-W135 HydrophobicContact CD1-CE3 4.33Å; L97-W135 HydrophobicContact CD1-CG 3.97Å
98	Q	86.9	Confident	84.9	Confident	144 Å²	144	74.5 Å²	74.5	67%	0.673	34%	0.343	S	S	*	.	H	α-helix	trans	-77.3	-48.4	-178.5	-64.6	-160.5	15.3	0	0	111.8	D96 L100 K101 Q102	D96-Q98 PolarHBondContact O-N 2.91Å; D96-Q98 WeakPolarHBondContact OD1-CA 3.3Å; D96-Q98 WeakPolarHBondContact OD1-CB 3.24Å; D96-Q98 PolarHBondContact OD1-N 2.97Å; Q98-L100 VanDerWaalsContact C-N 3.32Å; Q98-L100 PolarHBondContact O-N 2.73Å; Q98-K101 WeakPolarHBondContact O-CB 3.26Å; Q98-K101 PolarHBondContact O-N 3.26Å; Q98-Q102 WeakPolarHBondContact O-CG 3.27Å; Q98-Q102 PolarHBondContact O-N 3.34Å; Q98-Q102 VanDerWaalsContact O-N 3.12Å
99	T	86.7	Confident	84.6	Confident	51 Å²	51	75.5 Å²	75.5	31%	0.313	35%	0.349	S	S	.	.	H	α-helix	trans	-66.4	-36.3	174.4	54.9	0	0	0	0	111.4	D96 K101 Q102 L103	D96-T99 PolarHBondContact O-OG1 3.02Å; D96-T99 PolarHBondContact OD1-N 2.84Å; D96-T99 VanDerWaalsContact OD2-CB 3.3Å; D96-T99 WeakPolarHBondContact OD2-CB 3.32Å; D96-T99 WeakPolarHBondContact OD2-CG2 3.29Å; D96-T99 PolarHBondContact OD2-OG1 3.1Å; T99-K101 PolarHBondContact O-N 2.87Å; T99-Q102 PolarHBondContact O-N 3.31Å; T99-Q102 VanDerWaalsContact O-N 3.13Å; T99-L103 WeakPolarHBondContact O-CG 3.49Å; T99-L103 PolarHBondContact O-N 2.63Å
100	L	87.5	Confident	84.3	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-56	-47.7	171.4	-165.3	80.5	0	0	0	112	I88 A91 V92 D96 L97 Q98 Q102 L103 V104 V120 T132 W135 L136	I88-L100 HydrophobicContact CG2-CD1 3.99Å; A91-L100 HydrophobicContact CB-CB 4.31Å; A91-L100 HydrophobicContact CB-CD1 4.18Å; V92-L100 HydrophobicContact CG2-CD1 3.55Å; V92-L100 HydrophobicContact CG2-CD2 4.39Å; D96-L100 WeakPolarHBondContact O-CB 3.27Å; D96-L100 PolarHBondContact O-N 3.3Å; D96-L100 VanDerWaalsContact O-N 3.12Å; L97-L100 HydrophobicContact CD1-CD2 4.47Å; Q98-L100 VanDerWaalsContact C-N 3.32Å; Q98-L100 PolarHBondContact O-N 2.73Å; L100-Q102 VanDerWaalsContact C-N 3.28Å; L100-Q102 PolarHBondContact O-N 3.27Å; L100-L103 PolarHBondContact O-N 2.97Å; L100-V104 HydrophobicContact CD1-CG2 4.06Å; L100-V104 HydrophobicContact CG-CG2 4.15Å; L100-V104 WeakPolarHBondContact O-CG2 3.48Å; L100-V104 PolarHBondContact O-N 3.24Å; L100-V120 HydrophobicContact CD1-CG1 4.33Å; L100-T132 HydrophobicContact CD2-CG2 3.81Å; L100-W135 HydrophobicContact CD2-CE3 3.99Å; L100-W135 HydrophobicContact CD2-CZ3 3.93Å; L100-W135 HydrophobicContact CG-CZ3 4.21Å; L100-L136 HydrophobicContact CD2-CD2 4.5Å; L100-L136 HydrophobicContact CD2-CG 4.49Å
101	K	87	Confident	84.3	Confident	94 Å²	94	74 Å²	74	41%	0.409	34%	0.343	S	S	.	.	H	α-helix	trans	-58.6	-37.2	176.1	-84.1	165.7	178.7	170.5	0	112.7	L97 Q98 T99 W135	L97-K101 HydrophobicContact CD1-CD 4.35Å; L97-K101 HydrophobicContact CD1-CG 4.39Å; L97-K101 HydrophobicContact CG-CD 4.06Å; L97-K101 VanDerWaalsContact O-CB 3.31Å; L97-K101 WeakPolarHBondContact O-CB 3.47Å; L97-K101 WeakPolarHBondContact O-CD 3.42Å; L97-K101 WeakPolarHBondContact O-CG 3.25Å; L97-K101 PolarHBondContact O-N 3.23Å; Q98-K101 WeakPolarHBondContact O-CB 3.26Å; Q98-K101 PolarHBondContact O-N 3.26Å; T99-K101 PolarHBondContact O-N 2.87Å; K101-W135 HydrophobicContact CB-CH2 4.5Å; K101-W135 HydrophobicContact CB-CZ2 4.14Å; K101-W135 HydrophobicContact CG-CD2 4.15Å; K101-W135 HydrophobicContact CG-CH2 4.07Å; K101-W135 HydrophobicContact CG-CZ2 3.45Å; K101-W135 VanDerWaalsContact CG-CZ2 3.45Å
102	Q	86.3	Confident	84.2	Confident	129 Å²	129	73.8 Å²	73.8	60%	0.603	34%	0.342	S	S	*	.	H	α-helix	trans	-75.1	-37.6	178.7	-67.6	-179.6	23	0	0	113	Q98 T99 L100 K105	Q98-Q102 WeakPolarHBondContact O-CG 3.27Å; Q98-Q102 PolarHBondContact O-N 3.34Å; Q98-Q102 VanDerWaalsContact O-N 3.12Å; T99-Q102 PolarHBondContact O-N 3.31Å; T99-Q102 VanDerWaalsContact O-N 3.13Å; L100-Q102 VanDerWaalsContact C-N 3.28Å; L100-Q102 PolarHBondContact O-N 3.27Å; Q102-K105 WeakPolarHBondContact O-CE 3.23Å; Q102-K105 WeakPolarHBondContact O-CG 3.38Å
103	L	85.2	Confident	84	Confident	59 Å²	59	75.6 Å²	75.6	31%	0.309	35%	0.349	S	S	.	.	H	α-helix	trans	-78.6	-46.4	-178.4	-66.7	171.1	0	0	0	112.3	A87 I88 T99 L100 K105	A87-L103 HydrophobicContact CB-CD1 3.99Å; I88-L103 HydrophobicContact CD1-CB 4.31Å; I88-L103 HydrophobicContact CG1-CB 3.67Å; I88-L103 HydrophobicContact CG1-CD1 4.1Å; I88-L103 HydrophobicContact CG1-CG 4.48Å; T99-L103 WeakPolarHBondContact O-CG 3.49Å; T99-L103 PolarHBondContact O-N 2.63Å; L100-L103 PolarHBondContact O-N 2.97Å; L103-K105 VanDerWaalsContact C-N 3.32Å; L103-K105 PolarHBondContact O-N 2.95Å
104	V	84	Confident	83.8	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	33%	0.328	C	S	.	.			trans	-84	72.8	-173.4	-167.5	0	0	0	0	111.5	I88 L100 A110 W135 K139 F140	I88-V104 HydrophobicContact CD1-CG2 3.97Å; I88-V104 HydrophobicContact CG1-CG2 3.87Å; I88-V104 HydrophobicContact CG2-CG2 3.85Å; L100-V104 HydrophobicContact CD1-CG2 4.06Å; L100-V104 HydrophobicContact CG-CG2 4.15Å; L100-V104 WeakPolarHBondContact O-CG2 3.48Å; L100-V104 PolarHBondContact O-N 3.24Å; V104-A110 HydrophobicContact CG1-CB 3.95Å; V104-W135 HydrophobicContact CB-CH2 4.19Å; V104-W135 HydrophobicContact CB-CZ3 4.36Å; V104-K139 PolarHBondContact O-NZ 3.02Å; V104-F140 HydrophobicContact CG1-CD2 4.47Å; V104-F140 HydrophobicContact CG1-CE2 3.51Å; V104-F140 HydrophobicContact CG1-CZ 3.9Å
105	K	78	Confident	83.1	Confident	164 Å²	164	69.1 Å²	69.1	71%	0.713	32%	0.32	S	S	*	.			trans	-87.8	-14.7	177.3	-63.5	-170.4	-178.1	-175.3	0	115	Q102 L103	Q102-K105 WeakPolarHBondContact O-CE 3.23Å; Q102-K105 WeakPolarHBondContact O-CG 3.38Å; L103-K105 VanDerWaalsContact C-N 3.32Å; L103-K105 PolarHBondContact O-N 2.95Å
106	K	80	Confident	82.3	Confident	148 Å²	148	70 Å²	70	64%	0.643	32%	0.324	S	S	*	.	S	Bend	trans	-135.8	142.1	-175.5	-66	-175.9	178.7	-177.5	0	111.5	K108 L109	K106-K108 PolarHBondContact O-N 2.94Å; K106-K108 VanDerWaalsContact O-N 3.13Å; K106-L109 PolarHBondContact O-N 3.2Å
107	N	78.5	Confident	81.7	Confident	100 Å²	100	67.4 Å²	67.4	54%	0.535	31%	0.311	S	S	.	.	H	α-helix	trans	-53.1	-37.5	-178.9	-53	31.9	0	0	0	113	L109 A110 L111 F140	N107-L109 VanDerWaalsContact C-N 3.25Å; N107-L109 PolarHBondContact O-N 3.29Å; N107-A110 PolarHBondContact O-N 3.42Å; N107-A110 VanDerWaalsContact O-N 3.17Å; N107-L111 PolarHBondContact O-N 3.15Å; N107-F140 HydrophobicContact CB-CD1 4.06Å; N107-F140 HydrophobicContact CB-CE1 4.26Å; N107-F140 WeakPolarHBondContact OD1-CE1 3.46Å
108	K	82.9	Confident	81.5	Confident	101 Å²	101	66.3 Å²	66.3	44%	0.439	31%	0.306	S	S	.	.	H	α-helix	trans	-54.6	-38.8	177.1	-71.2	-168.3	-177.1	-177.5	0	113.2	E48 L52 K106 L111	E48-K108 VanDerWaalsContact OE1-CD 3.27Å; E48-K108 WeakPolarHBondContact OE1-CD 3.31Å; E48-K108 IonicContact OE1-NZ 3.41Å; E48-K108 PolarHBondContact OE1-NZ 3.46Å; E48-K108 IonicContact OE2-NZ 3.64Å; E48-K108 PolarHBondContact OE2-NZ 3.31Å; L52-K108 HydrophobicContact CD1-CB 3.99Å; L52-K108 HydrophobicContact CD1-CD 4.2Å; L52-K108 HydrophobicContact CD1-CG 4.33Å; L52-K108 WeakPolarHBondContact CD2-O 3.38Å; K106-K108 PolarHBondContact O-N 2.94Å; K106-K108 VanDerWaalsContact O-N 3.13Å; K108-L111 PolarHBondContact O-N 2.77Å
109	L	82.9	Confident	81.5	Confident	23 Å²	23	59.5 Å²	59.5	12%	0.12	27%	0.274	C	S	.	.	H	α-helix	trans	-76	-25.4	-177.2	-66.9	172.1	0	0	0	112.6	Y81 I88 K106 N107 L111 A112	Y81-L109 HydrophobicContact CE1-CD2 4.43Å; I88-L109 HydrophobicContact CD1-CB 3.97Å; I88-L109 HydrophobicContact CD1-CD1 4.44Å; I88-L109 HydrophobicContact CD1-CD2 4.45Å; K106-L109 PolarHBondContact O-N 3.2Å; N107-L109 VanDerWaalsContact C-N 3.25Å; N107-L109 PolarHBondContact O-N 3.29Å; L109-L111 VanDerWaalsContact C-N 3.26Å; L109-L111 PolarHBondContact O-N 2.86Å; L109-A112 WeakPolarHBondContact O-CB 3.35Å; L109-A112 PolarHBondContact O-N 3.07Å
110	A	82	Confident	81.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71.9	-22.6	173.1	0	0	0	0	0	112.5	V104 N107 F140 V143	V104-A110 HydrophobicContact CG1-CB 3.95Å; N107-A110 PolarHBondContact O-N 3.42Å; N107-A110 VanDerWaalsContact O-N 3.17Å; A110-F140 HydrophobicContact CB-CB 4.44Å; A110-F140 HydrophobicContact CB-CD2 3.68Å; A110-F140 HydrophobicContact CB-CE2 4.02Å; A110-F140 HydrophobicContact CB-CG 4.06Å; A110-V143 HydrophobicContact CB-CG2 4Å
111	L	84.9	Confident	81.7	Confident	66 Å²	66	57.1 Å²	57.1	35%	0.346	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.7	175.3	-61.9	171.9	0	0	0	113.3	N107 K108 L109 R113 V143 V146	N107-L111 PolarHBondContact O-N 3.15Å; K108-L111 PolarHBondContact O-N 2.77Å; L109-L111 VanDerWaalsContact C-N 3.26Å; L109-L111 PolarHBondContact O-N 2.86Å; L111-R113 PolarHBondContact O-N 3.01Å; L111-V143 HydrophobicContact CD2-CB 4.48Å; L111-V143 HydrophobicContact CD2-CG2 3.93Å; L111-V146 HydrophobicContact CD2-CG2 3.55Å
112	A	85	Confident	81.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.24	C	C	.	.			trans	-70.8	126.5	-175.7	0	0	0	0	0	111.3	L52 I85 H89 L109	L52-A112 HydrophobicContact CD2-CB 3.96Å; L52-A112 WeakPolarHBondContact O-CA 3.48Å; I85-A112 HydrophobicContact CB-CB 4.45Å; I85-A112 HydrophobicContact CD1-CB 4.08Å; I85-A112 HydrophobicContact CG1-CB 3.89Å; I85-A112 HydrophobicContact CG2-CB 3.82Å; H89-A112 PolarHBondContact NE2-O 3.26Å; L109-A112 WeakPolarHBondContact O-CB 3.35Å; L109-A112 PolarHBondContact O-N 3.07Å
113	R	85.1	Confident	81.7	Confident	39 Å²	39	48 Å²	48	15%	0.147	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-86	147.2	173.6	-65.5	179.1	179.6	172.3	-0.9	111.2	L52 L111 G117 T118 T119 Q147	L52-R113 PolarHBondContact O-N 3.2Å; L111-R113 PolarHBondContact O-N 3.01Å; R113-G117 WeakPolarHBondContact CD-O 3.42Å; R113-T118 CarbonylContact C-O 3.53Å; R113-T118 VanDerWaalsContact CA-O 3.26Å; R113-T118 WeakPolarHBondContact CA-O 3.43Å; R113-T119 HydrophobicContact CG-CG2 4.04Å; R113-Q147 VanDerWaalsContact CZ-O 3.31Å; R113-Q147 PolarHBondContact NE-O 3.48Å; R113-Q147 PolarHBondContact NH2-O 3.22Å
114	D	79.6	Confident	81.9	Confident	9 Å²	9	45.2 Å²	45.2	5%	0.048	20%	0.203	C	C	.	.			trans	-77.6	177.5	167.6	75.1	-1.3	0	0	0	111.6	H89 F116 G117 T118 K123	H89-D114 PolarHBondContact NE2-N 3.42Å; D114-F116 PolarHBondContact O-N 3.45Å; D114-F116 WeakPolarHBondContact OD1-CA 3.46Å; D114-F116 WeakPolarHBondContact OD1-CB 3.5Å; D114-F116 PolarHBondContact OD1-N 3.29Å; D114-G117 PolarHBondContact O-N 2.85Å; D114-G117 PolarHBondContact OD1-N 2.79Å; D114-G117 VanDerWaalsContact OD1-N 3.16Å; D114-T118 PolarHBondContact N-O 3.39Å; D114-T118 PolarHBondContact OD1-N 3.41Å; D114-T118 PolarHBondContact OD1-OG1 3.38Å; D114-T118 PolarHBondContact OD2-OG1 2.87Å; D114-K123 IonicContact OD2-NZ 2.73Å; D114-K123 PolarHBondContact OD2-NZ 3.22Å
115	R	68.6	Low	82.1	Confident	124 Å²	124	45.2 Å²	45.2	47%	0.468	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-6.7	176.7	55.5	163	-75.4	-133.4	-12	115.4
116	F	66	Low	82.4	Confident	123 Å²	123	40.2 Å²	40.2	54%	0.539	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-9.5	173.1	-56.5	-78.5	0	0	0	112.1	D114 T118 N149	D114-F116 PolarHBondContact O-N 3.45Å; D114-F116 WeakPolarHBondContact OD1-CA 3.46Å; D114-F116 WeakPolarHBondContact OD1-CB 3.5Å; D114-F116 PolarHBondContact OD1-N 3.29Å; F116-T118 HydrophobicContact CB-CG2 4.39Å; F116-N149 PolarHBondContact O-ND2 3.49Å; F116-N149 VanDerWaalsContact O-ND2 3.17Å
117	G	73.8	Confident	82.4	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.01	16%	0.164	C	C	.	.	S	Bend	trans	92.2	4.1	-175.9	0	0	0	0	0	114.2	R113 D114 N149	R113-G117 WeakPolarHBondContact CD-O 3.42Å; D114-G117 PolarHBondContact O-N 2.85Å; D114-G117 PolarHBondContact OD1-N 2.79Å; D114-G117 VanDerWaalsContact OD1-N 3.16Å; G117-N149 WeakPolarHBondContact CA-ND2 3.34Å
118	T	81.1	Confident	82.7	Confident	18 Å²	18	32.2 Å²	32.2	11%	0.11	15%	0.148	C	C	.	.			trans	-81.1	139.6	-179.8	72.4	0	0	0	0	110.4	H89 R113 D114 F116	H89-T118 PolarHBondContact CE1-O 2.62Å; R113-T118 CarbonylContact C-O 3.53Å; R113-T118 VanDerWaalsContact CA-O 3.26Å; R113-T118 WeakPolarHBondContact CA-O 3.43Å; D114-T118 PolarHBondContact N-O 3.39Å; D114-T118 PolarHBondContact OD1-N 3.41Å; D114-T118 PolarHBondContact OD1-OG1 3.38Å; D114-T118 PolarHBondContact OD2-OG1 2.87Å; F116-T118 HydrophobicContact CB-CG2 4.39Å
119	T	85.4	Confident	82.8	Confident	1 Å²	1	28 Å²	28	1%	0.006	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	-86.5	159.2	177.5	61.5	0	0	0	0	111.5	R113 L121 Q122 K123 V146	R113-T119 HydrophobicContact CG-CG2 4.04Å; T119-L121 PolarHBondContact O-N 3.26Å; T119-Q122 PolarHBondContact O-N 2.67Å; T119-Q122 VanDerWaalsContact O-N 3.16Å; T119-Q122 WeakPolarHBondContact OG1-CB 3.37Å; T119-Q122 VanDerWaalsContact OG1-CG 3.28Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.33Å; T119-Q122 PolarHBondContact OG1-N 2.8Å; T119-Q122 PolarHBondContact OG1-OE1 3.27Å; T119-K123 PolarHBondContact O-N 2.72Å; T119-V146 HydrophobicContact CG2-CB 4.09Å; T119-V146 HydrophobicContact CG2-CG1 3.52Å
120	V	88.6	Confident	83	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-53.5	-37.4	176.3	-169.7	0	0	0	0	111.8	I88 V92 L100 A124 L136	I88-V120 HydrophobicContact CG2-CB 4.49Å; I88-V120 HydrophobicContact CG2-CG1 3.83Å; I88-V120 HydrophobicContact CG2-CG2 3.74Å; V92-V120 HydrophobicContact CG2-CG1 3.63Å; L100-V120 HydrophobicContact CD1-CG1 4.33Å; V120-A124 WeakPolarHBondContact O-CB 3.46Å; V120-A124 PolarHBondContact O-N 3.13Å; V120-A124 VanDerWaalsContact O-N 3.14Å; V120-L136 HydrophobicContact CG1-CD1 4.03Å; V120-L136 HydrophobicContact CG1-CD2 4.41Å
121	L	90.2	Very high	83.4	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-71.7	-47.4	177.3	-178.7	65.8	0	0	0	112.3	T119 K123 A124 V125 V133 L136 L137 V143 A154 L173	T119-L121 PolarHBondContact O-N 3.26Å; L121-K123 VanDerWaalsContact C-N 3.26Å; L121-K123 PolarHBondContact O-N 3.33Å; L121-A124 WeakPolarHBondContact O-CB 3.31Å; L121-A124 PolarHBondContact O-N 3.12Å; L121-V125 WeakPolarHBondContact O-CG2 3.32Å; L121-V125 PolarHBondContact O-N 3.13Å; L121-V133 HydrophobicContact CD1-CB 4.5Å; L121-V133 HydrophobicContact CD1-CG1 4.16Å; L121-V133 HydrophobicContact CD1-CG2 4.32Å; L121-L136 HydrophobicContact CD1-CB 4.42Å; L121-L136 HydrophobicContact CD1-CD1 4.42Å; L121-L137 HydrophobicContact CD1-CD2 4.1Å; L121-L137 HydrophobicContact CD1-CG 4.12Å; L121-L137 HydrophobicContact CD2-CD2 3.78Å; L121-V143 HydrophobicContact CB-CG1 3.69Å; L121-V143 HydrophobicContact CD2-CB 4.41Å; L121-V143 HydrophobicContact CD2-CG1 3.99Å; L121-V143 WeakPolarHBondContact CD2-O 3.41Å; L121-V143 HydrophobicContact CG-CG1 4.47Å; L121-A154 HydrophobicContact CD2-CB 3.86Å; L121-A154 HydrophobicContact CG-CB 3.99Å; L121-L173 HydrophobicContact CD2-CD2 4.42Å
122	Q	88.6	Confident	83.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.6	-40.2	176.7	-73.8	158.5	-32.3	0	0	111.3	T119 V125 M126 V146 R152 A154 Y157	T119-Q122 PolarHBondContact O-N 2.67Å; T119-Q122 VanDerWaalsContact O-N 3.16Å; T119-Q122 WeakPolarHBondContact OG1-CB 3.37Å; T119-Q122 VanDerWaalsContact OG1-CG 3.28Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.33Å; T119-Q122 PolarHBondContact OG1-N 2.8Å; T119-Q122 PolarHBondContact OG1-OE1 3.27Å; Q122-V125 PolarHBondContact O-N 2.85Å; Q122-M126 VanDerWaalsContact O-CG 3.31Å; Q122-M126 WeakPolarHBondContact O-CG 3.43Å; Q122-M126 PolarHBondContact O-N 3.46Å; Q122-V146 PolarHBondContact NE2-O 3.21Å; Q122-R152 PolarHBondContact NE2-O 3.14Å; Q122-A154 HydrophobicContact CG-CB 4.22Å; Q122-Y157 HydrophobicContact CB-CD2 4.24Å; Q122-Y157 HydrophobicContact CB-CE2 4.27Å; Q122-Y157 HydrophobicContact CG-CD2 3.92Å; Q122-Y157 HydrophobicContact CG-CE2 3.97Å
123	K	85.9	Confident	83.7	Confident	32 Å²	32	32.4 Å²	32.4	14%	0.139	15%	0.15	C	C	.	.	H	α-helix	trans	-67.8	-35.7	177.9	-156.8	146.6	-169.4	169.4	0	112.8	V92 D114 T119 L121 N127	V92-K123 HydrophobicContact CG1-CB 4.25Å; V92-K123 HydrophobicContact CG1-CG 4.41Å; D114-K123 IonicContact OD2-NZ 2.73Å; D114-K123 PolarHBondContact OD2-NZ 3.22Å; T119-K123 PolarHBondContact O-N 2.72Å; L121-K123 VanDerWaalsContact C-N 3.26Å; L121-K123 PolarHBondContact O-N 3.33Å; K123-N127 WeakPolarHBondContact O-CB 3.49Å; K123-N127 PolarHBondContact O-N 2.81Å; K123-N127 PolarHBondContact O-ND2 3.32Å
124	A	88.9	Confident	83.9	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66	-39	172.7	0	0	0	0	0	112.2	V92 V120 L121 N128 D129 T132 V133 L136	V92-A124 HydrophobicContact CG1-CB 3.8Å; V120-A124 WeakPolarHBondContact O-CB 3.46Å; V120-A124 PolarHBondContact O-N 3.13Å; V120-A124 VanDerWaalsContact O-N 3.14Å; L121-A124 WeakPolarHBondContact O-CB 3.31Å; L121-A124 PolarHBondContact O-N 3.12Å; A124-N128 PolarHBondContact O-N 3.33Å; A124-D129 PolarHBondContact O-N 3.26Å; A124-T132 WeakPolarHBondContact CB-OG1 3.35Å; A124-V133 HydrophobicContact CB-CG2 3.76Å; A124-L136 HydrophobicContact CB-CD1 4.38Å
125	V	88.7	Confident	84.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-52.2	172.7	172.5	0	0	0	0	110.7	L121 Q122 N127 N128 V133 A154 A158 L161 I169 L173	L121-V125 WeakPolarHBondContact O-CG2 3.32Å; L121-V125 PolarHBondContact O-N 3.13Å; Q122-V125 PolarHBondContact O-N 2.85Å; V125-N127 VanDerWaalsContact C-N 3.28Å; V125-N127 PolarHBondContact O-N 3.35Å; V125-N128 WeakPolarHBondContact O-CA 3.3Å; V125-N128 PolarHBondContact O-N 3.06Å; V125-V133 HydrophobicContact CG2-CG2 3.85Å; V125-A154 HydrophobicContact CG2-CB 4.36Å; V125-A158 HydrophobicContact CG1-CB 3.96Å; V125-L161 HydrophobicContact CG1-CD1 3.77Å; V125-L161 WeakPolarHBondContact O-CD1 3.26Å; V125-I169 HydrophobicContact CB-CG2 4.45Å; V125-I169 HydrophobicContact CG1-CG2 4.08Å; V125-I169 HydrophobicContact CG2-CG2 3.83Å; V125-L173 HydrophobicContact CG2-CD1 4.25Å
126	M	83.3	Confident	85.3	Confident	58 Å²	58	28 Å²	28	29%	0.286	14%	0.137	S	C	.	.	H	α-helix	trans	-56.8	-39.4	178.4	-71.6	174	67.9	0	0	112.9	Q122 N128 Y157 T207	Q122-M126 VanDerWaalsContact O-CG 3.31Å; Q122-M126 WeakPolarHBondContact O-CG 3.43Å; Q122-M126 PolarHBondContact O-N 3.46Å; M126-N128 PolarHBondContact O-N 2.77Å; M126-Y157 HydrophobicContact CE-CE1 4.49Å; M126-Y157 HydrophobicContact CG-CD1 3.68Å; M126-Y157 HydrophobicContact CG-CE1 4.16Å; M126-Y157 HydrophobicContact CG-CG 4.2Å; M126-Y157 HydrophobicContact SD-CD1 3.92Å; M126-Y157 HydrophobicContact SD-CE1 3.74Å; M126-T207 HydrophobicContact CE-CG2 4.16Å
127	N	81.3	Confident	86.4	Confident	47 Å²	47	22.5 Å²	22.5	25%	0.251	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-1	176.5	-66.7	-9.1	0	0	0	113.4	V92 E93 K95 K123 V125 D129	V92-N127 PolarHBondContact O-ND2 3.41Å; V92-N127 VanDerWaalsContact O-ND2 3.17Å; E93-N127 WeakPolarHBondContact CA-ND2 3.3Å; K95-N127 WeakPolarHBondContact CE-O 3.19Å; K95-N127 PolarHBondContact NZ-O 2.95Å; K123-N127 WeakPolarHBondContact O-CB 3.49Å; K123-N127 PolarHBondContact O-N 2.81Å; K123-N127 PolarHBondContact O-ND2 3.32Å; V125-N127 VanDerWaalsContact C-N 3.28Å; V125-N127 PolarHBondContact O-N 3.35Å; N127-D129 VanDerWaalsContact C-N 3.33Å; N127-D129 PolarHBondContact O-N 3.35Å
128	N	84	Confident	87.1	Confident	34 Å²	34	28.2 Å²	28.2	18%	0.182	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	44.7	-178.4	-144.3	4.3	0	0	0	112	A124 V125 M126 S163 Q165 G166 I169	A124-N128 PolarHBondContact O-N 3.33Å; V125-N128 WeakPolarHBondContact O-CA 3.3Å; V125-N128 PolarHBondContact O-N 3.06Å; M126-N128 PolarHBondContact O-N 2.77Å; N128-S163 PolarHBondContact ND2-OG 2.92Å; N128-Q165 PolarHBondContact O-OE1 3.34Å; N128-Q165 WeakPolarHBondContact OD1-CB 3.15Å; N128-G166 PolarHBondContact OD1-N 3.24Å; N128-I169 WeakPolarHBondContact OD1-CD1 3.48Å
129	D	85.3	Confident	87.3	Confident	13 Å²	13	31.4 Å²	31.4	7%	0.07	16%	0.155	C	C	.	.			trans	-106.1	83.1	-179.4	-178.3	8	0	0	0	111.2	K95 A124 N127 N131 T132 V133	K95-D129 HydrophobicContact CD-CB 4.27Å; K95-D129 HydrophobicContact CG-CB 4.34Å; A124-D129 PolarHBondContact O-N 3.26Å; N127-D129 VanDerWaalsContact C-N 3.33Å; N127-D129 PolarHBondContact O-N 3.35Å; D129-N131 PolarHBondContact O-N 3.23Å; D129-N131 PolarHBondContact OD1-N 2.73Å; D129-T132 WeakPolarHBondContact CB-OG1 3.08Å; D129-T132 PolarHBondContact O-N 2.68Å; D129-T132 PolarHBondContact O-OG1 3.47Å; D129-T132 PolarHBondContact OD1-N 3.47Å; D129-T132 WeakPolarHBondContact OD2-CB 3.5Å; D129-T132 WeakPolarHBondContact OD2-CG2 3.47Å; D129-T132 PolarHBondContact OD2-OG1 2.95Å; D129-V133 WeakPolarHBondContact O-CG2 3.24Å; D129-V133 PolarHBondContact O-N 2.86Å; D129-V133 VanDerWaalsContact O-N 3.11Å
130	F	87.5	Confident	87.4	Confident	71 Å²	71	31.7 Å²	31.7	31%	0.311	16%	0.157	S	C	.	.	H	α-helix	trans	-53.2	-35.9	178.2	-176.1	-103.3	0	0	0	112.9	V133 V134 K168 I169 F172	F130-V133 PolarHBondContact O-N 2.96Å; F130-V134 HydrophobicContact CD1-CG2 3.99Å; F130-V134 HydrophobicContact CD2-CG2 4.26Å; F130-V134 HydrophobicContact CE1-CG2 3.63Å; F130-V134 HydrophobicContact CE2-CG2 3.92Å; F130-V134 HydrophobicContact CG-CG2 4.29Å; F130-V134 HydrophobicContact CZ-CG2 3.59Å; F130-V134 WeakPolarHBondContact O-CB 3.27Å; F130-V134 VanDerWaalsContact O-CG2 3.26Å; F130-V134 WeakPolarHBondContact O-CG2 3.34Å; F130-V134 PolarHBondContact O-N 3.05Å; F130-K168 HydrophobicContact CD2-CB 4.37Å; F130-K168 HydrophobicContact CE2-CB 4.16Å; F130-I169 HydrophobicContact CB-CG1 4.33Å; F130-I169 HydrophobicContact CD2-CG1 3.82Å; F130-F172 HydrophobicContact CE2-CB 4.14Å; F130-F172 HydrophobicContact CE2-CG 4.33Å; F130-F172 HydrophobicContact CZ-CD2 4.49Å
131	N	88.8	Confident	87.1	Confident	109 Å²	109	36 Å²	36	58%	0.583	18%	0.184	S	C	*	.	H	α-helix	trans	-71.3	-39.2	-175.5	-71.3	-43.1	0	0	0	112.7	L97 D129 W135	L97-N131 HydrophobicContact CD2-CB 4.46Å; D129-N131 PolarHBondContact O-N 3.23Å; D129-N131 PolarHBondContact OD1-N 2.73Å; N131-W135 WeakPolarHBondContact O-CB 3.3Å; N131-W135 PolarHBondContact O-N 2.94Å; N131-W135 VanDerWaalsContact O-N 3.17Å
132	T	87.5	Confident	86.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-73.8	-35.5	173.3	53.3	0	0	0	0	111.9	L97 L100 A124 D129 W135 L136	L97-T132 HydrophobicContact CB-CG2 4.12Å; L97-T132 HydrophobicContact CD1-CG2 3.71Å; L97-T132 HydrophobicContact CG-CG2 4.47Å; L100-T132 HydrophobicContact CD2-CG2 3.81Å; A124-T132 WeakPolarHBondContact CB-OG1 3.35Å; D129-T132 WeakPolarHBondContact CB-OG1 3.08Å; D129-T132 PolarHBondContact O-N 2.68Å; D129-T132 PolarHBondContact O-OG1 3.47Å; D129-T132 PolarHBondContact OD1-N 3.47Å; D129-T132 WeakPolarHBondContact OD2-CB 3.5Å; D129-T132 WeakPolarHBondContact OD2-CG2 3.47Å; D129-T132 PolarHBondContact OD2-OG1 2.95Å; T132-W135 PolarHBondContact O-N 2.94Å; T132-L136 VanDerWaalsContact O-CB 3.31Å; T132-L136 WeakPolarHBondContact O-CB 3.37Å; T132-L136 VanDerWaalsContact O-CG 3.25Å; T132-L136 WeakPolarHBondContact O-CG 3.41Å; T132-L136 PolarHBondContact O-N 2.92Å
133	V	88.9	Confident	86.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-54.2	172.6	171.4	0	0	0	0	111.2	L121 A124 V125 D129 F130 W135 L136 L137 I169	L121-V133 HydrophobicContact CD1-CB 4.5Å; L121-V133 HydrophobicContact CD1-CG1 4.16Å; L121-V133 HydrophobicContact CD1-CG2 4.32Å; A124-V133 HydrophobicContact CB-CG2 3.76Å; V125-V133 HydrophobicContact CG2-CG2 3.85Å; D129-V133 WeakPolarHBondContact O-CG2 3.24Å; D129-V133 PolarHBondContact O-N 2.86Å; D129-V133 VanDerWaalsContact O-N 3.11Å; F130-V133 PolarHBondContact O-N 2.96Å; V133-W135 VanDerWaalsContact C-N 3.31Å; V133-W135 PolarHBondContact O-N 3.13Å; V133-L136 PolarHBondContact O-N 3.39Å; V133-L137 HydrophobicContact CG1-CD1 3.79Å; V133-L137 HydrophobicContact CG1-CG 4.46Å; V133-L137 WeakPolarHBondContact O-CB 3.42Å; V133-L137 WeakPolarHBondContact O-CG 3.35Å; V133-L137 PolarHBondContact O-N 3.48Å; V133-I169 HydrophobicContact CG1-CG2 4.47Å
134	V	89.9	Confident	86.6	Confident	31 Å²	31	45.4 Å²	45.4	19%	0.188	22%	0.22	C	C	.	.	H	α-helix	trans	-57.7	-43.5	178.3	170.4	0	0	0	0	111.3	F130 N138 F172	F130-V134 HydrophobicContact CD1-CG2 3.99Å; F130-V134 HydrophobicContact CD2-CG2 4.26Å; F130-V134 HydrophobicContact CE1-CG2 3.63Å; F130-V134 HydrophobicContact CE2-CG2 3.92Å; F130-V134 HydrophobicContact CG-CG2 4.29Å; F130-V134 HydrophobicContact CZ-CG2 3.59Å; F130-V134 WeakPolarHBondContact O-CB 3.27Å; F130-V134 VanDerWaalsContact O-CG2 3.26Å; F130-V134 WeakPolarHBondContact O-CG2 3.34Å; F130-V134 PolarHBondContact O-N 3.05Å; V134-N138 VanDerWaalsContact O-CB 3.3Å; V134-N138 WeakPolarHBondContact O-CB 3.44Å; V134-N138 VanDerWaalsContact O-CG 3.29Å; V134-N138 PolarHBondContact O-N 2.97Å; V134-N138 PolarHBondContact O-ND2 2.75Å; V134-F172 HydrophobicContact CB-CE1 4.27Å; V134-F172 HydrophobicContact CB-CZ 4.23Å; V134-F172 HydrophobicContact CG1-CZ 4.04Å; V134-F172 HydrophobicContact CG2-CD1 4.1Å; V134-F172 HydrophobicContact CG2-CD2 4.33Å; V134-F172 HydrophobicContact CG2-CE1 3.83Å; V134-F172 HydrophobicContact CG2-CE2 4.06Å; V134-F172 HydrophobicContact CG2-CG 4.36Å; V134-F172 HydrophobicContact CG2-CZ 3.81Å
135	W	90.3	Very high	86.5	Confident	49 Å²	49	47.9 Å²	47.9	19%	0.186	23%	0.233	C	C	.	.	H	α-helix	trans	-67.5	-40.9	179.1	-178.3	79.4	0	0	0	113.4	L97 L100 K101 V104 N131 T132 V133 K139	L97-W135 HydrophobicContact CD1-CB 3.94Å; L97-W135 HydrophobicContact CD1-CD2 4.15Å; L97-W135 HydrophobicContact CD1-CE3 4.33Å; L97-W135 HydrophobicContact CD1-CG 3.97Å; L100-W135 HydrophobicContact CD2-CE3 3.99Å; L100-W135 HydrophobicContact CD2-CZ3 3.93Å; L100-W135 HydrophobicContact CG-CZ3 4.21Å; K101-W135 HydrophobicContact CB-CH2 4.5Å; K101-W135 HydrophobicContact CB-CZ2 4.14Å; K101-W135 HydrophobicContact CG-CD2 4.15Å; K101-W135 HydrophobicContact CG-CH2 4.07Å; K101-W135 HydrophobicContact CG-CZ2 3.45Å; K101-W135 VanDerWaalsContact CG-CZ2 3.45Å; V104-W135 HydrophobicContact CB-CH2 4.19Å; V104-W135 HydrophobicContact CB-CZ3 4.36Å; N131-W135 WeakPolarHBondContact O-CB 3.3Å; N131-W135 PolarHBondContact O-N 2.94Å; N131-W135 VanDerWaalsContact O-N 3.17Å; T132-W135 PolarHBondContact O-N 2.94Å; V133-W135 VanDerWaalsContact C-N 3.31Å; V133-W135 PolarHBondContact O-N 3.13Å; W135-K139 HydrophobicContact CH2-CD 3.79Å; W135-K139 HydrophobicContact CZ2-CD 3.38Å; W135-K139 VanDerWaalsContact O-CB 3.29Å; W135-K139 WeakPolarHBondContact O-CB 3.39Å; W135-K139 PolarHBondContact O-N 3.11Å
136	L	88.6	Confident	86.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-44.4	177.9	-78.2	169.2	0	0	0	111.2	L100 V120 L121 A124 T132 V133 K139 F140	L100-L136 HydrophobicContact CD2-CD2 4.5Å; L100-L136 HydrophobicContact CD2-CG 4.49Å; V120-L136 HydrophobicContact CG1-CD1 4.03Å; V120-L136 HydrophobicContact CG1-CD2 4.41Å; L121-L136 HydrophobicContact CD1-CB 4.42Å; L121-L136 HydrophobicContact CD1-CD1 4.42Å; A124-L136 HydrophobicContact CB-CD1 4.38Å; T132-L136 VanDerWaalsContact O-CB 3.31Å; T132-L136 WeakPolarHBondContact O-CB 3.37Å; T132-L136 VanDerWaalsContact O-CG 3.25Å; T132-L136 WeakPolarHBondContact O-CG 3.41Å; T132-L136 PolarHBondContact O-N 2.92Å; V133-L136 PolarHBondContact O-N 3.39Å; L136-K139 PolarHBondContact O-N 2.75Å; L136-F140 HydrophobicContact CD2-CD2 4.39Å; L136-F140 WeakPolarHBondContact O-CA 3.33Å; L136-F140 WeakPolarHBondContact O-CB 3.42Å; L136-F140 PolarHBondContact O-N 2.81Å
137	L	88.3	Confident	86.5	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-70.2	-46.4	-178.2	-67.4	178.7	0	0	0	112.3	L121 V133 K139 F140 V144 F172 L173 A176	L121-L137 HydrophobicContact CD1-CD2 4.1Å; L121-L137 HydrophobicContact CD1-CG 4.12Å; L121-L137 HydrophobicContact CD2-CD2 3.78Å; V133-L137 HydrophobicContact CG1-CD1 3.79Å; V133-L137 HydrophobicContact CG1-CG 4.46Å; V133-L137 WeakPolarHBondContact O-CB 3.42Å; V133-L137 WeakPolarHBondContact O-CG 3.35Å; V133-L137 PolarHBondContact O-N 3.48Å; L137-K139 PolarHBondContact O-N 3Å; L137-F140 CarbonylContact O-C 3.51Å; L137-F140 PolarHBondContact O-N 3.35Å; L137-V144 HydrophobicContact CD2-CB 4.44Å; L137-V144 HydrophobicContact CD2-CG2 3.44Å; L137-V144 VanDerWaalsContact CD2-CG2 3.44Å; L137-F172 HydrophobicContact CB-CE1 4.15Å; L137-F172 HydrophobicContact CD1-CD1 3.82Å; L137-F172 HydrophobicContact CD1-CE1 3.78Å; L137-L173 HydrophobicContact CD1-CD2 3.78Å; L137-A176 HydrophobicContact CD1-CB 4.14Å
138	N	87.8	Confident	86.5	Confident	121 Å²	121	47.7 Å²	47.7	65%	0.647	23%	0.232	S	C	*	.	H	α-helix	trans	-60.6	-30.2	176.4	-76.2	-16.4	0	0	0	113	V134	V134-N138 VanDerWaalsContact O-CB 3.3Å; V134-N138 WeakPolarHBondContact O-CB 3.44Å; V134-N138 VanDerWaalsContact O-CG 3.29Å; V134-N138 PolarHBondContact O-N 2.97Å; V134-N138 PolarHBondContact O-ND2 2.75Å
139	K	86.5	Confident	86	Confident	85 Å²	85	49.9 Å²	49.9	37%	0.37	24%	0.244	S	C	.	.	H	α-helix	trans	-92.3	-30.5	179.8	-165.6	178	177.4	-168	0	113.4	V104 W135 L136 L137	V104-K139 PolarHBondContact O-NZ 3.02Å; W135-K139 HydrophobicContact CH2-CD 3.79Å; W135-K139 HydrophobicContact CZ2-CD 3.38Å; W135-K139 VanDerWaalsContact O-CB 3.29Å; W135-K139 WeakPolarHBondContact O-CB 3.39Å; W135-K139 PolarHBondContact O-N 3.11Å; L136-K139 PolarHBondContact O-N 2.75Å; L137-K139 PolarHBondContact O-N 3Å
140	F	85.9	Confident	85.4	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.035	25%	0.253	C	S	.	.			trans	-140.7	71.9	-172.9	-50.9	-65.2	0	0	0	111.8	V104 N107 A110 L136 L137 R142 V143	V104-F140 HydrophobicContact CG1-CD2 4.47Å; V104-F140 HydrophobicContact CG1-CE2 3.51Å; V104-F140 HydrophobicContact CG1-CZ 3.9Å; N107-F140 HydrophobicContact CB-CD1 4.06Å; N107-F140 HydrophobicContact CB-CE1 4.26Å; N107-F140 WeakPolarHBondContact OD1-CE1 3.46Å; A110-F140 HydrophobicContact CB-CB 4.44Å; A110-F140 HydrophobicContact CB-CD2 3.68Å; A110-F140 HydrophobicContact CB-CE2 4.02Å; A110-F140 HydrophobicContact CB-CG 4.06Å; L136-F140 HydrophobicContact CD2-CD2 4.39Å; L136-F140 WeakPolarHBondContact O-CA 3.33Å; L136-F140 WeakPolarHBondContact O-CB 3.42Å; L136-F140 PolarHBondContact O-N 2.81Å; L137-F140 CarbonylContact O-C 3.51Å; L137-F140 PolarHBondContact O-N 3.35Å; F140-R142 PolarHBondContact O-N 3.19Å; F140-V143 HydrophobicContact CB-CG2 3.69Å; F140-V143 WeakPolarHBondContact O-CG2 3.48Å; F140-V143 PolarHBondContact O-N 3.19Å; F140-V143 VanDerWaalsContact O-N 3.1Å
141	P	84.2	Confident	85.2	Confident	89 Å²	89	53.8 Å²	53.8	58%	0.578	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-61.4	-18.3	-176.9	22.7	-34.2	0	0	0	114.3	V143 V144	P141-V143 PolarHBondContact O-N 2.87Å; P141-V144 VanDerWaalsContact O-CG2 3.31Å; P141-V144 WeakPolarHBondContact O-CG2 3.29Å
142	R	82	Confident	85	Confident	223 Å²	223	49.5 Å²	49.5	84%	0.842	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-71.5	-1.7	175.4	-66.9	-171.6	178.6	-171.8	-2.4	115	F140	F140-R142 PolarHBondContact O-N 3.19Å
143	V	84.9	Confident	84.9	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.024	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-90.3	-15.9	-176.9	-172.5	0	0	0	0	112.3	A110 L111 L121 F140 P141 D145 V146	A110-V143 HydrophobicContact CB-CG2 4Å; L111-V143 HydrophobicContact CD2-CB 4.48Å; L111-V143 HydrophobicContact CD2-CG2 3.93Å; L121-V143 HydrophobicContact CB-CG1 3.69Å; L121-V143 HydrophobicContact CD2-CB 4.41Å; L121-V143 HydrophobicContact CD2-CG1 3.99Å; L121-V143 WeakPolarHBondContact CD2-O 3.41Å; L121-V143 HydrophobicContact CG-CG1 4.47Å; F140-V143 HydrophobicContact CB-CG2 3.69Å; F140-V143 WeakPolarHBondContact O-CG2 3.48Å; F140-V143 PolarHBondContact O-N 3.19Å; F140-V143 VanDerWaalsContact O-N 3.1Å; P141-V143 PolarHBondContact O-N 2.87Å; V143-D145 PolarHBondContact O-N 3.26Å; V143-V146 HydrophobicContact CG1-CG2 4.48Å; V143-V146 WeakPolarHBondContact O-CG2 3.29Å; V143-V146 PolarHBondContact O-N 3.44Å
144	V	86.2	Confident	84.9	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.03	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-55.1	-173.7	-178.5	0	0	0	0	113.1	L137 P141 V146 L173 A176 A178	L137-V144 HydrophobicContact CD2-CB 4.44Å; L137-V144 HydrophobicContact CD2-CG2 3.44Å; L137-V144 VanDerWaalsContact CD2-CG2 3.44Å; P141-V144 VanDerWaalsContact O-CG2 3.31Å; P141-V144 WeakPolarHBondContact O-CG2 3.29Å; V144-V146 VanDerWaalsContact C-N 3.34Å; V144-V146 PolarHBondContact O-N 3.11Å; V144-L173 HydrophobicContact CG1-CD2 4.46Å; V144-A176 HydrophobicContact CG2-CB 4.33Å; V144-A178 HydrophobicContact CG1-CB 3.39Å
145	D	86.9	Confident	84.9	Confident	51 Å²	51	48.2 Å²	48.2	27%	0.273	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	14.8	-171.5	-67.2	-29.4	0	0	0	114.2	V143 Q147 N179 I182	V143-D145 PolarHBondContact O-N 3.26Å; D145-Q147 PolarHBondContact O-N 3.41Å; D145-N179 PolarHBondContact OD1-N 2.99Å; D145-N179 PolarHBondContact OD2-ND2 2.79Å; D145-I182 HydrophobicContact CB-CD1 3.82Å
146	V	86	Confident	84.7	Confident	29 Å²	29	45.9 Å²	45.9	18%	0.176	22%	0.221	C	C	.	.			trans	-71.8	122.4	-177.9	-173.1	0	0	0	0	109.9	L111 T119 Q122 V143 V144	L111-V146 HydrophobicContact CD2-CG2 3.55Å; T119-V146 HydrophobicContact CG2-CB 4.09Å; T119-V146 HydrophobicContact CG2-CG1 3.52Å; Q122-V146 PolarHBondContact NE2-O 3.21Å; V143-V146 HydrophobicContact CG1-CG2 4.48Å; V143-V146 WeakPolarHBondContact O-CG2 3.29Å; V143-V146 PolarHBondContact O-N 3.44Å; V144-V146 VanDerWaalsContact C-N 3.34Å; V144-V146 PolarHBondContact O-N 3.11Å
147	Q	86.2	Confident	84.5	Confident	64 Å²	64	47 Å²	47	30%	0.299	23%	0.226	S	C	.	.			trans	-79.1	151.8	179	-66.8	-179.3	1.3	0	0	112.4	R113 D145 K151 R152 T153 I182	R113-Q147 VanDerWaalsContact CZ-O 3.31Å; R113-Q147 PolarHBondContact NE-O 3.48Å; R113-Q147 PolarHBondContact NH2-O 3.22Å; D145-Q147 PolarHBondContact O-N 3.41Å; Q147-K151 WeakPolarHBondContact CG-O 3.48Å; Q147-R152 CarbonylContact C-O 3.52Å; Q147-R152 VanDerWaalsContact CA-O 3.26Å; Q147-R152 WeakPolarHBondContact CA-O 3.31Å; Q147-T153 HydrophobicContact CG-CG2 4.12Å; Q147-I182 HydrophobicContact CG-CG2 4.23Å
148	D	81.9	Confident	84.4	Confident	9 Å²	9	46.8 Å²	46.8	5%	0.048	23%	0.225	C	C	.	.			trans	-82.3	-164.7	166.7	82.6	-30.7	0	0	0	111.9	N150 K151 R152	D148-N150 VanDerWaalsContact C-N 3.28Å; D148-N150 PolarHBondContact O-N 3.07Å; D148-N150 VanDerWaalsContact OD1-CA 3.26Å; D148-N150 WeakPolarHBondContact OD1-CA 3.33Å; D148-N150 PolarHBondContact OD1-N 3.41Å; D148-N150 WeakPolarHBondContact OD2-CB 3.44Å; D148-N150 PolarHBondContact OD2-N 3.39Å; D148-N150 PolarHBondContact OD2-ND2 2.94Å; D148-K151 PolarHBondContact O-N 3.27Å; D148-K151 PolarHBondContact OD1-N 2.87Å; D148-R152 PolarHBondContact N-O 3.02Å; D148-R152 WeakPolarHBondContact OD1-CB 3.35Å; D148-R152 PolarHBondContact OD1-N 3.43Å
149	N	72.6	Confident	84.2	Confident	80 Å²	80	41.6 Å²	41.6	43%	0.428	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.4	173.5	-74.3	-18.9	0	0	0	114	F116 G117	F116-N149 PolarHBondContact O-ND2 3.49Å; F116-N149 VanDerWaalsContact O-ND2 3.17Å; G117-N149 WeakPolarHBondContact CA-ND2 3.34Å
150	N	73.7	Confident	83.8	Confident	49 Å²	49	37.9 Å²	37.9	26%	0.262	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	17.1	174.7	-53.7	-59.9	0	0	0	112.6	D148 R152 R185	D148-N150 VanDerWaalsContact C-N 3.28Å; D148-N150 PolarHBondContact O-N 3.07Å; D148-N150 VanDerWaalsContact OD1-CA 3.26Å; D148-N150 WeakPolarHBondContact OD1-CA 3.33Å; D148-N150 PolarHBondContact OD1-N 3.41Å; D148-N150 WeakPolarHBondContact OD2-CB 3.44Å; D148-N150 PolarHBondContact OD2-N 3.39Å; D148-N150 PolarHBondContact OD2-ND2 2.94Å; N150-R152 HydrophobicContact CB-CG 4.26Å; N150-R152 PolarHBondContact O-N 3.01Å; N150-R185 HydrophobicContact CB-CB 4.5Å; N150-R185 VanDerWaalsContact O-CB 3.32Å; N150-R185 WeakPolarHBondContact O-CB 3.44Å; N150-R185 PolarHBondContact O-N 3.24Å
151	K	82.1	Confident	83.3	Confident	117 Å²	117	38.9 Å²	38.9	51%	0.509	19%	0.189	S	C	.	.	S	Bend	trans	64.2	9.2	-176.2	-60.1	-175.5	176	-179.5	0	116.2	Q147 D148	Q147-K151 WeakPolarHBondContact CG-O 3.48Å; D148-K151 PolarHBondContact O-N 3.27Å; D148-K151 PolarHBondContact OD1-N 2.87Å
152	R	84.3	Confident	82.4	Confident	19 Å²	19	40.6 Å²	40.6	7%	0.072	20%	0.203	C	C	.	.			trans	-78.2	136.3	-179.5	-62.6	177.6	177.9	155.2	6	111	Q122 Q147 D148 N150 H156 Y157 D184 D186 Y193 L203	Q122-R152 PolarHBondContact NE2-O 3.14Å; Q147-R152 CarbonylContact C-O 3.52Å; Q147-R152 VanDerWaalsContact CA-O 3.26Å; Q147-R152 WeakPolarHBondContact CA-O 3.31Å; D148-R152 PolarHBondContact N-O 3.02Å; D148-R152 WeakPolarHBondContact OD1-CB 3.35Å; D148-R152 PolarHBondContact OD1-N 3.43Å; N150-R152 HydrophobicContact CB-CG 4.26Å; N150-R152 PolarHBondContact O-N 3.01Å; R152-H156 HydrophobicContact CB-CB 4.13Å; R152-Y157 HydrophobicContact CB-CE2 4.18Å; R152-D184 HydrophobicContact CG-CB 3.54Å; R152-D184 IonicContact CZ-OD2 3.6Å; R152-D184 VanDerWaalsContact CZ-OD2 3.29Å; R152-D184 IonicContact NE-OD2 3.45Å; R152-D184 PolarHBondContact NE-OD2 3.39Å; R152-D184 IonicContact NH2-OD2 3.67Å; R152-D184 PolarHBondContact NH2-OD2 3.28Å; R152-D186 IonicContact NH2-OD2 2.73Å; R152-D186 PolarHBondContact NH2-OD2 3.35Å; R152-D186 VanDerWaalsContact NH2-OD2 3.08Å; R152-Y193 PolarHBondContact NH2-OH 2.98Å; R152-L203 VanDerWaalsContact NH1-CD2 3.34Å
153	T	86.9	Confident	81.8	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	18%	0.176	C	C	.	.			trans	-92.5	171.5	174.8	61.9	0	0	0	0	111.8	Q147 L155 H156 Y157 I182	Q147-T153 HydrophobicContact CG-CG2 4.12Å; T153-L155 PolarHBondContact O-N 2.95Å; T153-H156 PolarHBondContact N-ND1 3.13Å; T153-H156 WeakPolarHBondContact O-CB 3.48Å; T153-H156 PolarHBondContact O-N 3.42Å; T153-H156 VanDerWaalsContact O-N 3.12Å; T153-H156 PolarHBondContact OG1-ND1 2.89Å; T153-Y157 WeakPolarHBondContact O-CD2 3.38Å; T153-I182 HydrophobicContact CG2-CB 3.99Å; T153-I182 HydrophobicContact CG2-CD1 3.72Å; T153-I182 HydrophobicContact CG2-CG1 4.46Å; T153-I182 HydrophobicContact CG2-CG2 3.6Å
154	A	88.2	Confident	81.3	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-55.9	-31.8	172.7	0	0	0	0	0	113.1	L121 Q122 V125 H156 Y157 A158 L173	L121-A154 HydrophobicContact CD2-CB 3.86Å; L121-A154 HydrophobicContact CG-CB 3.99Å; Q122-A154 HydrophobicContact CG-CB 4.22Å; V125-A154 HydrophobicContact CG2-CB 4.36Å; A154-H156 VanDerWaalsContact C-N 3.34Å; A154-H156 PolarHBondContact O-N 3.33Å; A154-Y157 PolarHBondContact O-N 3.01Å; A154-A158 PolarHBondContact O-N 3.37Å; A154-L173 HydrophobicContact CB-CD1 4.32Å; A154-L173 HydrophobicContact CB-CD2 4.25Å
155	L	89.1	Confident	80.7	Confident	1 Å²	1	44 Å²	44	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-32.6	178	-163.9	67	0	0	0	112.9	T153 Y157 A158 A159 Y170 L173 L174 A178 L180 P190	T153-L155 PolarHBondContact O-N 2.95Å; L155-Y157 VanDerWaalsContact C-N 3.34Å; L155-A158 PolarHBondContact O-N 3.22Å; L155-A159 WeakPolarHBondContact O-CB 3.45Å; L155-A159 PolarHBondContact O-N 2.76Å; L155-Y170 HydrophobicContact CD1-CD2 3.56Å; L155-Y170 HydrophobicContact CD1-CE2 3.44Å; L155-Y170 VanDerWaalsContact CD1-CE2 3.44Å; L155-Y170 HydrophobicContact CD1-CG 4.27Å; L155-Y170 HydrophobicContact CG-CD2 4.24Å; L155-Y170 HydrophobicContact CG-CE2 3.72Å; L155-L173 HydrophobicContact CD1-CB 3.82Å; L155-L173 HydrophobicContact CD1-CD1 4.37Å; L155-L174 HydrophobicContact CD1-CD2 4.23Å; L155-L174 HydrophobicContact CD1-CG 4.31Å; L155-L174 HydrophobicContact CD2-CD2 4.01Å; L155-A178 HydrophobicContact CB-CB 4.42Å; L155-A178 HydrophobicContact CD1-CB 4.31Å; L155-A178 HydrophobicContact CD2-CB 4Å; L155-A178 HydrophobicContact CG-CB 4.49Å; L155-L180 HydrophobicContact CD2-CD2 3.89Å; L155-L180 HydrophobicContact CD2-CG 4.17Å; L155-P190 HydrophobicContact CB-CB 4.39Å; L155-P190 HydrophobicContact CB-CG 4.28Å; L155-P190 HydrophobicContact CD2-CB 4.04Å; L155-P190 HydrophobicContact CD2-CG 3.99Å; L155-P190 HydrophobicContact CG-CB 3.97Å; L155-P190 HydrophobicContact CG-CG 4.22Å
156	H	87.6	Confident	80.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.4	-36.3	174.1	-68.5	79.4	0	0	0	112.2	R152 T153 A154 V160 I182 R188 Y193	R152-H156 HydrophobicContact CB-CB 4.13Å; T153-H156 PolarHBondContact N-ND1 3.13Å; T153-H156 WeakPolarHBondContact O-CB 3.48Å; T153-H156 PolarHBondContact O-N 3.42Å; T153-H156 VanDerWaalsContact O-N 3.12Å; T153-H156 PolarHBondContact OG1-ND1 2.89Å; A154-H156 VanDerWaalsContact C-N 3.34Å; A154-H156 PolarHBondContact O-N 3.33Å; H156-V160 VanDerWaalsContact O-CG2 3.23Å; H156-V160 WeakPolarHBondContact O-CG2 3.37Å; H156-I182 PolarHBondContact CE1-O 3.49Å; H156-I182 PolarHBondContact NE2-O 3.22Å; H156-R188 PolarHBondContact NE2-O 3.26Å; H156-Y193 AromaticContact CD2-CD2 3.87Å; H156-Y193 AromaticContact CD2-CE2 3.76Å
157	Y	83.2	Confident	79.9	Confident	23 Å²	23	44.7 Å²	44.7	9%	0.09	24%	0.235	C	C	.	.	H	α-helix	trans	-75	-36.6	175.2	-69.8	-83.6	0	0	0	111.6	Q122 M126 R152 T153 A154 L155 V160 L161 L203	Q122-Y157 HydrophobicContact CB-CD2 4.24Å; Q122-Y157 HydrophobicContact CB-CE2 4.27Å; Q122-Y157 HydrophobicContact CG-CD2 3.92Å; Q122-Y157 HydrophobicContact CG-CE2 3.97Å; M126-Y157 HydrophobicContact CE-CE1 4.49Å; M126-Y157 HydrophobicContact CG-CD1 3.68Å; M126-Y157 HydrophobicContact CG-CE1 4.16Å; M126-Y157 HydrophobicContact CG-CG 4.2Å; M126-Y157 HydrophobicContact SD-CD1 3.92Å; M126-Y157 HydrophobicContact SD-CE1 3.74Å; R152-Y157 HydrophobicContact CB-CE2 4.18Å; T153-Y157 WeakPolarHBondContact O-CD2 3.38Å; A154-Y157 PolarHBondContact O-N 3.01Å; L155-Y157 VanDerWaalsContact C-N 3.34Å; Y157-V160 PolarHBondContact O-N 3.4Å; Y157-L161 WeakPolarHBondContact O-CG 3.49Å; Y157-L203 HydrophobicContact CD1-CD2 4.37Å; Y157-L203 HydrophobicContact CE1-CD2 3.89Å
158	A	86.1	Confident	79.8	Confident	3 Å²	3	48.1 Å²	48.1	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-37.5	177.7	0	0	0	0	0	112.6	V125 A154 L155 V160 L161 I169 Y170 L173	V125-A158 HydrophobicContact CG1-CB 3.96Å; A154-A158 PolarHBondContact O-N 3.37Å; L155-A158 PolarHBondContact O-N 3.22Å; A158-V160 PolarHBondContact O-N 2.82Å; A158-V160 VanDerWaalsContact O-N 3.09Å; A158-L161 PolarHBondContact O-N 3.42Å; A158-I169 HydrophobicContact CB-CG2 4.08Å; A158-Y170 HydrophobicContact CB-CD2 3.92Å; A158-L173 HydrophobicContact CB-CD1 3.67Å
159	A	84.3	Confident	80	Confident	13 Å²	13	47.7 Å²	47.7	11%	0.107	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-17	175.5	0	0	0	0	0	114.8	L155 Y170 P190 L194	L155-A159 WeakPolarHBondContact O-CB 3.45Å; L155-A159 PolarHBondContact O-N 2.76Å; A159-Y170 HydrophobicContact CB-CD2 4.27Å; A159-Y170 HydrophobicContact CB-CE2 3.95Å; A159-P190 WeakPolarHBondContact CB-O 3.28Å; A159-L194 HydrophobicContact CB-CG 4.03Å
160	V	78	Confident	80.7	Confident	6 Å²	6	44.9 Å²	44.9	4%	0.036	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-10.7	-169	169.6	0	0	0	0	111.4	H156 Y157 A158 S162 Y193 V200 L203 I204	H156-V160 VanDerWaalsContact O-CG2 3.23Å; H156-V160 WeakPolarHBondContact O-CG2 3.37Å; Y157-V160 PolarHBondContact O-N 3.4Å; A158-V160 PolarHBondContact O-N 2.82Å; A158-V160 VanDerWaalsContact O-N 3.09Å; V160-S162 PolarHBondContact O-N 2.91Å; V160-Y193 HydrophobicContact CG2-CD1 3.97Å; V160-Y193 HydrophobicContact CG2-CG 4.18Å; V160-V200 HydrophobicContact CB-CG2 4.5Å; V160-V200 HydrophobicContact CG1-CB 4.09Å; V160-V200 HydrophobicContact CG1-CG1 3.71Å; V160-V200 HydrophobicContact CG1-CG2 4.01Å; V160-V200 HydrophobicContact CG2-CG2 4.43Å; V160-L203 HydrophobicContact CG1-CB 4.16Å; V160-L203 HydrophobicContact CG1-CD1 4.49Å; V160-L203 HydrophobicContact CG2-CD1 3.87Å; V160-I204 HydrophobicContact CG1-CD1 3.93Å; V160-I204 HydrophobicContact CG1-CG1 3.88Å
161	L	74.9	Confident	81.4	Confident	29 Å²	29	47.8 Å²	47.8	15%	0.152	24%	0.242	C	C	.	.			trans	-89.3	93.2	-177.4	-69	168.1	0	0	0	111.4	V125 Y157 A158 S163	V125-L161 HydrophobicContact CG1-CD1 3.77Å; V125-L161 WeakPolarHBondContact O-CD1 3.26Å; Y157-L161 WeakPolarHBondContact O-CG 3.49Å; A158-L161 PolarHBondContact O-N 3.42Å; L161-S163 PolarHBondContact O-N 3.48Å
162	S	65.8	Low	81.7	Confident	125 Å²	125	44.8 Å²	44.8	87%	0.874	23%	0.229	S	C	*	.			trans	-65.5	31.7	-179.2	-36.4	0	0	0	0	116.2	V160	V160-S162 PolarHBondContact O-N 2.91Å
163	S	68.5	Low	81.9	Confident	38 Å²	38	43.9 Å²	43.9	27%	0.266	23%	0.225	S	C	.	.	S	Bend	trans	-120.2	149.3	-175.3	67.5	0	0	0	0	110.9	N128 L161 Q165 G166 D167	N128-S163 PolarHBondContact ND2-OG 2.92Å; L161-S163 PolarHBondContact O-N 3.48Å; S163-Q165 PolarHBondContact O-N 2.89Å; S163-G166 WeakPolarHBondContact O-CA 3.28Å; S163-G166 PolarHBondContact O-N 3.31Å; S163-G166 PolarHBondContact OG-N 3.06Å; S163-G166 VanDerWaalsContact OG-N 3.1Å; S163-D167 PolarHBondContact O-N 3.1Å; S163-D167 VanDerWaalsContact O-N 3.15Å
164	H	74.7	Confident	81.9	Confident	162 Å²	162	46 Å²	46	75%	0.75	24%	0.237	S	C	*	.	H	α-helix	trans	-57.8	-17.2	176.1	-62	-52.6	0	0	0	114.8	K168	H164-K168 WeakPolarHBondContact O-CG 3.42Å
165	Q	73.4	Confident	81.9	Confident	105 Å²	105	52.5 Å²	52.5	49%	0.491	27%	0.271	S	S	.	.	H	α-helix	trans	-85.1	-34.5	171.2	-66	-175.1	5.5	0	0	111.7	N128 S163 K168 I169	N128-Q165 PolarHBondContact O-OE1 3.34Å; N128-Q165 WeakPolarHBondContact OD1-CB 3.15Å; S163-Q165 PolarHBondContact O-N 2.89Å; Q165-K168 PolarHBondContact O-N 3.34Å; Q165-I169 VanDerWaalsContact O-CG1 3.28Å; Q165-I169 WeakPolarHBondContact O-CG1 3.27Å; Q165-I169 PolarHBondContact O-N 3.4Å
166	G	74.4	Confident	81.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.9	-47.8	171.6	0	0	0	0	0	112.5	N128 S163 K168 I169 Y170	N128-G166 PolarHBondContact OD1-N 3.24Å; S163-G166 WeakPolarHBondContact O-CA 3.28Å; S163-G166 PolarHBondContact O-N 3.31Å; S163-G166 PolarHBondContact OG-N 3.06Å; S163-G166 VanDerWaalsContact OG-N 3.1Å; G166-K168 VanDerWaalsContact C-N 3.34Å; G166-K168 PolarHBondContact O-N 3.39Å; G166-I169 CarbonylContact O-C 3.51Å; G166-I169 WeakPolarHBondContact O-CA 3.49Å; G166-I169 WeakPolarHBondContact O-CB 3.36Å; G166-I169 PolarHBondContact O-N 2.87Å; G166-I169 VanDerWaalsContact O-N 3.1Å; G166-Y170 WeakPolarHBondContact O-CB 3.23Å; G166-Y170 PolarHBondContact O-N 3.15Å
167	D	81.6	Confident	81.6	Confident	93 Å²	93	57 Å²	57	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-59.4	-42.8	175	-73.6	-29.6	0	0	0	112.3	S163 I169 Y170 Q171	S163-D167 PolarHBondContact O-N 3.1Å; S163-D167 VanDerWaalsContact O-N 3.15Å; D167-I169 VanDerWaalsContact C-N 3.32Å; D167-I169 PolarHBondContact O-N 3.4Å; D167-Y170 PolarHBondContact O-N 2.75Å; D167-Q171 WeakPolarHBondContact O-CB 3.42Å; D167-Q171 WeakPolarHBondContact O-CG 3.31Å; D167-Q171 PolarHBondContact O-N 3.47Å
168	K	84.5	Confident	81.8	Confident	136 Å²	136	56.4 Å²	56.4	59%	0.591	31%	0.313	S	S	*	.	H	α-helix	trans	-63.6	-37.9	175.8	-70.9	176	-176.5	-178.1	0	111.6	F130 H164 Q165 G166 F172	F130-K168 HydrophobicContact CD2-CB 4.37Å; F130-K168 HydrophobicContact CE2-CB 4.16Å; H164-K168 WeakPolarHBondContact O-CG 3.42Å; Q165-K168 PolarHBondContact O-N 3.34Å; G166-K168 VanDerWaalsContact C-N 3.34Å; G166-K168 PolarHBondContact O-N 3.39Å; K168-F172 WeakPolarHBondContact O-CB 3.37Å; K168-F172 PolarHBondContact O-N 2.99Å
169	I	86.6	Confident	81.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66.7	-43.2	173.6	-70.2	168.1	0	0	0	110.7	V125 N128 F130 V133 A158 Q165 G166 D167 F172 L173	V125-I169 HydrophobicContact CB-CG2 4.45Å; V125-I169 HydrophobicContact CG1-CG2 4.08Å; V125-I169 HydrophobicContact CG2-CG2 3.83Å; N128-I169 WeakPolarHBondContact OD1-CD1 3.48Å; F130-I169 HydrophobicContact CB-CG1 4.33Å; F130-I169 HydrophobicContact CD2-CG1 3.82Å; V133-I169 HydrophobicContact CG1-CG2 4.47Å; A158-I169 HydrophobicContact CB-CG2 4.08Å; Q165-I169 VanDerWaalsContact O-CG1 3.28Å; Q165-I169 WeakPolarHBondContact O-CG1 3.27Å; Q165-I169 PolarHBondContact O-N 3.4Å; G166-I169 CarbonylContact O-C 3.51Å; G166-I169 WeakPolarHBondContact O-CA 3.49Å; G166-I169 WeakPolarHBondContact O-CB 3.36Å; G166-I169 PolarHBondContact O-N 2.87Å; G166-I169 VanDerWaalsContact O-N 3.1Å; D167-I169 VanDerWaalsContact C-N 3.32Å; D167-I169 PolarHBondContact O-N 3.4Å; I169-F172 PolarHBondContact O-N 3.25Å; I169-L173 HydrophobicContact CG2-CD1 3.87Å; I169-L173 HydrophobicContact CG2-CG 4.48Å; I169-L173 WeakPolarHBondContact O-CB 3.47Å; I169-L173 WeakPolarHBondContact O-CG 3.44Å; I169-L173 PolarHBondContact O-N 3.21Å
170	Y	87.7	Confident	81.8	Confident	22 Å²	22	63.2 Å²	63.2	9%	0.086	35%	0.347	C	S	.	.	H	α-helix	trans	-62.5	-50.8	179.2	-174.1	-95.4	0	0	0	111.5	L155 A158 A159 G166 D167 F172 L173 L174 L194	L155-Y170 HydrophobicContact CD1-CD2 3.56Å; L155-Y170 HydrophobicContact CD1-CE2 3.44Å; L155-Y170 VanDerWaalsContact CD1-CE2 3.44Å; L155-Y170 HydrophobicContact CD1-CG 4.27Å; L155-Y170 HydrophobicContact CG-CD2 4.24Å; L155-Y170 HydrophobicContact CG-CE2 3.72Å; A158-Y170 HydrophobicContact CB-CD2 3.92Å; A159-Y170 HydrophobicContact CB-CD2 4.27Å; A159-Y170 HydrophobicContact CB-CE2 3.95Å; G166-Y170 WeakPolarHBondContact O-CB 3.23Å; G166-Y170 PolarHBondContact O-N 3.15Å; D167-Y170 PolarHBondContact O-N 2.75Å; Y170-F172 VanDerWaalsContact C-N 3.33Å; Y170-F172 PolarHBondContact O-N 2.86Å; Y170-L173 PolarHBondContact O-N 3.01Å; Y170-L174 HydrophobicContact CD1-CD1 3.97Å; Y170-L174 HydrophobicContact CE1-CD1 3.55Å; Y170-L174 HydrophobicContact CE1-CG 4.24Å; Y170-L174 WeakPolarHBondContact O-CG 3.19Å; Y170-L174 PolarHBondContact O-N 3.35Å; Y170-L194 HydrophobicContact CE1-CD1 3.98Å; Y170-L194 HydrophobicContact CE2-CD1 4.13Å; Y170-L194 WeakPolarHBondContact OH-CD1 3.5Å
171	Q	86.9	Confident	82.2	Confident	109 Å²	109	70.3 Å²	70.3	51%	0.509	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-37.4	175.2	-66.3	-65.5	-9.5	0	0	112.3	D167 L174 N175	D167-Q171 WeakPolarHBondContact O-CB 3.42Å; D167-Q171 WeakPolarHBondContact O-CG 3.31Å; D167-Q171 PolarHBondContact O-N 3.47Å; Q171-L174 PolarHBondContact O-N 3.21Å; Q171-N175 WeakPolarHBondContact O-CB 3.36Å; Q171-N175 VanDerWaalsContact O-CG 3.3Å; Q171-N175 PolarHBondContact O-N 3.46Å; Q171-N175 PolarHBondContact O-ND2 3.38Å
172	F	88.8	Confident	82.7	Confident	54 Å²	54	70.4 Å²	70.4	24%	0.237	38%	0.38	C	S	.	.	H	α-helix	trans	-68.8	-35.8	176.1	-168.5	-92.6	0	0	0	112.6	F130 V134 L137 K168 I169 Y170 N175 A176	F130-F172 HydrophobicContact CE2-CB 4.14Å; F130-F172 HydrophobicContact CE2-CG 4.33Å; F130-F172 HydrophobicContact CZ-CD2 4.49Å; V134-F172 HydrophobicContact CB-CE1 4.27Å; V134-F172 HydrophobicContact CB-CZ 4.23Å; V134-F172 HydrophobicContact CG1-CZ 4.04Å; V134-F172 HydrophobicContact CG2-CD1 4.1Å; V134-F172 HydrophobicContact CG2-CD2 4.33Å; V134-F172 HydrophobicContact CG2-CE1 3.83Å; V134-F172 HydrophobicContact CG2-CE2 4.06Å; V134-F172 HydrophobicContact CG2-CG 4.36Å; V134-F172 HydrophobicContact CG2-CZ 3.81Å; L137-F172 HydrophobicContact CB-CE1 4.15Å; L137-F172 HydrophobicContact CD1-CD1 3.82Å; L137-F172 HydrophobicContact CD1-CE1 3.78Å; K168-F172 WeakPolarHBondContact O-CB 3.37Å; K168-F172 PolarHBondContact O-N 2.99Å; I169-F172 PolarHBondContact O-N 3.25Å; Y170-F172 VanDerWaalsContact C-N 3.33Å; Y170-F172 PolarHBondContact O-N 2.86Å; F172-N175 PolarHBondContact O-N 2.77Å; F172-A176 VanDerWaalsContact O-CB 3.3Å; F172-A176 WeakPolarHBondContact O-CB 3.48Å; F172-A176 PolarHBondContact O-N 3.13Å
173	L	89	Confident	83.6	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-65.6	-40.8	172.8	-77.6	164	0	0	0	111.7	L121 V125 L137 V144 A154 L155 A158 I169 Y170 A176 G177 A178	L121-L173 HydrophobicContact CD2-CD2 4.42Å; V125-L173 HydrophobicContact CG2-CD1 4.25Å; L137-L173 HydrophobicContact CD1-CD2 3.78Å; V144-L173 HydrophobicContact CG1-CD2 4.46Å; A154-L173 HydrophobicContact CB-CD1 4.32Å; A154-L173 HydrophobicContact CB-CD2 4.25Å; L155-L173 HydrophobicContact CD1-CB 3.82Å; L155-L173 HydrophobicContact CD1-CD1 4.37Å; A158-L173 HydrophobicContact CB-CD1 3.67Å; I169-L173 HydrophobicContact CG2-CD1 3.87Å; I169-L173 HydrophobicContact CG2-CG 4.48Å; I169-L173 WeakPolarHBondContact O-CB 3.47Å; I169-L173 WeakPolarHBondContact O-CG 3.44Å; I169-L173 PolarHBondContact O-N 3.21Å; Y170-L173 PolarHBondContact O-N 3.01Å; L173-A176 PolarHBondContact O-N 3.35Å; L173-G177 PolarHBondContact O-N 3.4Å; L173-A178 HydrophobicContact CB-CB 4.27Å; L173-A178 WeakPolarHBondContact O-CB 3.27Å; L173-A178 PolarHBondContact O-N 2.91Å; L173-A178 VanDerWaalsContact O-N 3.07Å
174	L	87.6	Confident	84.2	Confident	46 Å²	46	70.4 Å²	70.4	24%	0.241	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-49.2	172.9	-70.9	178.1	0	0	0	111.5	L155 Y170 Q171 A176 G177 L180	L155-L174 HydrophobicContact CD1-CD2 4.23Å; L155-L174 HydrophobicContact CD1-CG 4.31Å; L155-L174 HydrophobicContact CD2-CD2 4.01Å; Y170-L174 HydrophobicContact CD1-CD1 3.97Å; Y170-L174 HydrophobicContact CE1-CD1 3.55Å; Y170-L174 HydrophobicContact CE1-CG 4.24Å; Y170-L174 WeakPolarHBondContact O-CG 3.19Å; Y170-L174 PolarHBondContact O-N 3.35Å; Q171-L174 PolarHBondContact O-N 3.21Å; L174-A176 PolarHBondContact O-N 3.26Å; L174-G177 PolarHBondContact O-N 3.17Å; L174-L180 HydrophobicContact CD2-CD1 3.92Å; L174-L180 HydrophobicContact CD2-CD2 3.97Å; L174-L180 HydrophobicContact CD2-CG 3.86Å
175	N	87.2	Confident	84.4	Confident	138 Å²	138	71.2 Å²	71.2	74%	0.738	35%	0.352	S	S	*	.	H	α-helix	trans	-63.7	-24	176.9	-70.1	-16.8	0	0	0	113.3	Q171 F172 G177	Q171-N175 WeakPolarHBondContact O-CB 3.36Å; Q171-N175 VanDerWaalsContact O-CG 3.3Å; Q171-N175 PolarHBondContact O-N 3.46Å; Q171-N175 PolarHBondContact O-ND2 3.38Å; F172-N175 PolarHBondContact O-N 2.77Å; N175-G177 VanDerWaalsContact C-N 3.29Å
176	A	84.9	Confident	84.5	Confident	43 Å²	43	70.8 Å²	70.8	36%	0.355	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-0.3	172.4	0	0	0	0	0	114	L137 V144 F172 L173 L174	L137-A176 HydrophobicContact CD1-CB 4.14Å; V144-A176 HydrophobicContact CG2-CB 4.33Å; F172-A176 VanDerWaalsContact O-CB 3.3Å; F172-A176 WeakPolarHBondContact O-CB 3.48Å; F172-A176 PolarHBondContact O-N 3.13Å; L173-A176 PolarHBondContact O-N 3.35Å; L174-A176 PolarHBondContact O-N 3.26Å
177	G	86.2	Confident	84.8	Confident	51 Å²	51	72.1 Å²	72.1	53%	0.526	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	30.4	176	0	0	0	0	0	115.4	L173 L174 N175	L173-G177 PolarHBondContact O-N 3.4Å; L174-G177 PolarHBondContact O-N 3.17Å; N175-G177 VanDerWaalsContact C-N 3.29Å
178	A	86	Confident	84.9	Confident	12 Å²	12	71.4 Å²	71.4	10%	0.099	36%	0.357	C	S	.	.			trans	-66.3	132.3	178.3	0	0	0	0	0	113.5	V144 L155 L173 L180	V144-A178 HydrophobicContact CG1-CB 3.39Å; L155-A178 HydrophobicContact CB-CB 4.42Å; L155-A178 HydrophobicContact CD1-CB 4.31Å; L155-A178 HydrophobicContact CD2-CB 4Å; L155-A178 HydrophobicContact CG-CB 4.49Å; L173-A178 HydrophobicContact CB-CB 4.27Å; L173-A178 WeakPolarHBondContact O-CB 3.27Å; L173-A178 PolarHBondContact O-N 2.91Å; L173-A178 VanDerWaalsContact O-N 3.07Å; A178-L180 PolarHBondContact O-N 3.24Å
179	N	86.7	Confident	84.9	Confident	84 Å²	84	65.7 Å²	65.7	45%	0.449	33%	0.334	S	S	.	.			trans	-76.7	106	-179.4	-89.3	-65.1	0	0	0	112.5	D145 Q181 I182	D145-N179 PolarHBondContact OD1-N 2.99Å; D145-N179 PolarHBondContact OD2-ND2 2.79Å; N179-Q181 PolarHBondContact O-N 3.19Å; N179-I182 HydrophobicContact CB-CD1 3.68Å; N179-I182 HydrophobicContact CB-CG1 3.94Å
180	L	84.7	Confident	84.8	Confident	75 Å²	75	65.7 Å²	65.7	39%	0.393	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.1	173.5	-78.7	157.5	0	0	0	114.4	L155 L174 A178 P190	L155-L180 HydrophobicContact CD2-CD2 3.89Å; L155-L180 HydrophobicContact CD2-CG 4.17Å; L174-L180 HydrophobicContact CD2-CD1 3.92Å; L174-L180 HydrophobicContact CD2-CD2 3.97Å; L174-L180 HydrophobicContact CD2-CG 3.86Å; A178-L180 PolarHBondContact O-N 3.24Å; L180-P190 WeakPolarHBondContact O-CD 3.39Å
181	Q	85.9	Confident	84.6	Confident	154 Å²	154	70.6 Å²	70.6	72%	0.72	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.6	-173.2	-61.4	-63.3	-12.5	0	0	114.3	N179 R183	N179-Q181 PolarHBondContact O-N 3.19Å; Q181-R183 PolarHBondContact O-N 3.24Å
182	I	85.6	Confident	84.5	Confident	32 Å²	32	67.6 Å²	67.6	16%	0.164	34%	0.343	C	S	.	.			trans	-71.7	122.2	178.3	-68.6	169.3	0	0	0	108.9	D145 Q147 T153 H156 N179	D145-I182 HydrophobicContact CB-CD1 3.82Å; Q147-I182 HydrophobicContact CG-CG2 4.23Å; T153-I182 HydrophobicContact CG2-CB 3.99Å; T153-I182 HydrophobicContact CG2-CD1 3.72Å; T153-I182 HydrophobicContact CG2-CG1 4.46Å; T153-I182 HydrophobicContact CG2-CG2 3.6Å; H156-I182 PolarHBondContact CE1-O 3.49Å; H156-I182 PolarHBondContact NE2-O 3.22Å; N179-I182 HydrophobicContact CB-CD1 3.68Å; N179-I182 HydrophobicContact CB-CG1 3.94Å
183	R	84.2	Confident	84.1	Confident	156 Å²	156	65.2 Å²	65.2	59%	0.589	33%	0.333	S	S	*	.			trans	-93.3	141.1	175.8	-66.2	173.6	-176.5	-113.6	9.1	111.6	Q181 G187 R188 T189	Q181-R183 PolarHBondContact O-N 3.24Å; R183-G187 WeakPolarHBondContact CD-O 3.32Å; R183-G187 WeakPolarHBondContact CG-O 3.26Å; R183-G187 PolarHBondContact NH1-O 3.18Å; R183-R188 CarbonylContact C-O 3.42Å; R183-R188 VanDerWaalsContact CA-O 3.28Å; R183-R188 WeakPolarHBondContact CA-O 3.35Å; R183-T189 HydrophobicContact CG-CG2 4.08Å
184	D	82.2	Confident	83.6	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.032	36%	0.355	C	S	.	.			trans	-73.3	-177.1	171.2	93.2	-26.1	0	0	0	112.6	R152 D186 G187 R188 Y193	R152-D184 HydrophobicContact CG-CB 3.54Å; R152-D184 IonicContact CZ-OD2 3.6Å; R152-D184 VanDerWaalsContact CZ-OD2 3.29Å; R152-D184 IonicContact NE-OD2 3.45Å; R152-D184 PolarHBondContact NE-OD2 3.39Å; R152-D184 IonicContact NH2-OD2 3.67Å; R152-D184 PolarHBondContact NH2-OD2 3.28Å; D184-D186 PolarHBondContact O-N 3.1Å; D184-D186 WeakPolarHBondContact OD1-CA 3.48Å; D184-D186 WeakPolarHBondContact OD1-CB 3.28Å; D184-D186 PolarHBondContact OD1-N 3.38Å; D184-G187 PolarHBondContact O-N 2.9Å; D184-G187 VanDerWaalsContact O-N 3.11Å; D184-G187 PolarHBondContact OD1-N 3.25Å; D184-G187 VanDerWaalsContact OD1-N 3.09Å; D184-R188 PolarHBondContact N-O 3.4Å; D184-R188 WeakPolarHBondContact OD1-CB 3.08Å; D184-R188 PolarHBondContact OD1-N 3.45Å; D184-Y193 PolarHBondContact OD2-OH 3.15Å
185	R	77.8	Confident	83.2	Confident	180 Å²	180	73.1 Å²	73.1	68%	0.679	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.5	179.7	-178	174.6	-179.4	178.5	-0.9	113	N150 G187	N150-R185 HydrophobicContact CB-CB 4.5Å; N150-R185 VanDerWaalsContact O-CB 3.32Å; N150-R185 WeakPolarHBondContact O-CB 3.44Å; N150-R185 PolarHBondContact O-N 3.24Å; R185-G187 VanDerWaalsContact C-N 3.27Å
186	D	76.1	Confident	82.4	Confident	95 Å²	95	69.2 Å²	69.2	51%	0.508	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	4.4	179	-51.9	-31.2	0	0	0	111.2	R152 D184 R188	R152-D186 IonicContact NH2-OD2 2.73Å; R152-D186 PolarHBondContact NH2-OD2 3.35Å; R152-D186 VanDerWaalsContact NH2-OD2 3.08Å; D184-D186 PolarHBondContact O-N 3.1Å; D184-D186 WeakPolarHBondContact OD1-CA 3.48Å; D184-D186 WeakPolarHBondContact OD1-CB 3.28Å; D184-D186 PolarHBondContact OD1-N 3.38Å; D186-R188 HydrophobicContact CB-CG 4.48Å; D186-R188 IonicContact OD2-NH1 3.67Å
187	G	81	Confident	81.4	Confident	29 Å²	29	71.6 Å²	71.6	30%	0.299	36%	0.362	S	S	.	.	S	Bend	trans	87.5	2.6	175.7	0	0	0	0	0	115.2	R183 D184 R185	R183-G187 WeakPolarHBondContact CD-O 3.32Å; R183-G187 WeakPolarHBondContact CG-O 3.26Å; R183-G187 PolarHBondContact NH1-O 3.18Å; D184-G187 PolarHBondContact O-N 2.9Å; D184-G187 VanDerWaalsContact O-N 3.11Å; D184-G187 PolarHBondContact OD1-N 3.25Å; D184-G187 VanDerWaalsContact OD1-N 3.09Å; R185-G187 VanDerWaalsContact C-N 3.27Å
188	R	82.7	Confident	80.3	Confident	77 Å²	77	74.9 Å²	74.9	29%	0.291	36%	0.363	S	S	.	.			trans	-87.3	143.7	-170.9	-62.1	165.9	175.9	157.8	-6.2	112	H156 R183 D184 D186 D192 Y193	H156-R188 PolarHBondContact NE2-O 3.26Å; R183-R188 CarbonylContact C-O 3.42Å; R183-R188 VanDerWaalsContact CA-O 3.28Å; R183-R188 WeakPolarHBondContact CA-O 3.35Å; D184-R188 PolarHBondContact N-O 3.4Å; D184-R188 WeakPolarHBondContact OD1-CB 3.08Å; D184-R188 PolarHBondContact OD1-N 3.45Å; D186-R188 HydrophobicContact CB-CG 4.48Å; D186-R188 IonicContact OD2-NH1 3.67Å; R188-D192 VanDerWaalsContact CA-OD2 3.29Å; R188-D192 WeakPolarHBondContact CA-OD2 3.5Å; R188-D192 HydrophobicContact CB-CB 4.4Å; R188-Y193 HydrophobicContact CB-CE2 3.94Å
189	T	85.9	Confident	79.1	Confident	16 Å²	16	75.1 Å²	75.1	10%	0.098	36%	0.363	C	S	.	.			trans	-92.1	164.7	173.7	79.1	0	0	0	0	111.4	R183 K191 D192 Y193	R183-T189 HydrophobicContact CG-CG2 4.08Å; T189-K191 PolarHBondContact O-N 3.4Å; T189-K191 PolarHBondContact OG1-N 2.75Å; T189-D192 PolarHBondContact N-OD2 3.17Å; T189-D192 WeakPolarHBondContact O-CB 3.48Å; T189-D192 PolarHBondContact O-N 2.77Å; T189-D192 VanDerWaalsContact O-N 3.13Å; T189-D192 PolarHBondContact OG1-N 3.25Å; T189-D192 PolarHBondContact OG1-OD1 3.45Å; T189-D192 PolarHBondContact OG1-OD2 2.71Å; T189-Y193 WeakPolarHBondContact O-CD2 3.45Å
190	P	83.4	Confident	77.7	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-56.9	-29.8	171.2	-21.9	31.9	0	0	0	113.6	L155 A159 L180 Y193	L155-P190 HydrophobicContact CB-CB 4.39Å; L155-P190 HydrophobicContact CB-CG 4.28Å; L155-P190 HydrophobicContact CD2-CB 4.04Å; L155-P190 HydrophobicContact CD2-CG 3.99Å; L155-P190 HydrophobicContact CG-CB 3.97Å; L155-P190 HydrophobicContact CG-CG 4.22Å; A159-P190 WeakPolarHBondContact CB-O 3.28Å; L180-P190 WeakPolarHBondContact O-CD 3.39Å; P190-Y193 PolarHBondContact O-N 3.24Å
191	K	84.5	Confident	76.2	Confident	126 Å²	126	72.8 Å²	72.8	55%	0.548	35%	0.352	S	S	.	.	H	α-helix	trans	-70.3	-33.5	178.7	-169.9	179	178.3	-177.1	0	111.7	T189 Y193 L194 Q195	T189-K191 PolarHBondContact O-N 3.4Å; T189-K191 PolarHBondContact OG1-N 2.75Å; K191-Y193 PolarHBondContact O-N 2.59Å; K191-L194 WeakPolarHBondContact O-CB 3.25Å; K191-L194 PolarHBondContact O-N 3.09Å; K191-Q195 PolarHBondContact O-N 3.04Å
192	D	84.4	Confident	74.5	Confident	46 Å²	46	71.7 Å²	71.7	25%	0.246	35%	0.346	C	S	.	.	H	α-helix	trans	-67.1	-28.8	180	-49.3	-10.5	0	0	0	111.2	R188 T189 Q195 N196	R188-D192 VanDerWaalsContact CA-OD2 3.29Å; R188-D192 WeakPolarHBondContact CA-OD2 3.5Å; R188-D192 HydrophobicContact CB-CB 4.4Å; T189-D192 PolarHBondContact N-OD2 3.17Å; T189-D192 WeakPolarHBondContact O-CB 3.48Å; T189-D192 PolarHBondContact O-N 2.77Å; T189-D192 VanDerWaalsContact O-N 3.13Å; T189-D192 PolarHBondContact OG1-N 3.25Å; T189-D192 PolarHBondContact OG1-OD1 3.45Å; T189-D192 PolarHBondContact OG1-OD2 2.71Å; D192-Q195 PolarHBondContact O-N 2.85Å; D192-N196 WeakPolarHBondContact O-CB 3.47Å; D192-N196 PolarHBondContact O-N 3.14Å; D192-N196 VanDerWaalsContact O-N 3.16Å; D192-N196 PolarHBondContact O-ND2 3.13Å
193	Y	80	Confident	73	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.016	34%	0.342	C	S	.	.	H	α-helix	trans	-73.8	-35	174.5	-78	-76.5	0	0	0	113.3	R152 H156 V160 D184 R188 T189 P190 K191 Q195 L199 L203	R152-Y193 PolarHBondContact NH2-OH 2.98Å; H156-Y193 AromaticContact CD2-CD2 3.87Å; H156-Y193 AromaticContact CD2-CE2 3.76Å; V160-Y193 HydrophobicContact CG2-CD1 3.97Å; V160-Y193 HydrophobicContact CG2-CG 4.18Å; D184-Y193 PolarHBondContact OD2-OH 3.15Å; R188-Y193 HydrophobicContact CB-CE2 3.94Å; T189-Y193 WeakPolarHBondContact O-CD2 3.45Å; P190-Y193 PolarHBondContact O-N 3.24Å; K191-Y193 PolarHBondContact O-N 2.59Å; Y193-Q195 VanDerWaalsContact C-N 3.29Å; Y193-Q195 PolarHBondContact O-N 3.34Å; Y193-L199 HydrophobicContact CD1-CB 3.84Å; Y193-L199 HydrophobicContact CE1-CB 3.71Å; Y193-L199 HydrophobicContact CE1-CD1 4.42Å; Y193-L203 HydrophobicContact CD1-CD1 3.68Å; Y193-L203 HydrophobicContact CE1-CD1 3.22Å; Y193-L203 HydrophobicContact CE1-CG 4.4Å
194	L	78.4	Confident	71.5	Confident	87 Å²	87	67 Å²	67	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-34	170.4	-81.1	165.7	0	0	0	112.1	A159 Y170 K191	A159-L194 HydrophobicContact CB-CG 4.03Å; Y170-L194 HydrophobicContact CE1-CD1 3.98Å; Y170-L194 HydrophobicContact CE2-CD1 4.13Å; Y170-L194 WeakPolarHBondContact OH-CD1 3.5Å; K191-L194 WeakPolarHBondContact O-CB 3.25Å; K191-L194 PolarHBondContact O-N 3.09Å
195	Q	78.6	Confident	69.7	Low	125 Å²	125	72.1 Å²	72.1	58%	0.584	36%	0.356	S	S	*	.	H	α-helix	trans	-80.2	-24.1	-179.1	-70.8	-178.5	-26	0	0	113.8	K191 D192 Y193 P197	K191-Q195 PolarHBondContact O-N 3.04Å; D192-Q195 PolarHBondContact O-N 2.85Å; Y193-Q195 VanDerWaalsContact C-N 3.29Å; Y193-Q195 PolarHBondContact O-N 3.34Å; Q195-P197 WeakPolarHBondContact O-CD 3.4Å
196	N	70.8	Confident	67.7	Low	56 Å²	56	73 Å²	73	30%	0.299	36%	0.359	S	S	.	.			trans	-126.1	84.1	-170.8	-67.1	-74.1	0	0	0	112.2	D192 H198 L199	D192-N196 WeakPolarHBondContact O-CB 3.47Å; D192-N196 PolarHBondContact O-N 3.14Å; D192-N196 VanDerWaalsContact O-N 3.16Å; D192-N196 PolarHBondContact O-ND2 3.13Å; N196-H198 PolarHBondContact O-N 3.07Å; N196-H198 VanDerWaalsContact O-N 3.12Å; N196-H198 PolarHBondContact OD1-CE1 3.27Å; N196-L199 HydrophobicContact CB-CD1 3.71Å; N196-L199 HydrophobicContact CB-CG 3.83Å; N196-L199 WeakPolarHBondContact O-CB 3.23Å; N196-L199 PolarHBondContact O-N 3.17Å
197	P	64.2	Low	66	Low	93 Å²	93	72.3 Å²	72.3	60%	0.604	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-55.7	-29.9	179	-27.6	35.5	0	0	0	114.2	Q195 L199 V200	Q195-P197 WeakPolarHBondContact O-CD 3.4Å; P197-L199 PolarHBondContact O-N 3.45Å; P197-L199 VanDerWaalsContact O-N 3.17Å; P197-V200 WeakPolarHBondContact O-CB 3.45Å; P197-V200 WeakPolarHBondContact O-CG2 3.42Å; P197-V200 PolarHBondContact O-N 3.02Å
198	H	64.2	Low	63.7	Low	119 Å²	119	75.8 Å²	75.8	55%	0.551	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-65.2	-18	177.6	65.4	-95.4	0	0	0	113.9	N196 V200	N196-H198 PolarHBondContact O-N 3.07Å; N196-H198 VanDerWaalsContact O-N 3.12Å; N196-H198 PolarHBondContact OD1-CE1 3.27Å; H198-V200 VanDerWaalsContact C-N 3.29Å
199	L	60.7	Low	61.2	Low	17 Å²	17	75.8 Å²	75.8	9%	0.089	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-79.6	-12.1	174.6	-58.6	-179	0	0	0	112.9	Y193 N196 P197	Y193-L199 HydrophobicContact CD1-CB 3.84Å; Y193-L199 HydrophobicContact CE1-CB 3.71Å; Y193-L199 HydrophobicContact CE1-CD1 4.42Å; N196-L199 HydrophobicContact CB-CD1 3.71Å; N196-L199 HydrophobicContact CB-CG 3.83Å; N196-L199 WeakPolarHBondContact O-CB 3.23Å; N196-L199 PolarHBondContact O-N 3.17Å; P197-L199 PolarHBondContact O-N 3.45Å; P197-L199 VanDerWaalsContact O-N 3.17Å
200	V	55.9	Low	58.6	Low	23 Å²	23	79 Å²	79	14%	0.139	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-40.5	177.3	170.1	0	0	0	0	111.3	V160 P197 H198 H202 L203 I204	V160-V200 HydrophobicContact CB-CG2 4.5Å; V160-V200 HydrophobicContact CG1-CB 4.09Å; V160-V200 HydrophobicContact CG1-CG1 3.71Å; V160-V200 HydrophobicContact CG1-CG2 4.01Å; V160-V200 HydrophobicContact CG2-CG2 4.43Å; P197-V200 WeakPolarHBondContact O-CB 3.45Å; P197-V200 WeakPolarHBondContact O-CG2 3.42Å; P197-V200 PolarHBondContact O-N 3.02Å; H198-V200 VanDerWaalsContact C-N 3.29Å; V200-H202 PolarHBondContact O-N 2.94Å; V200-L203 WeakPolarHBondContact O-CA 3.49Å; V200-L203 WeakPolarHBondContact O-CB 3.4Å; V200-L203 PolarHBondContact O-N 2.89Å; V200-I204 HydrophobicContact CG1-CD1 3.79Å; V200-I204 HydrophobicContact CG1-CG1 4.22Å; V200-I204 PolarHBondContact O-N 2.99Å
201	D	53	Low	56.2	Low	88 Å²	88	86.6 Å²	86.6	47%	0.471	43%	0.431	S	S	.	.	H	α-helix	trans	-59.9	-35.9	-174	-67	-13.1	0	0	0	112.1	L203 H205	D201-L203 PolarHBondContact O-N 3.28Å; D201-H205 WeakPolarHBondContact O-CB 3.41Å; D201-H205 PolarHBondContact O-N 3.42Å
202	H	50.2	Low	53.5	Low	131 Å²	131	89.8 Å²	89.8	61%	0.606	45%	0.448	S	S	*	.	H	α-helix	trans	-74.1	-12.9	177.8	-67.1	10.3	0	0	0	113.9	V200	V200-H202 PolarHBondContact O-N 2.94Å
203	L	55.6	Low	50.8	Low	14 Å²	14	93.8 Å²	93.8	7%	0.073	47%	0.466	C	S	.	.	H	α-helix	trans	-100.9	-40.8	-178.6	-91.4	164.9	0	0	0	113.2	R152 Y157 V160 Y193 V200 D201	R152-L203 VanDerWaalsContact NH1-CD2 3.34Å; Y157-L203 HydrophobicContact CD1-CD2 4.37Å; Y157-L203 HydrophobicContact CE1-CD2 3.89Å; V160-L203 HydrophobicContact CG1-CB 4.16Å; V160-L203 HydrophobicContact CG1-CD1 4.49Å; V160-L203 HydrophobicContact CG2-CD1 3.87Å; Y193-L203 HydrophobicContact CD1-CD1 3.68Å; Y193-L203 HydrophobicContact CE1-CD1 3.22Å; Y193-L203 HydrophobicContact CE1-CG 4.4Å; V200-L203 WeakPolarHBondContact O-CA 3.49Å; V200-L203 WeakPolarHBondContact O-CB 3.4Å; V200-L203 PolarHBondContact O-N 2.89Å; D201-L203 PolarHBondContact O-N 3.28Å
204	I	52.6	Low	48.4	Very low	74 Å²	74	100 Å²	100	38%	0.379	50%	0.495	S	S	.	.	H	α-helix	trans	-87.7	-41.9	-178.5	-61.8	-175.3	0	0	0	111.8	V160 V200 R206 T207	V160-I204 HydrophobicContact CG1-CD1 3.93Å; V160-I204 HydrophobicContact CG1-CG1 3.88Å; V200-I204 HydrophobicContact CG1-CD1 3.79Å; V200-I204 HydrophobicContact CG1-CG1 4.22Å; V200-I204 PolarHBondContact O-N 2.99Å; I204-R206 PolarHBondContact O-N 3.25Å; I204-T207 PolarHBondContact O-OG1 3.13Å
205	H	44	Very low	46.2	Very low	115 Å²	115	101 Å²	101	53%	0.532	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	5.5	-170.7	-68.9	-62.2	0	0	0	116.3	D201 S209	D201-H205 WeakPolarHBondContact O-CB 3.41Å; D201-H205 PolarHBondContact O-N 3.42Å; H205-S209 PolarHBondContact O-OG 3.34Å
206	R	36.7	Very low	44.3	Very low	199 Å²	199	96.3 Å²	96.3	75%	0.751	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.1	175.4	-78.2	-173.7	172.6	172.5	2.4	114.8	I204	I204-R206 PolarHBondContact O-N 3.25Å
207	T	38.9	Very low	42.9	Very low	80 Å²	80	95.4 Å²	95.4	49%	0.491	48%	0.48	S	S	.	.	S	Bend	trans	-106.7	-26.1	-173	50.4	0	0	0	0	116.2	M126 I204	M126-T207 HydrophobicContact CE-CG2 4.16Å; I204-T207 PolarHBondContact O-OG1 3.13Å
208	D	32.7	Very low	41.7	Very low	101 Å²	101	99.6 Å²	99.6	54%	0.54	49%	0.492	S	S	.	.	S	Bend	trans	-118.7	-23.7	-168.3	-79.7	-69.6	0	0	0	117.2	K211	D208-K211 IonicContact OD1-NZ 3.34Å; D208-K211 PolarHBondContact OD1-NZ 3.45Å
209	S	31.1	Very low	40.8	Very low	77 Å²	77	96.6 Å²	96.6	54%	0.538	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-25	-176.7	27.5	0	0	0	0	114.5	H205 K211	H205-S209 PolarHBondContact O-OG 3.34Å; S209-K211 PolarHBondContact O-N 3.4Å
210	N	30.2	Very low	40.5	Very low	85 Å²	85	98.2 Å²	98.2	46%	0.455	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	36.6	-178.1	-80.4	27.6	0	0	0	114.7	Q212 E213	N210-Q212 PolarHBondContact O-N 3.17Å; N210-E213 HydrophobicContact CB-CB 4.26Å; N210-E213 PolarHBondContact ND2-OE2 2.69Å; N210-E213 PolarHBondContact O-N 3.34Å
211	K	33	Very low	40.8	Very low	158 Å²	158	99.6 Å²	99.6	69%	0.687	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	1	172.2	-80	170.4	-175.6	146.3	0	114.5	D208 S209	D208-K211 IonicContact OD1-NZ 3.34Å; D208-K211 PolarHBondContact OD1-NZ 3.45Å; S209-K211 PolarHBondContact O-N 3.4Å
212	Q	27.6	Very low	41.4	Very low	194 Å²	194	100.6 Å²	100.6	91%	0.907	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	-4.2	170.2	-70	-173.3	-14.3	0	0	115	N210	N210-Q212 PolarHBondContact O-N 3.17Å
213	E	28.9	Very low	42.4	Very low	130 Å²	130	96.5 Å²	96.5	61%	0.607	47%	0.471	S	S	*	.	S	Bend	trans	-110.4	94.1	168.2	-73.4	-164.7	153.3	0	0	109.7	N210 T215	N210-E213 HydrophobicContact CB-CB 4.26Å; N210-E213 PolarHBondContact ND2-OE2 2.69Å; N210-E213 PolarHBondContact O-N 3.34Å; E213-T215 PolarHBondContact O-N 3.11Å
214	Q	30.4	Very low	43.3	Very low	135 Å²	135	95.9 Å²	95.9	63%	0.631	47%	0.468	S	S	*	.			trans	-67.9	79.5	173.4	-68.5	-174.7	3.4	0	0	110.6	L216	Q214-L216 PolarHBondContact O-N 3.09Å
215	T	31.9	Very low	44.3	Very low	108 Å²	108	95.2 Å²	95.2	66%	0.663	47%	0.47	S	S	*	.			trans	-66.5	87	159.2	52	0	0	0	0	107.7	E213	E213-T215 PolarHBondContact O-N 3.11Å
216	L	37.9	Very low	45.7	Very low	26 Å²	26	91.7 Å²	91.7	14%	0.136	46%	0.455	C	S	.	.			trans	-52.4	145.6	179.9	-68.4	151	0	0	0	110	Q214 Q218 F220 N221 V247	Q214-L216 PolarHBondContact O-N 3.09Å; L216-Q218 PolarHBondContact O-N 3.49Å; L216-F220 HydrophobicContact CB-CB 4.29Å; L216-F220 HydrophobicContact CB-CD1 3.83Å; L216-F220 HydrophobicContact CB-CG 4.38Å; L216-F220 HydrophobicContact CD1-CD1 3.74Å; L216-F220 HydrophobicContact CD1-CE1 3.78Å; L216-F220 HydrophobicContact CD2-CD1 3.64Å; L216-F220 HydrophobicContact CD2-CE1 3.68Å; L216-F220 HydrophobicContact CD2-CG 4.24Å; L216-F220 HydrophobicContact CD2-CZ 4.31Å; L216-F220 HydrophobicContact CG-CD1 3.93Å; L216-F220 HydrophobicContact CG-CE1 4.21Å; L216-N221 PolarHBondContact O-ND2 2.93Å; L216-V247 HydrophobicContact CD1-CB 4.07Å; L216-V247 HydrophobicContact CD1-CG1 3.21Å; L216-V247 HydrophobicContact CD1-CG2 3.67Å; L216-V247 HydrophobicContact CD2-CG2 4.49Å; L216-V247 HydrophobicContact CG-CG2 4.44Å
217	P	41.1	Very low	47.9	Very low	36 Å²	36	84 Å²	84	23%	0.234	43%	0.426	C	S	.	.			trans	-44.3	137.6	176.8	-0.6	-8	0	0	0	110.2	H219 F220 N221	P217-H219 CarbonylContact O-C 3.46Å; P217-H219 PolarHBondContact O-N 3.31Å; P217-F220 HydrophobicContact CB-CB 4.32Å; P217-F220 HydrophobicContact CG-CB 3.82Å; P217-F220 CarbonylContact O-C 3.5Å; P217-F220 WeakPolarHBondContact O-CA 3.42Å; P217-F220 WeakPolarHBondContact O-CB 3.18Å; P217-F220 PolarHBondContact O-N 2.73Å; P217-N221 PolarHBondContact O-N 2.84Å
218	Q	40.2	Very low	50	Low	181 Å²	181	80.7 Å²	80.7	85%	0.846	41%	0.405	S	S	*	.	H	α-helix	trans	-51.3	-36.4	-178	-74.7	-179.1	-13.6	0	0	111.6	L216 N221 Y222	L216-Q218 PolarHBondContact O-N 3.49Å; Q218-N221 PolarHBondContact O-N 3.23Å; Q218-Y222 PolarHBondContact O-N 2.77Å
219	H	44.6	Very low	52	Low	56 Å²	56	80.6 Å²	80.6	26%	0.259	40%	0.397	S	S	.	.	H	α-helix	trans	-61.1	-40.7	171.3	-176.6	-114.7	0	0	0	114.4	D57 P217 Y222 L223	D57-H219 WeakPolarHBondContact CB-ND1 3.29Å; P217-H219 CarbonylContact O-C 3.46Å; P217-H219 PolarHBondContact O-N 3.31Å; H219-Y222 WeakPolarHBondContact O-CB 3.47Å; H219-Y222 PolarHBondContact O-N 2.8Å; H219-L223 WeakPolarHBondContact O-CG 3.31Å; H219-L223 PolarHBondContact O-N 3.08Å
220	F	54	Low	54.3	Low	51 Å²	51	80.5 Å²	80.5	22%	0.224	39%	0.388	C	S	.	.	H	α-helix	trans	-72	-35.7	174.4	-171.5	-78.2	0	0	0	111.9	L216 P217 Y222 L223 L224 L239	L216-F220 HydrophobicContact CB-CB 4.29Å; L216-F220 HydrophobicContact CB-CD1 3.83Å; L216-F220 HydrophobicContact CB-CG 4.38Å; L216-F220 HydrophobicContact CD1-CD1 3.74Å; L216-F220 HydrophobicContact CD1-CE1 3.78Å; L216-F220 HydrophobicContact CD2-CD1 3.64Å; L216-F220 HydrophobicContact CD2-CE1 3.68Å; L216-F220 HydrophobicContact CD2-CG 4.24Å; L216-F220 HydrophobicContact CD2-CZ 4.31Å; L216-F220 HydrophobicContact CG-CD1 3.93Å; L216-F220 HydrophobicContact CG-CE1 4.21Å; P217-F220 HydrophobicContact CB-CB 4.32Å; P217-F220 HydrophobicContact CG-CB 3.82Å; P217-F220 CarbonylContact O-C 3.5Å; P217-F220 WeakPolarHBondContact O-CA 3.42Å; P217-F220 WeakPolarHBondContact O-CB 3.18Å; P217-F220 PolarHBondContact O-N 2.73Å; F220-Y222 VanDerWaalsContact C-N 3.29Å; F220-Y222 PolarHBondContact O-N 2.86Å; F220-L223 PolarHBondContact O-N 3.13Å; F220-L224 HydrophobicContact CD1-CB 4.42Å; F220-L224 HydrophobicContact CE1-CB 4.46Å; F220-L224 HydrophobicContact CE1-CD2 4.38Å; F220-L224 WeakPolarHBondContact O-CB 3.47Å; F220-L224 PolarHBondContact O-N 3.31Å; F220-L239 HydrophobicContact CE1-CD1 3.91Å; F220-L239 HydrophobicContact CZ-CD1 3.52Å; F220-L239 HydrophobicContact CZ-CG 4.45Å
221	N	63.1	Low	56.7	Low	52 Å²	52	77.2 Å²	77.2	28%	0.278	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-38.1	170.2	-92.7	-48.3	0	0	0	111.7	L216 P217 Q218 S225 R251	L216-N221 PolarHBondContact O-ND2 2.93Å; P217-N221 PolarHBondContact O-N 2.84Å; Q218-N221 PolarHBondContact O-N 3.23Å; N221-S225 WeakPolarHBondContact O-CB 3.01Å; N221-S225 PolarHBondContact O-N 3.36Å; N221-S225 PolarHBondContact O-OG 3.34Å; N221-R251 PolarHBondContact OD1-NH1 2.99Å; N221-R251 PolarHBondContact OD1-NH2 2.92Å
222	Y	65	Low	59.1	Low	109 Å²	109	74.3 Å²	74.3	43%	0.427	36%	0.359	S	S	.	.	H	α-helix	trans	-64	-53.4	169.7	175.3	-113	0	0	0	112.3	E32 Q218 H219 F220 L224 S225 L226	E32-Y222 PolarHBondContact OE1-OH 3.17Å; Q218-Y222 PolarHBondContact O-N 2.77Å; H219-Y222 WeakPolarHBondContact O-CB 3.47Å; H219-Y222 PolarHBondContact O-N 2.8Å; F220-Y222 VanDerWaalsContact C-N 3.29Å; F220-Y222 PolarHBondContact O-N 2.86Å; Y222-L224 PolarHBondContact O-N 3.16Å; Y222-S225 PolarHBondContact O-N 3.34Å; Y222-S225 PolarHBondContact O-OG 3.18Å; Y222-L226 VanDerWaalsContact O-CB 3.28Å; Y222-L226 WeakPolarHBondContact O-CB 3.36Å; Y222-L226 PolarHBondContact O-N 2.98Å
223	L	71.1	Confident	61.9	Low	45 Å²	45	67 Å²	67	24%	0.236	33%	0.328	C	S	.	.	H	α-helix	trans	-56.5	-38.2	176.7	-75	176.7	0	0	0	112.4	H219 F220 L226 W227	H219-L223 WeakPolarHBondContact O-CG 3.31Å; H219-L223 PolarHBondContact O-N 3.08Å; F220-L223 PolarHBondContact O-N 3.13Å; L223-L226 WeakPolarHBondContact O-CB 3.4Å; L223-L226 PolarHBondContact O-N 3.19Å; L223-W227 HydrophobicContact CB-CZ2 4.13Å; L223-W227 HydrophobicContact CD1-CZ2 4.41Å; L223-W227 WeakPolarHBondContact O-CB 3.38Å; L223-W227 PolarHBondContact O-N 3.34Å; L223-W227 PolarHBondContact O-NE1 3.12Å
224	L	74.2	Confident	64.5	Low	1 Å²	1	68.7 Å²	68.7	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-71.7	-45.4	178.4	176.5	56.6	0	0	0	111.9	F220 Y222 L226 W227 L228 L236 L239 V247 L248 R251	F220-L224 HydrophobicContact CD1-CB 4.42Å; F220-L224 HydrophobicContact CE1-CB 4.46Å; F220-L224 HydrophobicContact CE1-CD2 4.38Å; F220-L224 WeakPolarHBondContact O-CB 3.47Å; F220-L224 PolarHBondContact O-N 3.31Å; Y222-L224 PolarHBondContact O-N 3.16Å; L224-L226 PolarHBondContact O-N 3.01Å; L224-W227 PolarHBondContact O-N 3.16Å; L224-L228 HydrophobicContact CD1-CD1 4.1Å; L224-L228 HydrophobicContact CD1-CG 4.06Å; L224-L228 HydrophobicContact CG-CD1 4.08Å; L224-L228 WeakPolarHBondContact O-CB 3.45Å; L224-L228 VanDerWaalsContact O-CG 3.26Å; L224-L228 WeakPolarHBondContact O-CG 3.47Å; L224-L228 PolarHBondContact O-N 3.48Å; L224-L236 HydrophobicContact CD1-CD2 3.62Å; L224-L239 HydrophobicContact CD1-CD1 4.24Å; L224-V247 HydrophobicContact CD2-CG1 3.27Å; L224-L248 HydrophobicContact CD1-CD2 3.6Å; L224-L248 HydrophobicContact CD2-CD2 4.26Å; L224-L248 HydrophobicContact CG-CD2 4.49Å; L224-R251 VanDerWaalsContact CD2-CZ 3.41Å
225	S	73	Confident	67.1	Low	60 Å²	60	66 Å²	66	42%	0.42	32%	0.324	S	S	.	.	H	α-helix	trans	-61.1	-34.6	172.3	66.7	0	0	0	0	111.8	N221 Y222 R229	N221-S225 WeakPolarHBondContact O-CB 3.01Å; N221-S225 PolarHBondContact O-N 3.36Å; N221-S225 PolarHBondContact O-OG 3.34Å; Y222-S225 PolarHBondContact O-N 3.34Å; Y222-S225 PolarHBondContact O-OG 3.18Å; S225-R229 WeakPolarHBondContact O-CB 3.39Å; S225-R229 PolarHBondContact O-N 2.95Å
226	L	74.8	Confident	69.7	Low	42 Å²	42	60.9 Å²	60.9	22%	0.22	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-48.8	172.1	-176.6	69.7	0	0	0	111.3	Y222 L223 L224 L228 R229 E230	Y222-L226 VanDerWaalsContact O-CB 3.28Å; Y222-L226 WeakPolarHBondContact O-CB 3.36Å; Y222-L226 PolarHBondContact O-N 2.98Å; L223-L226 WeakPolarHBondContact O-CB 3.4Å; L223-L226 PolarHBondContact O-N 3.19Å; L224-L226 PolarHBondContact O-N 3.01Å; L226-L228 PolarHBondContact O-N 3.23Å; L226-R229 PolarHBondContact O-N 3.45Å; L226-E230 HydrophobicContact CD1-CG 3.97Å; L226-E230 HydrophobicContact CG-CG 4.15Å; L226-E230 WeakPolarHBondContact CG-OE2 3.19Å; L226-E230 VanDerWaalsContact O-CB 3.29Å; L226-E230 WeakPolarHBondContact O-CB 3.49Å; L226-E230 VanDerWaalsContact O-CG 3.26Å; L226-E230 WeakPolarHBondContact O-CG 3.45Å; L226-E230 PolarHBondContact O-N 3.12Å
227	W	82.3	Confident	72	Confident	38 Å²	38	60.4 Å²	60.4	14%	0.144	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-37.2	179	-61.9	-8.8	0	0	0	112.9	L223 L224 R229 G231 R232 K235 L236 L239	L223-W227 HydrophobicContact CB-CZ2 4.13Å; L223-W227 HydrophobicContact CD1-CZ2 4.41Å; L223-W227 WeakPolarHBondContact O-CB 3.38Å; L223-W227 PolarHBondContact O-N 3.34Å; L223-W227 PolarHBondContact O-NE1 3.12Å; L224-W227 PolarHBondContact O-N 3.16Å; W227-R229 VanDerWaalsContact C-N 3.35Å; W227-G231 PolarHBondContact O-N 3.03Å; W227-R232 HydrophobicContact CB-CB 4.17Å; W227-R232 HydrophobicContact CG-CB 4.46Å; W227-R232 PolarHBondContact O-N 3.5Å; W227-K235 HydrophobicContact CD2-CB 3.98Å; W227-K235 HydrophobicContact CD2-CD 3.85Å; W227-K235 HydrophobicContact CE3-CB 3.88Å; W227-K235 HydrophobicContact CE3-CD 4.45Å; W227-K235 HydrophobicContact CG-CB 4.41Å; W227-K235 HydrophobicContact CG-CD 4.15Å; W227-K235 HydrophobicContact CZ2-CD 4.02Å; W227-K235 HydrophobicContact CZ3-CB 4.31Å; W227-L236 HydrophobicContact CB-CD2 4.11Å; W227-L239 HydrophobicContact CZ3-CD1 4.06Å
228	L	83.8	Confident	74.1	Confident	9 Å²	9	65.3 Å²	65.3	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-39.8	172.7	-74.3	170.8	0	0	0	111.6	L224 L226 L236 R251 H255 S258 L262	L224-L228 HydrophobicContact CD1-CD1 4.1Å; L224-L228 HydrophobicContact CD1-CG 4.06Å; L224-L228 HydrophobicContact CG-CD1 4.08Å; L224-L228 WeakPolarHBondContact O-CB 3.45Å; L224-L228 VanDerWaalsContact O-CG 3.26Å; L224-L228 WeakPolarHBondContact O-CG 3.47Å; L224-L228 PolarHBondContact O-N 3.48Å; L226-L228 PolarHBondContact O-N 3.23Å; L228-L236 HydrophobicContact CD2-CD1 3.85Å; L228-L236 HydrophobicContact CD2-CD2 3.93Å; L228-L236 HydrophobicContact CG-CD2 4.14Å; L228-R251 HydrophobicContact CD1-CB 4.27Å; L228-H255 WeakPolarHBondContact O-CB 3.47Å; L228-S258 WeakPolarHBondContact O-CB 3.35Å; L228-S258 PolarHBondContact O-OG 3.46Å; L228-L262 HydrophobicContact CD2-CD1 4.03Å; L228-L262 HydrophobicContact CD2-CD2 4.29Å; L228-L262 HydrophobicContact CD2-CG 4.36Å
229	R	73.7	Confident	76.2	Confident	100 Å²	100	57 Å²	57	38%	0.377	27%	0.273	S	S	.	.	H	α-helix	trans	-77.4	-37.3	179.3	-168.1	-176.5	-157.9	169.3	7.7	113.8	S225 L226 W227 G231 A481 R484	S225-R229 WeakPolarHBondContact O-CB 3.39Å; S225-R229 PolarHBondContact O-N 2.95Å; L226-R229 PolarHBondContact O-N 3.45Å; W227-R229 VanDerWaalsContact C-N 3.35Å; R229-G231 VanDerWaalsContact C-N 3.3Å; R229-A481 PolarHBondContact NH2-O 2.76Å; R229-R484 VanDerWaalsContact CZ-CZ 3.41Å; R229-R484 VanDerWaalsContact CZ-NE 3.26Å
230	E	79	Confident	78.2	Confident	75 Å²	75	54.3 Å²	54.3	35%	0.35	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.1	178.4	-71.1	176.7	128.4	0	0	113.4	L226 R232	L226-E230 HydrophobicContact CD1-CG 3.97Å; L226-E230 HydrophobicContact CG-CG 4.15Å; L226-E230 WeakPolarHBondContact CG-OE2 3.19Å; L226-E230 VanDerWaalsContact O-CB 3.29Å; L226-E230 WeakPolarHBondContact O-CB 3.49Å; L226-E230 VanDerWaalsContact O-CG 3.26Å; L226-E230 WeakPolarHBondContact O-CG 3.45Å; L226-E230 PolarHBondContact O-N 3.12Å; E230-R232 HydrophobicContact CB-CG 3.98Å; E230-R232 IonicContact OE1-CZ 3.8Å; E230-R232 IonicContact OE1-NE 2.94Å; E230-R232 IonicContact OE1-NH1 2.63Å; E230-R232 PolarHBondContact OE1-NH1 3.28Å; E230-R232 IonicContact OE1-NH2 2.75Å; E230-R232 PolarHBondContact OE1-NH2 3.42Å; E230-R232 VanDerWaalsContact OE2-CD 3.31Å; E230-R232 WeakPolarHBondContact OE2-CD 3.33Å; E230-R232 IonicContact OE2-CZ 3.3Å; E230-R232 IonicContact OE2-NE 2.59Å; E230-R232 PolarHBondContact OE2-NE 2.92Å; E230-R232 VanDerWaalsContact OE2-NE 3.13Å; E230-R232 IonicContact OE2-NH1 2.77Å; E230-R232 PolarHBondContact OE2-NH1 3.23Å; E230-R232 IonicContact OE2-NH2 3.4Å; E230-R232 PolarHBondContact OE2-NH2 3.11Å
231	G	82	Confident	79.8	Confident	16 Å²	16	53.8 Å²	53.8	17%	0.165	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	26.8	-178.6	0	0	0	0	0	114.7	W227 R229 V233 H255 S258	W227-G231 PolarHBondContact O-N 3.03Å; R229-G231 VanDerWaalsContact C-N 3.3Å; G231-V233 PolarHBondContact O-N 2.65Å; G231-H255 VanDerWaalsContact CA-CE1 3.46Å; G231-H255 WeakPolarHBondContact CA-CE1 3.37Å; G231-H255 VanDerWaalsContact CA-CG 3.46Å; G231-H255 VanDerWaalsContact CA-ND1 3.27Å; G231-H255 WeakPolarHBondContact CA-ND1 3.46Å; G231-S258 WeakPolarHBondContact CA-OG 3.41Å
232	R	83.2	Confident	80.7	Confident	96 Å²	96	53 Å²	53	36%	0.362	26%	0.257	S	S	.	.			trans	-78.5	60	-175.6	-69.7	-171.2	174.1	146.5	6.1	112.3	W227 E230 M234 K235 L236	W227-R232 HydrophobicContact CB-CB 4.17Å; W227-R232 HydrophobicContact CG-CB 4.46Å; W227-R232 PolarHBondContact O-N 3.5Å; E230-R232 HydrophobicContact CB-CG 3.98Å; E230-R232 IonicContact OE1-CZ 3.8Å; E230-R232 IonicContact OE1-NE 2.94Å; E230-R232 IonicContact OE1-NH1 2.63Å; E230-R232 PolarHBondContact OE1-NH1 3.28Å; E230-R232 IonicContact OE1-NH2 2.75Å; E230-R232 PolarHBondContact OE1-NH2 3.42Å; E230-R232 VanDerWaalsContact OE2-CD 3.31Å; E230-R232 WeakPolarHBondContact OE2-CD 3.33Å; E230-R232 IonicContact OE2-CZ 3.3Å; E230-R232 IonicContact OE2-NE 2.59Å; E230-R232 PolarHBondContact OE2-NE 2.92Å; E230-R232 VanDerWaalsContact OE2-NE 3.13Å; E230-R232 IonicContact OE2-NH1 2.77Å; E230-R232 PolarHBondContact OE2-NH1 3.23Å; E230-R232 IonicContact OE2-NH2 3.4Å; E230-R232 PolarHBondContact OE2-NH2 3.11Å; R232-M234 PolarHBondContact O-N 3.32Å; R232-M234 VanDerWaalsContact O-N 3.11Å; R232-K235 HydrophobicContact CB-CB 4.33Å; R232-K235 HydrophobicContact CB-CD 4.41Å; R232-K235 HydrophobicContact CB-CG 4.37Å; R232-K235 PolarHBondContact O-N 3.32Å; R232-L236 PolarHBondContact O-N 3.28Å; R232-L236 VanDerWaalsContact O-N 3.17Å
233	V	86.2	Confident	81.1	Confident	41 Å²	41	48.3 Å²	48.3	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-50.2	-39.1	-177.6	-179.4	0	0	0	0	112.6	G231 K235 L236 A237 A257 F261	G231-V233 PolarHBondContact O-N 2.65Å; V233-K235 VanDerWaalsContact C-N 3.31Å; V233-K235 PolarHBondContact O-N 2.99Å; V233-L236 PolarHBondContact O-N 2.86Å; V233-A237 VanDerWaalsContact O-CB 3.3Å; V233-A237 WeakPolarHBondContact O-CB 3.38Å; V233-A237 PolarHBondContact O-N 3.23Å; V233-A257 HydrophobicContact CG2-CB 3.78Å; V233-A257 VanDerWaalsContact CG2-O 3.31Å; V233-A257 WeakPolarHBondContact CG2-O 3.33Å; V233-F261 HydrophobicContact CG1-CB 4.03Å; V233-F261 HydrophobicContact CG1-CD2 3.77Å; V233-F261 HydrophobicContact CG1-CE2 4.49Å; V233-F261 HydrophobicContact CG1-CG 3.87Å; V233-F261 HydrophobicContact CG2-CB 4.46Å
234	M	83.7	Confident	81.3	Confident	165 Å²	165	47.5 Å²	47.5	81%	0.813	24%	0.239	S	C	*	.	H	α-helix	trans	-61.6	-35.2	177.5	-62.1	-64.6	-87.8	0	0	113.2	R232 Q238	R232-M234 PolarHBondContact O-N 3.32Å; R232-M234 VanDerWaalsContact O-N 3.11Å; M234-Q238 WeakPolarHBondContact O-CB 3.19Å; M234-Q238 PolarHBondContact O-N 3.31Å
235	K	84.1	Confident	81.3	Confident	80 Å²	80	47.4 Å²	47.4	35%	0.348	24%	0.239	S	C	.	.	H	α-helix	trans	-75.5	-37.2	175.1	-65.5	-169.4	179.4	-178.6	0	111.6	W227 R232 V233 Q238 L239	W227-K235 HydrophobicContact CD2-CB 3.98Å; W227-K235 HydrophobicContact CD2-CD 3.85Å; W227-K235 HydrophobicContact CE3-CB 3.88Å; W227-K235 HydrophobicContact CE3-CD 4.45Å; W227-K235 HydrophobicContact CG-CB 4.41Å; W227-K235 HydrophobicContact CG-CD 4.15Å; W227-K235 HydrophobicContact CZ2-CD 4.02Å; W227-K235 HydrophobicContact CZ3-CB 4.31Å; R232-K235 HydrophobicContact CB-CB 4.33Å; R232-K235 HydrophobicContact CB-CD 4.41Å; R232-K235 HydrophobicContact CB-CG 4.37Å; R232-K235 PolarHBondContact O-N 3.32Å; V233-K235 VanDerWaalsContact C-N 3.31Å; V233-K235 PolarHBondContact O-N 2.99Å; K235-Q238 PolarHBondContact O-N 3.29Å; K235-L239 WeakPolarHBondContact O-CB 3.36Å; K235-L239 PolarHBondContact O-N 3.42Å
236	L	87.4	Confident	81.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-42	174.7	-59.2	172.2	0	0	0	111.1	L224 W227 L228 R232 V233 L239 V240 L248 F261	L224-L236 HydrophobicContact CD1-CD2 3.62Å; W227-L236 HydrophobicContact CB-CD2 4.11Å; L228-L236 HydrophobicContact CD2-CD1 3.85Å; L228-L236 HydrophobicContact CD2-CD2 3.93Å; L228-L236 HydrophobicContact CG-CD2 4.14Å; R232-L236 PolarHBondContact O-N 3.28Å; R232-L236 VanDerWaalsContact O-N 3.17Å; V233-L236 PolarHBondContact O-N 2.86Å; L236-L239 WeakPolarHBondContact O-CB 3.36Å; L236-L239 PolarHBondContact O-N 3.48Å; L236-V240 PolarHBondContact O-N 2.8Å; L236-L248 HydrophobicContact CB-CD1 4.5Å; L236-L248 HydrophobicContact CD2-CD2 4.09Å; L236-F261 HydrophobicContact CB-CD1 3.75Å; L236-F261 HydrophobicContact CB-CE1 3.54Å; L236-F261 HydrophobicContact CB-CZ 4.43Å; L236-F261 HydrophobicContact CD1-CD1 4.29Å
237	A	86.4	Confident	81.6	Confident	16 Å²	16	45.9 Å²	45.9	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-43.8	172.8	0	0	0	0	0	111.9	V233 L239 V240 F241 F261	V233-A237 VanDerWaalsContact O-CB 3.3Å; V233-A237 WeakPolarHBondContact O-CB 3.38Å; V233-A237 PolarHBondContact O-N 3.23Å; A237-L239 PolarHBondContact O-N 3.39Å; A237-V240 PolarHBondContact O-N 2.84Å; A237-F241 HydrophobicContact CB-CD2 4.42Å; A237-F241 HydrophobicContact CB-CE2 4.16Å; A237-F241 WeakPolarHBondContact O-CD2 3.45Å; A237-F241 WeakPolarHBondContact O-CG 3.42Å; A237-F241 PolarHBondContact O-N 3.09Å; A237-F261 VanDerWaalsContact CA-CZ 3.5Å; A237-F261 HydrophobicContact CB-CE2 3.93Å; A237-F261 HydrophobicContact CB-CZ 3.93Å
238	Q	84.2	Confident	81.6	Confident	138 Å²	138	44.2 Å²	44.2	65%	0.645	22%	0.221	S	C	*	.	H	α-helix	trans	-59.5	-36.1	173.1	-173.5	176.4	4.1	0	0	112.1	M234 K235 S242	M234-Q238 WeakPolarHBondContact O-CB 3.19Å; M234-Q238 PolarHBondContact O-N 3.31Å; K235-Q238 PolarHBondContact O-N 3.29Å; Q238-S242 WeakPolarHBondContact O-CB 3.44Å; Q238-S242 PolarHBondContact O-N 3.34Å; Q238-S242 PolarHBondContact O-OG 3.33Å
239	L	84.9	Confident	81.3	Confident	7 Å²	7	48 Å²	48	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-70.9	-34.2	176.7	-177.7	156.1	0	0	0	112.8	F220 L224 W227 K235 L236 A237 S242 C244 G245 L248	F220-L239 HydrophobicContact CE1-CD1 3.91Å; F220-L239 HydrophobicContact CZ-CD1 3.52Å; F220-L239 HydrophobicContact CZ-CG 4.45Å; L224-L239 HydrophobicContact CD1-CD1 4.24Å; W227-L239 HydrophobicContact CZ3-CD1 4.06Å; K235-L239 WeakPolarHBondContact O-CB 3.36Å; K235-L239 PolarHBondContact O-N 3.42Å; L236-L239 WeakPolarHBondContact O-CB 3.36Å; L236-L239 PolarHBondContact O-N 3.48Å; A237-L239 PolarHBondContact O-N 3.39Å; L239-S242 WeakPolarHBondContact CA-OG 3.39Å; L239-S242 PolarHBondContact O-OG 3.19Å; L239-S242 VanDerWaalsContact O-OG 3.06Å; L239-C244 HydrophobicContact CD2-CB 4.22Å; L239-C244 VanDerWaalsContact CD2-O 3.27Å; L239-C244 WeakPolarHBondContact CD2-O 3.46Å; L239-C244 HydrophobicContact CG-CB 4.18Å; L239-C244 CarbonylContact O-C 3.56Å; L239-C244 WeakPolarHBondContact O-CA 3.16Å; L239-C244 PolarHBondContact O-N 2.86Å; L239-C244 VanDerWaalsContact O-N 3.1Å; L239-G245 PolarHBondContact O-N 3.1Å; L239-L248 HydrophobicContact CD2-CD1 4.05Å; L239-L248 HydrophobicContact CD2-CD2 4.15Å; L239-L248 HydrophobicContact CD2-CG 3.87Å
240	V	87	Confident	81.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.264	C	S	.	.	I	π-helix	trans	-65.8	-53.7	168.9	173.9	0	0	0	0	110.5	L236 A237 S242 G243 L248 F261 V265 H268 L269 I272	L236-V240 PolarHBondContact O-N 2.8Å; A237-V240 PolarHBondContact O-N 2.84Å; V240-S242 PolarHBondContact O-N 2.74Å; V240-G243 PolarHBondContact O-N 3.21Å; V240-G243 VanDerWaalsContact O-N 3.1Å; V240-L248 HydrophobicContact CG2-CD1 3.67Å; V240-F261 HydrophobicContact CB-CZ 4.47Å; V240-F261 HydrophobicContact CG2-CE1 4.04Å; V240-F261 HydrophobicContact CG2-CZ 3.79Å; V240-V265 HydrophobicContact CG2-CG1 4.37Å; V240-V265 HydrophobicContact CG2-CG2 4.06Å; V240-H268 HydrophobicContact CG1-CB 4.07Å; V240-L269 HydrophobicContact CG1-CD2 4.38Å; V240-I272 HydrophobicContact CG1-CD1 3.99Å
241	F	86.3	Confident	81.3	Confident	40 Å²	40	47.2 Å²	47.2	18%	0.175	26%	0.261	C	S	.	.	I	π-helix	trans	-67.8	-20	-178.7	-63.2	-54.8	0	0	0	113.7	A237 G243 I272 K295 W296 A299 R300	A237-F241 HydrophobicContact CB-CD2 4.42Å; A237-F241 HydrophobicContact CB-CE2 4.16Å; A237-F241 WeakPolarHBondContact O-CD2 3.45Å; A237-F241 WeakPolarHBondContact O-CG 3.42Å; A237-F241 PolarHBondContact O-N 3.09Å; F241-G243 PolarHBondContact O-N 3.36Å; F241-I272 HydrophobicContact CD1-CD1 4.18Å; F241-I272 HydrophobicContact CE1-CD1 4.49Å; F241-K295 HydrophobicContact CE2-CB 4.49Å; F241-K295 HydrophobicContact CE2-CD 4.4Å; F241-K295 HydrophobicContact CZ-CB 4.33Å; F241-K295 HydrophobicContact CZ-CD 3.93Å; F241-K295 HydrophobicContact CZ-CG 4.31Å; F241-W296 AromaticContact CE1-CE3 3.93Å; F241-W296 HydrophobicContact CE1-CE3 3.93Å; F241-W296 HydrophobicContact CE1-CH2 4.25Å; F241-W296 AromaticContact CE1-CZ3 3.74Å; F241-W296 HydrophobicContact CE1-CZ3 3.74Å; F241-W296 HydrophobicContact CZ-CZ3 4.45Å; F241-A299 HydrophobicContact CD1-CB 3.87Å; F241-R300 PolarHBondContact O-N 3.35Å
242	S	81.5	Confident	80.9	Confident	36 Å²	36	55.3 Å²	55.3	25%	0.252	29%	0.294	S	S	.	.	I	π-helix	trans	-77.3	-3.5	173.7	72	0	0	0	0	114.1	Q238 L239 V240 R300 Y336	Q238-S242 WeakPolarHBondContact O-CB 3.44Å; Q238-S242 PolarHBondContact O-N 3.34Å; Q238-S242 PolarHBondContact O-OG 3.33Å; L239-S242 WeakPolarHBondContact CA-OG 3.39Å; L239-S242 PolarHBondContact O-OG 3.19Å; L239-S242 VanDerWaalsContact O-OG 3.06Å; V240-S242 PolarHBondContact O-N 2.74Å; S242-R300 VanDerWaalsContact O-CD 3.3Å; S242-R300 WeakPolarHBondContact O-CD 3.26Å; S242-Y336 WeakPolarHBondContact O-CE1 3.35Å; S242-Y336 PolarHBondContact O-OH 2.96Å
243	G	75.2	Confident	80.4	Confident	9 Å²	9	51.5 Å²	51.5	9%	0.093	28%	0.282	C	S	.	.	I	π-helix	trans	89.5	12.2	-179	0	0	0	0	0	114.5	V240 F241 R300 Y336	V240-G243 PolarHBondContact O-N 3.21Å; V240-G243 VanDerWaalsContact O-N 3.1Å; F241-G243 PolarHBondContact O-N 3.36Å; G243-R300 WeakPolarHBondContact CA-O 3.38Å; G243-Y336 VanDerWaalsContact CA-OH 3.28Å; G243-Y336 WeakPolarHBondContact CA-OH 3.46Å; G243-Y336 PolarHBondContact O-OH 3.21Å
244	C	74.3	Confident	79.9	Confident	28 Å²	28	52.2 Å²	52.2	19%	0.189	29%	0.289	C	S	.	.	I	π-helix	trans	-109.6	13.8	-179.5	-52.7	0	0	0	0	112.7	L239 D246 V247 Y336	L239-C244 HydrophobicContact CD2-CB 4.22Å; L239-C244 VanDerWaalsContact CD2-O 3.27Å; L239-C244 WeakPolarHBondContact CD2-O 3.46Å; L239-C244 HydrophobicContact CG-CB 4.18Å; L239-C244 CarbonylContact O-C 3.56Å; L239-C244 WeakPolarHBondContact O-CA 3.16Å; L239-C244 PolarHBondContact O-N 2.86Å; L239-C244 VanDerWaalsContact O-N 3.1Å; C244-D246 VanDerWaalsContact C-N 3.28Å; C244-D246 PolarHBondContact O-N 2.9Å; C244-V247 VanDerWaalsContact O-CB 3.24Å; C244-V247 WeakPolarHBondContact O-CB 3.49Å; C244-V247 WeakPolarHBondContact O-CG2 3.43Å; C244-V247 PolarHBondContact O-N 3.42Å; C244-Y336 PolarHBondContact SG-OH 3.07Å
245	G	74.8	Confident	79.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-65.2	-24.2	-171.9	0	0	0	0	0	115.3	L239 V247 L248	L239-G245 PolarHBondContact O-N 3.1Å; G245-V247 PolarHBondContact O-N 3.14Å; G245-V247 VanDerWaalsContact O-N 3.09Å; G245-L248 WeakPolarHBondContact O-CB 3.36Å; G245-L248 PolarHBondContact O-N 3.41Å
246	D	75.9	Confident	79.6	Confident	48 Å²	48	47.5 Å²	47.5	26%	0.257	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-53.4	-32	176.5	-65.4	-59.3	0	0	0	112.7	C244 L248 L249 R302	C244-D246 VanDerWaalsContact C-N 3.28Å; C244-D246 PolarHBondContact O-N 2.9Å; D246-L248 PolarHBondContact O-N 2.94Å; D246-L248 VanDerWaalsContact O-N 3.13Å; D246-L249 HydrophobicContact CB-CD1 4.48Å; D246-L249 VanDerWaalsContact O-CB 3.28Å; D246-L249 WeakPolarHBondContact O-CB 3.13Å; D246-L249 WeakPolarHBondContact O-CG 3.39Å; D246-L249 PolarHBondContact O-N 3.33Å; D246-R302 VanDerWaalsContact CG-NH2 3.3Å; D246-R302 IonicContact OD1-CZ 2.72Å; D246-R302 IonicContact OD1-NE 2.83Å; D246-R302 PolarHBondContact OD1-NE 2.72Å; D246-R302 IonicContact OD1-NH2 3.95Å; D246-R302 PolarHBondContact OD1-NH2 2.84Å; D246-R302 WeakPolarHBondContact OD2-CG 3.26Å; D246-R302 IonicContact OD2-CZ 3.8Å; D246-R302 IonicContact OD2-NE 3.48Å; D246-R302 PolarHBondContact OD2-NE 2.76Å; D246-R302 IonicContact OD2-NH2 3.15Å
247	V	77.6	Confident	79.4	Confident	22 Å²	22	49.6 Å²	49.6	13%	0.133	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-56.1	-27	176.9	169.7	0	0	0	0	113.4	L216 L224 C244 G245 R251	L216-V247 HydrophobicContact CD1-CB 4.07Å; L216-V247 HydrophobicContact CD1-CG1 3.21Å; L216-V247 HydrophobicContact CD1-CG2 3.67Å; L216-V247 HydrophobicContact CD2-CG2 4.49Å; L216-V247 HydrophobicContact CG-CG2 4.44Å; L224-V247 HydrophobicContact CD2-CG1 3.27Å; C244-V247 VanDerWaalsContact O-CB 3.24Å; C244-V247 WeakPolarHBondContact O-CB 3.49Å; C244-V247 WeakPolarHBondContact O-CG2 3.43Å; C244-V247 PolarHBondContact O-N 3.42Å; G245-V247 PolarHBondContact O-N 3.14Å; G245-V247 VanDerWaalsContact O-N 3.09Å; V247-R251 WeakPolarHBondContact O-CD 3.22Å; V247-R251 PolarHBondContact O-NE 2.81Å
248	L	82.7	Confident	79.4	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.016	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-85.6	-17.8	-179.6	-57.9	-178.9	0	0	0	112.5	L224 L236 L239 V240 G245 D246 R251 F261 L262 V265	L224-L248 HydrophobicContact CD1-CD2 3.6Å; L224-L248 HydrophobicContact CD2-CD2 4.26Å; L224-L248 HydrophobicContact CG-CD2 4.49Å; L236-L248 HydrophobicContact CB-CD1 4.5Å; L236-L248 HydrophobicContact CD2-CD2 4.09Å; L239-L248 HydrophobicContact CD2-CD1 4.05Å; L239-L248 HydrophobicContact CD2-CD2 4.15Å; L239-L248 HydrophobicContact CD2-CG 3.87Å; V240-L248 HydrophobicContact CG2-CD1 3.67Å; G245-L248 WeakPolarHBondContact O-CB 3.36Å; G245-L248 PolarHBondContact O-N 3.41Å; D246-L248 PolarHBondContact O-N 2.94Å; D246-L248 VanDerWaalsContact O-N 3.13Å; L248-R251 WeakPolarHBondContact O-CB 3.32Å; L248-R251 PolarHBondContact O-N 2.84Å; L248-R251 VanDerWaalsContact O-N 3.15Å; L248-F261 HydrophobicContact CD1-CE1 3.93Å; L248-L262 HydrophobicContact CB-CD2 3.87Å; L248-L262 WeakPolarHBondContact O-CD2 3.5Å; L248-V265 HydrophobicContact CB-CG1 4.14Å; L248-V265 HydrophobicContact CB-CG2 4.34Å; L248-V265 HydrophobicContact CD1-CG2 3.77Å
249	L	78	Confident	79.4	Confident	89 Å²	89	46.6 Å²	46.6	47%	0.466	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	138.1	177	-61.1	173.7	0	0	0	109.8	D246 R251 V265 L269	D246-L249 HydrophobicContact CB-CD1 4.48Å; D246-L249 VanDerWaalsContact O-CB 3.28Å; D246-L249 WeakPolarHBondContact O-CB 3.13Å; D246-L249 WeakPolarHBondContact O-CG 3.39Å; D246-L249 PolarHBondContact O-N 3.33Å; L249-R251 PolarHBondContact O-N 3.18Å; L249-V265 HydrophobicContact CD2-CG1 4.26Å; L249-L269 HydrophobicContact CD1-CD1 4.03Å; L249-L269 HydrophobicContact CD2-CD1 4.02Å; L249-L269 HydrophobicContact CG-CD1 4.05Å
250	G	73.7	Confident	79.4	Confident	84 Å²	84	49.1 Å²	49.1	87%	0.866	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	-9.2	-175	0	0	0	0	0	115.6
251	R	77.6	Confident	79.5	Confident	74 Å²	74	49.7 Å²	49.7	28%	0.279	30%	0.295	S	S	.	.			trans	-77.8	133.9	175.5	-64.4	-162.9	-174.2	-130.8	-3.9	110.9	N221 L224 L228 V247 L248 L249 L262	N221-R251 PolarHBondContact OD1-NH1 2.99Å; N221-R251 PolarHBondContact OD1-NH2 2.92Å; L224-R251 VanDerWaalsContact CD2-CZ 3.41Å; L228-R251 HydrophobicContact CD1-CB 4.27Å; V247-R251 WeakPolarHBondContact O-CD 3.22Å; V247-R251 PolarHBondContact O-NE 2.81Å; L248-R251 WeakPolarHBondContact O-CB 3.32Å; L248-R251 PolarHBondContact O-N 2.84Å; L248-R251 VanDerWaalsContact O-N 3.15Å; L249-R251 PolarHBondContact O-N 3.18Å; R251-L262 WeakPolarHBondContact O-CD1 3.41Å
252	Q	73.9	Confident	79.6	Confident	185 Å²	185	49.1 Å²	49.1	86%	0.864	29%	0.294	S	S	*	.			trans	-105	151.3	171	-61.1	-178.1	1.2	0	0	109.9
253	S	73.9	Confident	79.7	Confident	17 Å²	17	54.6 Å²	54.6	12%	0.119	32%	0.315	C	S	.	.			trans	-139.3	154.2	175.5	68.7	0	0	0	0	110.1	S258 Q259 L262	S253-S258 WeakPolarHBondContact OG-CB 3.5Å; S253-Q259 WeakPolarHBondContact O-CG 3.48Å; S253-Q259 PolarHBondContact O-NE2 2.79Å; S253-L262 WeakPolarHBondContact OG-CD1 3.46Å
254	S	73.9	Confident	80.3	Confident	56 Å²	56	58.9 Å²	58.9	39%	0.392	33%	0.333	S	S	.	.	S	Bend	trans	-90	-8.6	176.4	51.6	0	0	0	0	113.8	I482	S254-I482 WeakPolarHBondContact CB-O 3.28Å; S254-I482 PolarHBondContact OG-O 2.99Å
255	H	80.4	Confident	81	Confident	61 Å²	61	57.6 Å²	57.6	28%	0.282	32%	0.324	S	S	.	.	S	Bend	trans	-86.3	123.6	-179.1	-171.6	-80.4	0	0	0	110.9	L228 G231 A257 S258 Q259	L228-H255 WeakPolarHBondContact O-CB 3.47Å; G231-H255 VanDerWaalsContact CA-CE1 3.46Å; G231-H255 WeakPolarHBondContact CA-CE1 3.37Å; G231-H255 VanDerWaalsContact CA-CG 3.46Å; G231-H255 VanDerWaalsContact CA-ND1 3.27Å; G231-H255 WeakPolarHBondContact CA-ND1 3.46Å; H255-A257 PolarHBondContact ND1-N 3Å; H255-A257 PolarHBondContact O-N 3.47Å; H255-S258 CarbonylContact O-C 3.55Å; H255-S258 WeakPolarHBondContact O-CA 3.45Å; H255-S258 WeakPolarHBondContact O-CB 3.42Å; H255-S258 PolarHBondContact O-N 3.17Å; H255-Q259 PolarHBondContact O-N 3.02Å
256	P	81.7	Confident	81.5	Confident	85 Å²	85	60.7 Å²	60.7	55%	0.552	35%	0.346	S	S	*	.	H	α-helix	trans	-60.5	-41.7	-170.4	21.5	-33	0	0	0	113.3	S258 Q259 S260	P256-S258 PolarHBondContact O-N 3.45Å; P256-Q259 WeakPolarHBondContact O-CB 3.31Å; P256-Q259 PolarHBondContact O-N 3Å; P256-Q259 VanDerWaalsContact O-N 3.12Å; P256-S260 PolarHBondContact O-N 3.03Å; P256-S260 PolarHBondContact O-OG 2.99Å
257	A	83.9	Confident	82.1	Confident	44 Å²	44	64.7 Å²	64.7	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-66.1	-26.1	176.4	0	0	0	0	0	113.3	V233 H255 F261	V233-A257 HydrophobicContact CG2-CB 3.78Å; V233-A257 VanDerWaalsContact CG2-O 3.31Å; V233-A257 WeakPolarHBondContact CG2-O 3.33Å; H255-A257 PolarHBondContact ND1-N 3Å; H255-A257 PolarHBondContact O-N 3.47Å; A257-F261 VanDerWaalsContact O-CB 3.31Å; A257-F261 WeakPolarHBondContact O-CB 3.13Å; A257-F261 PolarHBondContact O-N 2.96Å
258	S	85.3	Confident	82.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-79.5	-34.1	173.1	-61.9	0	0	0	0	110.8	L228 G231 S253 H255 P256 F261 L262	L228-S258 WeakPolarHBondContact O-CB 3.35Å; L228-S258 PolarHBondContact O-OG 3.46Å; G231-S258 WeakPolarHBondContact CA-OG 3.41Å; S253-S258 WeakPolarHBondContact OG-CB 3.5Å; H255-S258 CarbonylContact O-C 3.55Å; H255-S258 WeakPolarHBondContact O-CA 3.45Å; H255-S258 WeakPolarHBondContact O-CB 3.42Å; H255-S258 PolarHBondContact O-N 3.17Å; P256-S258 PolarHBondContact O-N 3.45Å; S258-F261 PolarHBondContact O-N 3.31Å; S258-L262 VanDerWaalsContact O-CB 3.31Å; S258-L262 WeakPolarHBondContact O-CB 3.36Å; S258-L262 WeakPolarHBondContact O-CD1 3.41Å; S258-L262 WeakPolarHBondContact O-CG 3.23Å; S258-L262 PolarHBondContact O-N 2.95Å
259	Q	84.9	Confident	82.8	Confident	90 Å²	90	65.3 Å²	65.3	42%	0.421	36%	0.363	S	S	.	.	H	α-helix	trans	-63.6	-51	173.6	-69.6	177.1	-17.3	0	0	111.9	S253 H255 P256 F261 L262 Q263	S253-Q259 WeakPolarHBondContact O-CG 3.48Å; S253-Q259 PolarHBondContact O-NE2 2.79Å; H255-Q259 PolarHBondContact O-N 3.02Å; P256-Q259 WeakPolarHBondContact O-CB 3.31Å; P256-Q259 PolarHBondContact O-N 3Å; P256-Q259 VanDerWaalsContact O-N 3.12Å; Q259-F261 VanDerWaalsContact C-N 3.3Å; Q259-F261 PolarHBondContact O-N 3.15Å; Q259-L262 PolarHBondContact O-N 3.19Å; Q259-Q263 WeakPolarHBondContact O-CG 3.26Å; Q259-Q263 PolarHBondContact O-N 3.43Å
260	S	85.6	Confident	83.3	Confident	61 Å²	61	65.6 Å²	65.6	43%	0.427	36%	0.362	S	S	.	.	H	α-helix	trans	-58.8	-43.4	175.2	-55.6	0	0	0	0	111.2	P256 L262 Q263 E264	P256-S260 PolarHBondContact O-N 3.03Å; P256-S260 PolarHBondContact O-OG 2.99Å; S260-L262 PolarHBondContact O-N 2.94Å; S260-Q263 PolarHBondContact O-N 2.99Å; S260-E264 WeakPolarHBondContact O-CG 3.32Å; S260-E264 PolarHBondContact O-N 3.37Å; S260-E264 VanDerWaalsContact O-N 3.13Å
261	F	89.1	Confident	84.1	Confident	11 Å²	11	63.1 Å²	63.1	5%	0.048	33%	0.328	C	S	.	.	H	α-helix	trans	-62.1	-44.4	175.3	-176.5	-103.9	0	0	0	112.4	V233 L236 A237 V240 L248 A257 S258 Q259 Q263 E264 V265	V233-F261 HydrophobicContact CG1-CB 4.03Å; V233-F261 HydrophobicContact CG1-CD2 3.77Å; V233-F261 HydrophobicContact CG1-CE2 4.49Å; V233-F261 HydrophobicContact CG1-CG 3.87Å; V233-F261 HydrophobicContact CG2-CB 4.46Å; L236-F261 HydrophobicContact CB-CD1 3.75Å; L236-F261 HydrophobicContact CB-CE1 3.54Å; L236-F261 HydrophobicContact CB-CZ 4.43Å; L236-F261 HydrophobicContact CD1-CD1 4.29Å; A237-F261 VanDerWaalsContact CA-CZ 3.5Å; A237-F261 HydrophobicContact CB-CE2 3.93Å; A237-F261 HydrophobicContact CB-CZ 3.93Å; V240-F261 HydrophobicContact CB-CZ 4.47Å; V240-F261 HydrophobicContact CG2-CE1 4.04Å; V240-F261 HydrophobicContact CG2-CZ 3.79Å; L248-F261 HydrophobicContact CD1-CE1 3.93Å; A257-F261 VanDerWaalsContact O-CB 3.31Å; A257-F261 WeakPolarHBondContact O-CB 3.13Å; A257-F261 PolarHBondContact O-N 2.96Å; S258-F261 PolarHBondContact O-N 3.31Å; Q259-F261 VanDerWaalsContact C-N 3.3Å; Q259-F261 PolarHBondContact O-N 3.15Å; F261-Q263 VanDerWaalsContact C-N 3.3Å; F261-Q263 PolarHBondContact O-N 3.43Å; F261-E264 CarbonylContact O-C 3.57Å; F261-E264 WeakPolarHBondContact O-CA 3.26Å; F261-E264 WeakPolarHBondContact O-CB 3.35Å; F261-E264 PolarHBondContact O-N 3.41Å; F261-V265 HydrophobicContact CD1-CG2 3.84Å; F261-V265 HydrophobicContact CE1-CG2 3.47Å; F261-V265 VanDerWaalsContact CE1-CG2 3.47Å; F261-V265 HydrophobicContact CZ-CG2 3.96Å; F261-V265 WeakPolarHBondContact O-CG2 3.33Å; F261-V265 PolarHBondContact O-N 3.24Å
262	L	86.9	Confident	84.7	Confident	29 Å²	29	59.8 Å²	59.8	15%	0.152	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-34.4	177.8	-76.5	163.8	0	0	0	112.9	L228 L248 R251 S253 S258 Q259 S260 E264 V265	L228-L262 HydrophobicContact CD2-CD1 4.03Å; L228-L262 HydrophobicContact CD2-CD2 4.29Å; L228-L262 HydrophobicContact CD2-CG 4.36Å; L248-L262 HydrophobicContact CB-CD2 3.87Å; L248-L262 WeakPolarHBondContact O-CD2 3.5Å; R251-L262 WeakPolarHBondContact O-CD1 3.41Å; S253-L262 WeakPolarHBondContact OG-CD1 3.46Å; S258-L262 VanDerWaalsContact O-CB 3.31Å; S258-L262 WeakPolarHBondContact O-CB 3.36Å; S258-L262 WeakPolarHBondContact O-CD1 3.41Å; S258-L262 WeakPolarHBondContact O-CG 3.23Å; S258-L262 PolarHBondContact O-N 2.95Å; Q259-L262 PolarHBondContact O-N 3.19Å; S260-L262 PolarHBondContact O-N 2.94Å; L262-E264 VanDerWaalsContact C-N 3.31Å; L262-V265 PolarHBondContact O-N 3.37Å
263	Q	85.2	Confident	85.4	Confident	151 Å²	151	54.4 Å²	54.4	71%	0.706	29%	0.292	S	S	*	.	H	α-helix	trans	-65.8	-34.9	171.1	-70.5	171.6	-20.5	0	0	111.7	Q259 S260 F261 S266	Q259-Q263 WeakPolarHBondContact O-CG 3.26Å; Q259-Q263 PolarHBondContact O-N 3.43Å; S260-Q263 PolarHBondContact O-N 2.99Å; F261-Q263 VanDerWaalsContact C-N 3.3Å; F261-Q263 PolarHBondContact O-N 3.43Å; Q263-S266 PolarHBondContact O-OG 3.17Å
264	E	87.2	Confident	86.3	Confident	98 Å²	98	57.9 Å²	57.9	46%	0.458	31%	0.305	S	S	.	.	H	α-helix	trans	-79.4	-19.2	175.4	-68.3	177	-156.6	0	0	114.1	S260 F261 L262 S266 F267 H268	S260-E264 WeakPolarHBondContact O-CG 3.32Å; S260-E264 PolarHBondContact O-N 3.37Å; S260-E264 VanDerWaalsContact O-N 3.13Å; F261-E264 CarbonylContact O-C 3.57Å; F261-E264 WeakPolarHBondContact O-CA 3.26Å; F261-E264 WeakPolarHBondContact O-CB 3.35Å; F261-E264 PolarHBondContact O-N 3.41Å; L262-E264 VanDerWaalsContact C-N 3.31Å; E264-S266 PolarHBondContact O-N 3.14Å; E264-F267 PolarHBondContact O-N 2.9Å; E264-H268 PolarHBondContact O-N 3.22Å; E264-H268 PolarHBondContact O-ND1 3.15Å; E264-H268 IonicContact OE2-CE1 3.55Å
265	V	87.9	Confident	87.1	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-42.8	-176.9	164.7	0	0	0	0	112.1	V240 L248 L249 F261 L262 F267 H268 L269	V240-V265 HydrophobicContact CG2-CG1 4.37Å; V240-V265 HydrophobicContact CG2-CG2 4.06Å; L248-V265 HydrophobicContact CB-CG1 4.14Å; L248-V265 HydrophobicContact CB-CG2 4.34Å; L248-V265 HydrophobicContact CD1-CG2 3.77Å; L249-V265 HydrophobicContact CD2-CG1 4.26Å; F261-V265 HydrophobicContact CD1-CG2 3.84Å; F261-V265 HydrophobicContact CE1-CG2 3.47Å; F261-V265 VanDerWaalsContact CE1-CG2 3.47Å; F261-V265 HydrophobicContact CZ-CG2 3.96Å; F261-V265 WeakPolarHBondContact O-CG2 3.33Å; F261-V265 PolarHBondContact O-N 3.24Å; L262-V265 PolarHBondContact O-N 3.37Å; V265-F267 PolarHBondContact O-N 2.88Å; V265-H268 PolarHBondContact O-N 3.49Å; V265-L269 HydrophobicContact CG1-CD1 3.76Å; V265-L269 HydrophobicContact CG1-CG 4.22Å; V265-L269 WeakPolarHBondContact O-CG 3.46Å; V265-L269 PolarHBondContact O-N 3.23Å
266	S	85.6	Confident	87.5	Confident	66 Å²	66	53.1 Å²	53.1	46%	0.462	28%	0.277	S	S	.	.	H	α-helix	trans	-59.2	-49.1	178.8	51.8	0	0	0	0	111	Q263 E264 H268 L269 E270	Q263-S266 PolarHBondContact O-OG 3.17Å; E264-S266 PolarHBondContact O-N 3.14Å; S266-H268 VanDerWaalsContact C-N 3.33Å; S266-H268 PolarHBondContact O-N 3.39Å; S266-L269 PolarHBondContact O-N 3.09Å; S266-E270 WeakPolarHBondContact O-CB 3.49Å; S266-E270 PolarHBondContact O-N 3.23Å
267	F	88.4	Confident	88	Confident	132 Å²	132	54.5 Å²	54.5	58%	0.579	28%	0.276	S	S	*	.	H	α-helix	trans	-63	-36.9	175.4	-178.8	-100.6	0	0	0	112.6	E264 V265 K271	E264-F267 PolarHBondContact O-N 2.9Å; V265-F267 PolarHBondContact O-N 2.88Å; F267-K271 WeakPolarHBondContact O-CB 3.31Å; F267-K271 PolarHBondContact O-N 3.01Å
268	H	88.7	Confident	88.3	Confident	18 Å²	18	52.7 Å²	52.7	8%	0.083	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-43.9	175.5	-76	33.6	0	0	0	112	V240 E264 V265 S266 K271 I272 W296	V240-H268 HydrophobicContact CG1-CB 4.07Å; E264-H268 PolarHBondContact O-N 3.22Å; E264-H268 PolarHBondContact O-ND1 3.15Å; E264-H268 IonicContact OE2-CE1 3.55Å; V265-H268 PolarHBondContact O-N 3.49Å; S266-H268 VanDerWaalsContact C-N 3.33Å; S266-H268 PolarHBondContact O-N 3.39Å; H268-K271 PolarHBondContact O-N 3.3Å; H268-I272 WeakPolarHBondContact O-CD1 3.08Å; H268-I272 VanDerWaalsContact O-CG1 3.23Å; H268-I272 WeakPolarHBondContact O-CG1 3.43Å; H268-I272 PolarHBondContact O-N 3Å; H268-W296 HydrophobicContact CB-CH2 4.45Å
269	L	87.8	Confident	88.6	Confident	20 Å²	20	52.7 Å²	52.7	11%	0.105	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-45.2	177	-73.4	171.9	0	0	0	111.6	V240 L249 V265 S266 K271 I272 N273	V240-L269 HydrophobicContact CG1-CD2 4.38Å; L249-L269 HydrophobicContact CD1-CD1 4.03Å; L249-L269 HydrophobicContact CD2-CD1 4.02Å; L249-L269 HydrophobicContact CG-CD1 4.05Å; V265-L269 HydrophobicContact CG1-CD1 3.76Å; V265-L269 HydrophobicContact CG1-CG 4.22Å; V265-L269 WeakPolarHBondContact O-CG 3.46Å; V265-L269 PolarHBondContact O-N 3.23Å; S266-L269 PolarHBondContact O-N 3.09Å; L269-K271 VanDerWaalsContact C-N 3.31Å; L269-K271 PolarHBondContact O-N 3.33Å; L269-I272 PolarHBondContact O-N 3.22Å; L269-N273 PolarHBondContact O-N 3.41Å
270	E	87.7	Confident	88.8	Confident	94 Å²	94	54.2 Å²	54.2	44%	0.439	27%	0.266	S	S	.	.	H	α-helix	trans	-59.6	-42.7	174.7	-168	-169.1	167.8	0	0	111.2	S266 N273 K274	S266-E270 WeakPolarHBondContact O-CB 3.49Å; S266-E270 PolarHBondContact O-N 3.23Å; E270-N273 PolarHBondContact O-N 2.92Å; E270-K274 HydrophobicContact CG-CD 4.39Å; E270-K274 WeakPolarHBondContact O-CB 3.01Å; E270-K274 WeakPolarHBondContact O-CG 3.3Å; E270-K274 PolarHBondContact O-N 3.37Å; E270-K274 WeakPolarHBondContact OE1-CE 3.41Å; E270-K274 IonicContact OE1-NZ 3.37Å; E270-K274 PolarHBondContact OE1-NZ 3.47Å
271	K	90.9	Very high	89	Confident	33 Å²	33	56.7 Å²	56.7	14%	0.143	28%	0.275	C	S	.	.	H	α-helix	trans	-65	-39.9	175.7	-178.8	163.3	179.4	167.9	0	112.7	F267 H268 L269 K274 I275 L290 W296	F267-K271 WeakPolarHBondContact O-CB 3.31Å; F267-K271 PolarHBondContact O-N 3.01Å; H268-K271 PolarHBondContact O-N 3.3Å; L269-K271 VanDerWaalsContact C-N 3.31Å; L269-K271 PolarHBondContact O-N 3.33Å; K271-K274 PolarHBondContact O-N 3.06Å; K271-I275 HydrophobicContact CG-CD1 4.13Å; K271-I275 WeakPolarHBondContact O-CD1 3.39Å; K271-I275 VanDerWaalsContact O-CG1 3.27Å; K271-I275 WeakPolarHBondContact O-CG1 3.38Å; K271-I275 PolarHBondContact O-N 3.48Å; K271-L290 WeakPolarHBondContact CE-O 3.36Å; K271-L290 HydrophobicContact CG-CD2 4.44Å; K271-L290 PolarHBondContact NZ-O 3.31Å; K271-W296 HydrophobicContact CB-CZ3 4.34Å; K271-W296 HydrophobicContact CD-CD2 4.35Å; K271-W296 HydrophobicContact CD-CE3 4.37Å; K271-W296 HydrophobicContact CD-CH2 4Å; K271-W296 HydrophobicContact CD-CZ2 3.94Å; K271-W296 HydrophobicContact CD-CZ3 4.19Å; K271-W296 HydrophobicContact CG-CE3 4.32Å; K271-W296 HydrophobicContact CG-CH2 4.41Å; K271-W296 HydrophobicContact CG-CZ3 4.16Å
272	I	90.3	Very high	88.9	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-46.8	174.9	-70.4	164.7	0	0	0	110	V240 F241 H268 L269 K274 I275 H276 W296 A299	V240-I272 HydrophobicContact CG1-CD1 3.99Å; F241-I272 HydrophobicContact CD1-CD1 4.18Å; F241-I272 HydrophobicContact CE1-CD1 4.49Å; H268-I272 WeakPolarHBondContact O-CD1 3.08Å; H268-I272 VanDerWaalsContact O-CG1 3.23Å; H268-I272 WeakPolarHBondContact O-CG1 3.43Å; H268-I272 PolarHBondContact O-N 3Å; L269-I272 PolarHBondContact O-N 3.22Å; I272-K274 PolarHBondContact O-N 3.32Å; I272-I275 WeakPolarHBondContact O-CB 3.13Å; I272-I275 PolarHBondContact O-N 3.13Å; I272-H276 PolarHBondContact O-CD2 3.26Å; I272-H276 VanDerWaalsContact O-CD2 3.25Å; I272-H276 PolarHBondContact O-N 3.34Å; I272-W296 HydrophobicContact CG1-CE3 4.19Å; I272-W296 HydrophobicContact CG1-CZ3 4.06Å; I272-A299 HydrophobicContact CD1-CB 3.92Å; I272-A299 HydrophobicContact CG1-CB 3.78Å; I272-A299 HydrophobicContact CG2-CB 4.37Å
273	N	89	Confident	89.1	Confident	72 Å²	72	59.8 Å²	59.8	39%	0.385	30%	0.299	S	S	.	.	H	α-helix	trans	-59.6	-47.1	176.9	-69	-15.9	0	0	0	111.4	L269 E270 I275 H276 E277	L269-N273 PolarHBondContact O-N 3.41Å; E270-N273 PolarHBondContact O-N 2.92Å; N273-I275 VanDerWaalsContact C-N 3.31Å; N273-I275 PolarHBondContact O-N 3.41Å; N273-H276 CarbonylContact O-C 3.58Å; N273-H276 PolarHBondContact O-N 2.97Å; N273-H276 VanDerWaalsContact O-N 3.08Å; N273-E277 WeakPolarHBondContact O-CG 3.04Å; N273-E277 PolarHBondContact O-N 2.8Å
274	K	91.2	Very high	89.3	Confident	91 Å²	91	55.8 Å²	55.8	40%	0.396	28%	0.281	S	S	.	.	H	α-helix	trans	-60	-35.5	175.8	-74.5	177.1	-178	173.7	0	113.5	E270 K271 I272 A278 L290	E270-K274 HydrophobicContact CG-CD 4.39Å; E270-K274 WeakPolarHBondContact O-CB 3.01Å; E270-K274 WeakPolarHBondContact O-CG 3.3Å; E270-K274 PolarHBondContact O-N 3.37Å; E270-K274 WeakPolarHBondContact OE1-CE 3.41Å; E270-K274 IonicContact OE1-NZ 3.37Å; E270-K274 PolarHBondContact OE1-NZ 3.47Å; K271-K274 PolarHBondContact O-N 3.06Å; I272-K274 PolarHBondContact O-N 3.32Å; K274-A278 VanDerWaalsContact O-CB 3.27Å; K274-A278 WeakPolarHBondContact O-CB 3.39Å; K274-A278 PolarHBondContact O-N 3.35Å; K274-L290 HydrophobicContact CB-CD1 3.89Å
275	I	91	Very high	89.3	Confident	1 Å²	1	54 Å²	54	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-48.6	172.6	-69	158.6	0	0	0	110	K271 I272 N273 E277 A278 V279 L290 W296 P307	K271-I275 HydrophobicContact CG-CD1 4.13Å; K271-I275 WeakPolarHBondContact O-CD1 3.39Å; K271-I275 VanDerWaalsContact O-CG1 3.27Å; K271-I275 WeakPolarHBondContact O-CG1 3.38Å; K271-I275 PolarHBondContact O-N 3.48Å; I272-I275 WeakPolarHBondContact O-CB 3.13Å; I272-I275 PolarHBondContact O-N 3.13Å; N273-I275 VanDerWaalsContact C-N 3.31Å; N273-I275 PolarHBondContact O-N 3.41Å; I275-E277 VanDerWaalsContact C-N 3.33Å; I275-E277 PolarHBondContact O-N 3.25Å; I275-A278 PolarHBondContact O-N 3.48Å; I275-V279 HydrophobicContact CG2-CG2 4.33Å; I275-V279 WeakPolarHBondContact O-CB 3.23Å; I275-V279 WeakPolarHBondContact O-CG2 3.19Å; I275-V279 PolarHBondContact O-N 2.87Å; I275-L290 HydrophobicContact CD1-CB 4.31Å; I275-L290 HydrophobicContact CG1-CB 3.52Å; I275-L290 HydrophobicContact CG1-CD1 4.23Å; I275-L290 HydrophobicContact CG1-CG 4.46Å; I275-W296 HydrophobicContact CD1-CB 3.82Å; I275-W296 HydrophobicContact CD1-CD2 4.41Å; I275-W296 HydrophobicContact CD1-CE3 4.19Å; I275-W296 HydrophobicContact CD1-CG 4.3Å; I275-P307 HydrophobicContact CG2-CB 4.28Å; I275-P307 HydrophobicContact CG2-CG 3.78Å
276	H	90	Very high	89.4	Confident	15 Å²	15	55.3 Å²	55.3	7%	0.069	29%	0.294	C	S	.	.	H	α-helix	trans	-66.2	-33.5	179.3	-77.3	-76.4	0	0	0	113.1	I272 N273 K280 E305 T306 P307 T310	I272-H276 PolarHBondContact O-CD2 3.26Å; I272-H276 VanDerWaalsContact O-CD2 3.25Å; I272-H276 PolarHBondContact O-N 3.34Å; N273-H276 CarbonylContact O-C 3.58Å; N273-H276 PolarHBondContact O-N 2.97Å; N273-H276 VanDerWaalsContact O-N 3.08Å; H276-K280 WeakPolarHBondContact O-CB 3.4Å; H276-K280 PolarHBondContact O-N 3.24Å; H276-E305 PolarHBondContact NE2-O 3.42Å; H276-T306 WeakPolarHBondContact NE2-CA 3.41Å; H276-T306 PolarHBondContact NE2-N 3.02Å; H276-T306 PolarHBondContact NE2-O 3.37Å; H276-P307 VanDerWaalsContact NE2-CD 3.29Å; H276-P307 WeakPolarHBondContact NE2-CD 3.48Å; H276-T310 WeakPolarHBondContact CE1-CB 3.13Å; H276-T310 WeakPolarHBondContact CE1-CG2 3.45Å; H276-T310 PolarHBondContact CE1-OG1 2.79Å; H276-T310 VanDerWaalsContact ND1-CG2 3.34Å; H276-T310 WeakPolarHBondContact ND1-CG2 3.4Å; H276-T310 PolarHBondContact ND1-OG1 3.41Å; H276-T310 VanDerWaalsContact ND1-OG1 3.09Å
277	E	90.3	Very high	89.6	Confident	114 Å²	114	52.2 Å²	52.2	53%	0.533	27%	0.272	S	S	.	.	H	α-helix	trans	-68.8	-46.8	173	-73.4	176.4	162	0	0	112	N273 I275 V279 K280 N281	N273-E277 WeakPolarHBondContact O-CG 3.04Å; N273-E277 PolarHBondContact O-N 2.8Å; I275-E277 VanDerWaalsContact C-N 3.33Å; I275-E277 PolarHBondContact O-N 3.25Å; E277-V279 VanDerWaalsContact C-N 3.34Å; E277-V279 PolarHBondContact O-N 3.3Å; E277-K280 PolarHBondContact O-N 3.01Å; E277-N281 VanDerWaalsContact O-CB 3.3Å; E277-N281 WeakPolarHBondContact O-CB 3.5Å; E277-N281 PolarHBondContact O-N 2.83Å; E277-N281 PolarHBondContact O-ND2 2.84Å
278	A	92	Very high	89.6	Confident	7 Å²	7	49.7 Å²	49.7	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-47	174.7	0	0	0	0	0	111.3	K274 I275 N281 G282 D283 A286	K274-A278 VanDerWaalsContact O-CB 3.27Å; K274-A278 WeakPolarHBondContact O-CB 3.39Å; K274-A278 PolarHBondContact O-N 3.35Å; I275-A278 PolarHBondContact O-N 3.48Å; A278-N281 PolarHBondContact O-N 2.82Å; A278-G282 PolarHBondContact O-N 2.89Å; A278-D283 HydrophobicContact CB-CB 4.43Å; A278-D283 PolarHBondContact O-N 3.07Å; A278-A286 HydrophobicContact CB-CB 3.83Å
279	V	91.3	Very high	89.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-47.3	174.9	174	0	0	0	0	111	I275 E277 N281 G282 T287 P307 A311 R316 I319	I275-V279 HydrophobicContact CG2-CG2 4.33Å; I275-V279 WeakPolarHBondContact O-CB 3.23Å; I275-V279 WeakPolarHBondContact O-CG2 3.19Å; I275-V279 PolarHBondContact O-N 2.87Å; E277-V279 VanDerWaalsContact C-N 3.34Å; E277-V279 PolarHBondContact O-N 3.3Å; V279-N281 VanDerWaalsContact C-N 3.34Å; V279-N281 PolarHBondContact O-N 3.37Å; V279-G282 PolarHBondContact O-N 2.9Å; V279-T287 HydrophobicContact CG2-CG2 3.99Å; V279-P307 HydrophobicContact CG2-CB 4.39Å; V279-A311 HydrophobicContact CG1-CB 3.8Å; V279-R316 WeakPolarHBondContact O-CG 3.41Å; V279-I319 HydrophobicContact CG1-CG2 4.24Å; V279-I319 HydrophobicContact CG2-CG2 4.04Å
280	K	89.4	Confident	89.5	Confident	121 Å²	121	56.8 Å²	56.8	53%	0.526	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-43.4	179.1	-177.8	-177	178.3	-170.5	0	111.9	H276 E277 G282 R316	H276-K280 WeakPolarHBondContact O-CB 3.4Å; H276-K280 PolarHBondContact O-N 3.24Å; E277-K280 PolarHBondContact O-N 3.01Å; K280-G282 VanDerWaalsContact C-N 3.29Å; K280-G282 PolarHBondContact O-N 3.25Å; K280-R316 PolarHBondContact O-NE 3.09Å; K280-R316 PolarHBondContact O-NH2 3.37Å
281	N	88.4	Confident	89.4	Confident	114 Å²	114	52.3 Å²	52.3	61%	0.61	28%	0.277	S	S	*	.	H	α-helix	trans	-73.1	-21.2	-179.5	-65.8	-9.6	0	0	0	112.8	E277 A278 V279 R316	E277-N281 VanDerWaalsContact O-CB 3.3Å; E277-N281 WeakPolarHBondContact O-CB 3.5Å; E277-N281 PolarHBondContact O-N 2.83Å; E277-N281 PolarHBondContact O-ND2 2.84Å; A278-N281 PolarHBondContact O-N 2.82Å; V279-N281 VanDerWaalsContact C-N 3.34Å; V279-N281 PolarHBondContact O-N 3.37Å; N281-R316 VanDerWaalsContact C-NH2 3.34Å; N281-R316 PolarHBondContact O-NH2 3.34Å; N281-R316 VanDerWaalsContact O-NH2 3.11Å
282	G	87.9	Confident	89	Confident	29 Å²	29	55.1 Å²	55.1	30%	0.299	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	13.9	-174.9	0	0	0	0	0	113.8	A278 V279 K280 M284	A278-G282 PolarHBondContact O-N 2.89Å; V279-G282 PolarHBondContact O-N 2.9Å; K280-G282 VanDerWaalsContact C-N 3.29Å; K280-G282 PolarHBondContact O-N 3.25Å; G282-M284 PolarHBondContact O-N 3.27Å
283	D	90.1	Very high	88.9	Confident	76 Å²	76	56.6 Å²	56.6	41%	0.406	31%	0.309	S	S	.	.			trans	-75.2	95.1	178.1	-173	-16.7	0	0	0	110.4	A278 A285 A286 T287	A278-D283 HydrophobicContact CB-CB 4.43Å; A278-D283 PolarHBondContact O-N 3.07Å; D283-A285 PolarHBondContact OD1-N 3.08Å; D283-A286 HydrophobicContact CB-CB 4.08Å; D283-A286 PolarHBondContact OD1-N 2.92Å; D283-A286 VanDerWaalsContact OD2-CB 3.25Å; D283-A286 WeakPolarHBondContact OD2-CB 3.42Å; D283-T287 WeakPolarHBondContact O-CB 3.33Å; D283-T287 PolarHBondContact O-N 3.41Å; D283-T287 PolarHBondContact O-OG1 2.96Å
284	M	89	Confident	88.7	Confident	67 Å²	67	57 Å²	57	33%	0.33	31%	0.308	S	S	.	.	H	α-helix	trans	-64.2	-41.8	179.6	-154	-61.6	-53	0	0	110.9	G282 T287 Q288 I319	G282-M284 PolarHBondContact O-N 3.27Å; M284-T287 WeakPolarHBondContact O-CB 3.48Å; M284-T287 PolarHBondContact O-N 3.27Å; M284-Q288 VanDerWaalsContact CE-CD 3.4Å; M284-Q288 HydrophobicContact CE-CG 3.84Å; M284-Q288 WeakPolarHBondContact O-CG 3.35Å; M284-Q288 PolarHBondContact O-N 3.14Å; M284-Q288 VanDerWaalsContact SD-CD 3.57Å; M284-Q288 HydrophobicContact SD-CG 3.5Å; M284-Q288 VanDerWaalsContact SD-CG 3.5Å; M284-Q288 PolarHBondContact SD-NE2 3.28Å; M284-I319 HydrophobicContact CB-CG1 4.42Å; M284-I319 HydrophobicContact CG-CG1 4.23Å
285	A	88.9	Confident	88.4	Confident	59 Å²	59	57.7 Å²	57.7	49%	0.488	31%	0.311	S	S	.	.	H	α-helix	trans	-67.7	-46.3	-176.7	0	0	0	0	0	111.9	D283 T287 Q288 M289	D283-A285 PolarHBondContact OD1-N 3.08Å; A285-T287 VanDerWaalsContact C-N 3.27Å; A285-T287 PolarHBondContact O-N 3.22Å; A285-Q288 PolarHBondContact O-N 2.86Å; A285-M289 WeakPolarHBondContact O-CG 3.27Å; A285-M289 PolarHBondContact O-N 3.12Å
286	A	89.3	Confident	88.3	Confident	29 Å²	29	58.4 Å²	58.4	24%	0.24	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-37.6	171.9	0	0	0	0	0	111.5	A278 D283 M289 L290	A278-A286 HydrophobicContact CB-CB 3.83Å; D283-A286 HydrophobicContact CB-CB 4.08Å; D283-A286 PolarHBondContact OD1-N 2.92Å; D283-A286 VanDerWaalsContact OD2-CB 3.25Å; D283-A286 WeakPolarHBondContact OD2-CB 3.42Å; A286-M289 PolarHBondContact O-N 2.62Å; A286-L290 VanDerWaalsContact O-CB 3.32Å; A286-L290 WeakPolarHBondContact O-CB 3.4Å; A286-L290 WeakPolarHBondContact O-CG 3.46Å; A286-L290 PolarHBondContact O-N 3.43Å
287	T	88.8	Confident	88.1	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.006	31%	0.311	C	S	.	.	H	α-helix	trans	-64.1	-43.9	177.2	-57.1	0	0	0	0	112	V279 D283 M284 A285 L290 A291 I319	V279-T287 HydrophobicContact CG2-CG2 3.99Å; D283-T287 WeakPolarHBondContact O-CB 3.33Å; D283-T287 PolarHBondContact O-N 3.41Å; D283-T287 PolarHBondContact O-OG1 2.96Å; M284-T287 WeakPolarHBondContact O-CB 3.48Å; M284-T287 PolarHBondContact O-N 3.27Å; A285-T287 VanDerWaalsContact C-N 3.27Å; A285-T287 PolarHBondContact O-N 3.22Å; T287-L290 PolarHBondContact O-N 3.04Å; T287-A291 HydrophobicContact CG2-CB 4.39Å; T287-A291 WeakPolarHBondContact O-CB 3.19Å; T287-A291 PolarHBondContact O-N 3.48Å; T287-I319 HydrophobicContact CG2-CG2 3.98Å
288	Q	88.5	Confident	88	Confident	80 Å²	80	55.5 Å²	55.5	37%	0.374	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-44.8	174.4	-67.3	-166.6	-20.6	0	0	112.2	M284 A285 L290 Y322	M284-Q288 VanDerWaalsContact CE-CD 3.4Å; M284-Q288 HydrophobicContact CE-CG 3.84Å; M284-Q288 WeakPolarHBondContact O-CG 3.35Å; M284-Q288 PolarHBondContact O-N 3.14Å; M284-Q288 VanDerWaalsContact SD-CD 3.57Å; M284-Q288 HydrophobicContact SD-CG 3.5Å; M284-Q288 VanDerWaalsContact SD-CG 3.5Å; M284-Q288 PolarHBondContact SD-NE2 3.28Å; A285-Q288 PolarHBondContact O-N 2.86Å; Q288-L290 VanDerWaalsContact C-N 3.34Å; Q288-L290 PolarHBondContact O-N 2.89Å; Q288-Y322 HydrophobicContact CB-CE1 4.5Å; Q288-Y322 HydrophobicContact CG-CD1 4.35Å; Q288-Y322 HydrophobicContact CG-CD2 4.31Å; Q288-Y322 HydrophobicContact CG-CE1 3.87Å; Q288-Y322 HydrophobicContact CG-CE2 3.81Å
289	M	88.4	Confident	87.9	Confident	148 Å²	148	55.2 Å²	55.2	73%	0.729	30%	0.299	S	S	*	.	H	α-helix	trans	-67.1	-31.7	-179.5	-74.1	-62.9	-67.4	0	0	113.4	A285 A286 T292	A285-M289 WeakPolarHBondContact O-CG 3.27Å; A285-M289 PolarHBondContact O-N 3.12Å; A286-M289 PolarHBondContact O-N 2.62Å; M289-T292 WeakPolarHBondContact O-CG2 3.26Å
290	L	88	Confident	87.8	Confident	38 Å²	38	58 Å²	58	20%	0.199	31%	0.31	C	S	.	.	H	α-helix	trans	-91	-41.6	-177.9	-65.1	171.1	0	0	0	112.8	K271 K274 I275 A286 T287 Q288 T292	K271-L290 WeakPolarHBondContact CE-O 3.36Å; K271-L290 HydrophobicContact CG-CD2 4.44Å; K271-L290 PolarHBondContact NZ-O 3.31Å; K274-L290 HydrophobicContact CB-CD1 3.89Å; I275-L290 HydrophobicContact CD1-CB 4.31Å; I275-L290 HydrophobicContact CG1-CB 3.52Å; I275-L290 HydrophobicContact CG1-CD1 4.23Å; I275-L290 HydrophobicContact CG1-CG 4.46Å; A286-L290 VanDerWaalsContact O-CB 3.32Å; A286-L290 WeakPolarHBondContact O-CB 3.4Å; A286-L290 WeakPolarHBondContact O-CG 3.46Å; A286-L290 PolarHBondContact O-N 3.43Å; T287-L290 PolarHBondContact O-N 3.04Å; Q288-L290 VanDerWaalsContact C-N 3.34Å; Q288-L290 PolarHBondContact O-N 2.89Å; L290-T292 VanDerWaalsContact C-N 3.25Å; L290-T292 PolarHBondContact O-N 3.2Å; L290-T292 VanDerWaalsContact O-N 3.13Å
291	A	84.3	Confident	87.6	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.288	C	S	.	.			trans	-85.5	33.1	-172.3	0	0	0	0	0	114.4	T287 A293 L323 F327	T287-A291 HydrophobicContact CG2-CB 4.39Å; T287-A291 WeakPolarHBondContact O-CB 3.19Å; T287-A291 PolarHBondContact O-N 3.48Å; A291-A293 PolarHBondContact O-N 3.44Å; A291-L323 HydrophobicContact CB-CD2 4.18Å; A291-F327 VanDerWaalsContact O-CE2 3.28Å; A291-F327 WeakPolarHBondContact O-CE2 3.45Å; A291-F327 WeakPolarHBondContact O-CZ 3.48Å
292	T	83.7	Confident	87.2	Confident	92 Å²	92	55.1 Å²	55.1	56%	0.564	29%	0.288	S	S	*	.			trans	-62.5	-4.5	-172.5	56.9	0	0	0	0	116.7	M289 L290	M289-T292 WeakPolarHBondContact O-CG2 3.26Å; L290-T292 VanDerWaalsContact C-N 3.25Å; L290-T292 PolarHBondContact O-N 3.2Å; L290-T292 VanDerWaalsContact O-N 3.13Å
293	A	86.4	Confident	86.6	Confident	34 Å²	34	59.3 Å²	59.3	28%	0.281	30%	0.3	S	S	.	.	S	Bend	trans	-151.9	148.7	-178.2	0	0	0	0	0	112.3	A291 K295 W296 A297	A291-A293 PolarHBondContact O-N 3.44Å; A293-K295 HydrophobicContact CB-CG 4.28Å; A293-K295 PolarHBondContact O-N 3.28Å; A293-W296 WeakPolarHBondContact O-CB 3.48Å; A293-W296 PolarHBondContact O-N 3.17Å; A293-A297 PolarHBondContact O-N 3.13Å
294	K	84.9	Confident	86.2	Confident	82 Å²	82	55.7 Å²	55.7	36%	0.357	28%	0.281	S	S	.	.	H	α-helix	trans	-44.7	-35.7	177.6	-177.5	177.7	180	177.5	0	114.7	W296 A297 I298 F327 E329	K294-W296 VanDerWaalsContact C-N 3.3Å; K294-W296 PolarHBondContact O-N 3.17Å; K294-A297 PolarHBondContact O-N 3.45Å; K294-I298 HydrophobicContact CD-CD1 4.47Å; K294-I298 HydrophobicContact CG-CD1 3.74Å; K294-I298 WeakPolarHBondContact O-CG1 3.49Å; K294-I298 PolarHBondContact O-N 2.99Å; K294-F327 HydrophobicContact CB-CD1 3.96Å; K294-F327 HydrophobicContact CB-CE1 4.25Å; K294-F327 VanDerWaalsContact N-CE1 3.33Å; K294-E329 IonicContact NZ-OE1 2.76Å; K294-E329 PolarHBondContact NZ-OE1 2.88Å; K294-E329 IonicContact NZ-OE2 3.7Å; K294-E329 PolarHBondContact NZ-OE2 2.8Å
295	K	86.1	Confident	86.1	Confident	105 Å²	105	53.7 Å²	53.7	46%	0.457	27%	0.27	S	S	.	.	H	α-helix	trans	-62.2	-34.1	177.5	68.3	178.6	-174.9	171.2	0	113.4	F241 A293 A299	F241-K295 HydrophobicContact CE2-CB 4.49Å; F241-K295 HydrophobicContact CE2-CD 4.4Å; F241-K295 HydrophobicContact CZ-CB 4.33Å; F241-K295 HydrophobicContact CZ-CD 3.93Å; F241-K295 HydrophobicContact CZ-CG 4.31Å; A293-K295 HydrophobicContact CB-CG 4.28Å; A293-K295 PolarHBondContact O-N 3.28Å; K295-A299 PolarHBondContact O-N 3.03Å
296	W	89.2	Confident	86.2	Confident	16 Å²	16	51 Å²	51	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-80	-37.6	178.1	-59.2	122.1	0	0	0	111.4	F241 H268 K271 I272 I275 A293 K294 I298 A299	F241-W296 AromaticContact CE1-CE3 3.93Å; F241-W296 HydrophobicContact CE1-CE3 3.93Å; F241-W296 HydrophobicContact CE1-CH2 4.25Å; F241-W296 AromaticContact CE1-CZ3 3.74Å; F241-W296 HydrophobicContact CE1-CZ3 3.74Å; F241-W296 HydrophobicContact CZ-CZ3 4.45Å; H268-W296 HydrophobicContact CB-CH2 4.45Å; K271-W296 HydrophobicContact CB-CZ3 4.34Å; K271-W296 HydrophobicContact CD-CD2 4.35Å; K271-W296 HydrophobicContact CD-CE3 4.37Å; K271-W296 HydrophobicContact CD-CH2 4Å; K271-W296 HydrophobicContact CD-CZ2 3.94Å; K271-W296 HydrophobicContact CD-CZ3 4.19Å; K271-W296 HydrophobicContact CG-CE3 4.32Å; K271-W296 HydrophobicContact CG-CH2 4.41Å; K271-W296 HydrophobicContact CG-CZ3 4.16Å; I272-W296 HydrophobicContact CG1-CE3 4.19Å; I272-W296 HydrophobicContact CG1-CZ3 4.06Å; I275-W296 HydrophobicContact CD1-CB 3.82Å; I275-W296 HydrophobicContact CD1-CD2 4.41Å; I275-W296 HydrophobicContact CD1-CE3 4.19Å; I275-W296 HydrophobicContact CD1-CG 4.3Å; A293-W296 WeakPolarHBondContact O-CB 3.48Å; A293-W296 PolarHBondContact O-N 3.17Å; K294-W296 VanDerWaalsContact C-N 3.3Å; K294-W296 PolarHBondContact O-N 3.17Å; W296-I298 PolarHBondContact O-N 3Å; W296-A299 WeakPolarHBondContact O-CB 3.05Å; W296-A299 PolarHBondContact O-N 3.2Å
297	A	85.8	Confident	86.3	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-20.3	176.3	0	0	0	0	0	114.4	A293 K294 P307 L323 F327 T330	A293-A297 PolarHBondContact O-N 3.13Å; K294-A297 PolarHBondContact O-N 3.45Å; A297-P307 WeakPolarHBondContact O-CD 3.42Å; A297-L323 HydrophobicContact CB-CD2 4.37Å; A297-F327 HydrophobicContact CB-CB 4.42Å; A297-F327 HydrophobicContact CB-CD2 3.5Å; A297-F327 HydrophobicContact CB-CE2 3.99Å; A297-F327 HydrophobicContact CB-CG 4.08Å; A297-T330 HydrophobicContact CB-CG2 4.34Å
298	I	88.1	Confident	86.4	Confident	67 Å²	67	49.6 Å²	49.6	34%	0.344	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-12.4	177.3	-61.1	171.7	0	0	0	112	K294 W296 R300 T306 T330	K294-I298 HydrophobicContact CD-CD1 4.47Å; K294-I298 HydrophobicContact CG-CD1 3.74Å; K294-I298 WeakPolarHBondContact O-CG1 3.49Å; K294-I298 PolarHBondContact O-N 2.99Å; W296-I298 PolarHBondContact O-N 3Å; I298-R300 PolarHBondContact O-N 3.12Å; I298-T306 WeakPolarHBondContact O-CG2 3.46Å; I298-T330 HydrophobicContact CD1-CG2 3.97Å; I298-T330 HydrophobicContact CG1-CG2 3.53Å
299	A	89.1	Confident	86.5	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.008	22%	0.219	C	C	.	.			trans	-62.1	132.4	-175	0	0	0	0	0	111.3	F241 I272 K295 W296 P307	F241-A299 HydrophobicContact CD1-CB 3.87Å; I272-A299 HydrophobicContact CD1-CB 3.92Å; I272-A299 HydrophobicContact CG1-CB 3.78Å; I272-A299 HydrophobicContact CG2-CB 4.37Å; K295-A299 PolarHBondContact O-N 3.03Å; W296-A299 WeakPolarHBondContact O-CB 3.05Å; W296-A299 PolarHBondContact O-N 3.2Å; A299-P307 WeakPolarHBondContact O-CD 3.32Å
300	R	88.6	Confident	86.6	Confident	59 Å²	59	39.2 Å²	39.2	22%	0.223	19%	0.187	C	C	.	.			trans	-94.8	144.9	-178.1	-65.2	173.4	174.6	169	-4.3	112.3	F241 S242 G243 I298 G304 E305 T306 K334 D335	F241-R300 PolarHBondContact O-N 3.35Å; S242-R300 VanDerWaalsContact O-CD 3.3Å; S242-R300 WeakPolarHBondContact O-CD 3.26Å; G243-R300 WeakPolarHBondContact CA-O 3.38Å; I298-R300 PolarHBondContact O-N 3.12Å; R300-G304 VanDerWaalsContact CD-O 3.25Å; R300-G304 WeakPolarHBondContact CD-O 3.22Å; R300-G304 VanDerWaalsContact CG-O 3.29Å; R300-G304 WeakPolarHBondContact CG-O 3.43Å; R300-E305 VanDerWaalsContact CA-O 3.27Å; R300-E305 WeakPolarHBondContact CA-O 2.94Å; R300-T306 HydrophobicContact CG-CG2 3.95Å; R300-K334 VanDerWaalsContact CZ-O 3.26Å; R300-K334 PolarHBondContact NE-O 3.48Å; R300-K334 VanDerWaalsContact NE-O 3.08Å; R300-K334 PolarHBondContact NH2-O 3.05Å; R300-D335 PolarHBondContact NH2-O 2.83Å; R300-D335 VanDerWaalsContact NH2-O 3.17Å
301	N	86.1	Confident	86.8	Confident	14 Å²	14	37.4 Å²	37.4	8%	0.075	18%	0.177	C	C	.	.			trans	-74.5	-179	166.3	67.1	11.2	0	0	0	111.8	Q303 G304 E305	N301-Q303 PolarHBondContact ND2-OE1 2.9Å; N301-Q303 PolarHBondContact O-N 3.49Å; N301-Q303 WeakPolarHBondContact OD1-CA 3.41Å; N301-Q303 WeakPolarHBondContact OD1-CB 3.38Å; N301-Q303 PolarHBondContact OD1-N 3.15Å; N301-Q303 PolarHBondContact OD1-OE1 3.46Å; N301-G304 PolarHBondContact O-N 2.72Å; N301-G304 PolarHBondContact OD1-N 3.25Å; N301-E305 PolarHBondContact N-O 3.2Å; N301-E305 PolarHBondContact ND2-OE2 3.03Å; N301-E305 WeakPolarHBondContact OD1-CB 3.24Å; N301-E305 PolarHBondContact OD1-N 3.26Å; N301-E305 PolarHBondContact OD1-O 2.94Å
302	R	79.4	Confident	87.1	Confident	159 Å²	159	37.4 Å²	37.4	60%	0.6	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.4	176.3	-74.9	-176.1	173	171	2.1	113.6	D246 G304	D246-R302 VanDerWaalsContact CG-NH2 3.3Å; D246-R302 IonicContact OD1-CZ 2.72Å; D246-R302 IonicContact OD1-NE 2.83Å; D246-R302 PolarHBondContact OD1-NE 2.72Å; D246-R302 IonicContact OD1-NH2 3.95Å; D246-R302 PolarHBondContact OD1-NH2 2.84Å; D246-R302 WeakPolarHBondContact OD2-CG 3.26Å; D246-R302 IonicContact OD2-CZ 3.8Å; D246-R302 IonicContact OD2-NE 3.48Å; D246-R302 PolarHBondContact OD2-NE 2.76Å; D246-R302 IonicContact OD2-NH2 3.15Å; R302-G304 VanDerWaalsContact C-N 3.32Å
303	Q	76	Confident	87.3	Confident	118 Å²	118	36.6 Å²	36.6	55%	0.551	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.1	177	-62.7	74.4	7	0	0	112.5	N301 E305 Y336	N301-Q303 PolarHBondContact ND2-OE1 2.9Å; N301-Q303 PolarHBondContact O-N 3.49Å; N301-Q303 WeakPolarHBondContact OD1-CA 3.41Å; N301-Q303 WeakPolarHBondContact OD1-CB 3.38Å; N301-Q303 PolarHBondContact OD1-N 3.15Å; N301-Q303 PolarHBondContact OD1-OE1 3.46Å; Q303-E305 HydrophobicContact CB-CG 4.12Å; Q303-Y336 WeakPolarHBondContact O-CD2 3.38Å
304	G	82	Confident	87.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	89.2	1.1	-178.2	0	0	0	0	0	114.4	R300 N301 R302 D335 Y336	R300-G304 VanDerWaalsContact CD-O 3.25Å; R300-G304 WeakPolarHBondContact CD-O 3.22Å; R300-G304 VanDerWaalsContact CG-O 3.29Å; R300-G304 WeakPolarHBondContact CG-O 3.43Å; N301-G304 PolarHBondContact O-N 2.72Å; N301-G304 PolarHBondContact OD1-N 3.25Å; R302-G304 VanDerWaalsContact C-N 3.32Å; G304-D335 VanDerWaalsContact O-CA 3.29Å; G304-D335 WeakPolarHBondContact O-CA 3.43Å; G304-Y336 VanDerWaalsContact N-CE2 3.27Å
305	E	86.3	Confident	87.5	Confident	24 Å²	24	37.7 Å²	37.7	11%	0.112	18%	0.175	C	C	.	.			trans	-78.8	137.6	-178.2	-58.1	175.6	137.1	0	0	110.2	H276 R300 N301 Q303 H309 T310 N313 Y344	H276-E305 PolarHBondContact NE2-O 3.42Å; R300-E305 VanDerWaalsContact CA-O 3.27Å; R300-E305 WeakPolarHBondContact CA-O 2.94Å; N301-E305 PolarHBondContact N-O 3.2Å; N301-E305 PolarHBondContact ND2-OE2 3.03Å; N301-E305 WeakPolarHBondContact OD1-CB 3.24Å; N301-E305 PolarHBondContact OD1-N 3.26Å; N301-E305 PolarHBondContact OD1-O 2.94Å; Q303-E305 HydrophobicContact CB-CG 4.12Å; E305-H309 HydrophobicContact CB-CB 3.75Å; E305-H309 HydrophobicContact CG-CB 4.3Å; E305-T310 HydrophobicContact CB-CG2 4.25Å; E305-N313 PolarHBondContact OE1-ND2 2.67Å; E305-Y344 WeakPolarHBondContact OE1-CE1 3.4Å; E305-Y344 PolarHBondContact OE1-OH 2.98Å
306	T	90.7	Very high	87.7	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.012	17%	0.17	C	C	.	.			trans	-85.7	165.7	169.7	68.4	0	0	0	0	111.1	H276 I298 R300 L308 H309 T310 A333	H276-T306 WeakPolarHBondContact NE2-CA 3.41Å; H276-T306 PolarHBondContact NE2-N 3.02Å; H276-T306 PolarHBondContact NE2-O 3.37Å; I298-T306 WeakPolarHBondContact O-CG2 3.46Å; R300-T306 HydrophobicContact CG-CG2 3.95Å; T306-L308 PolarHBondContact O-N 2.81Å; T306-L308 VanDerWaalsContact O-N 3.07Å; T306-H309 PolarHBondContact N-ND1 2.83Å; T306-H309 WeakPolarHBondContact O-CA 3.49Å; T306-H309 WeakPolarHBondContact O-CB 3.19Å; T306-H309 PolarHBondContact O-N 2.89Å; T306-H309 PolarHBondContact OG1-ND1 3.21Å; T306-T310 PolarHBondContact O-N 3.21Å; T306-T310 PolarHBondContact O-OG1 3.27Å; T306-A333 HydrophobicContact CG2-CB 4.09Å
307	P	91	Very high	87.7	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-46.9	-37.5	174.6	-35.8	35.7	0	0	0	114.6	I275 H276 V279 A297 A299 T310 A311 L323	I275-P307 HydrophobicContact CG2-CB 4.28Å; I275-P307 HydrophobicContact CG2-CG 3.78Å; H276-P307 VanDerWaalsContact NE2-CD 3.29Å; H276-P307 WeakPolarHBondContact NE2-CD 3.48Å; V279-P307 HydrophobicContact CG2-CB 4.39Å; A297-P307 WeakPolarHBondContact O-CD 3.42Å; A299-P307 WeakPolarHBondContact O-CD 3.32Å; P307-T310 WeakPolarHBondContact CA-OG1 3.04Å; P307-T310 PolarHBondContact O-N 3.01Å; P307-T310 PolarHBondContact O-OG1 3.24Å; P307-A311 WeakPolarHBondContact O-CB 3.04Å; P307-A311 PolarHBondContact O-N 3.02Å; P307-L323 HydrophobicContact CB-CD1 3.93Å
308	L	91.8	Very high	87.9	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-65.4	-40.8	173.6	-74.6	175.6	0	0	0	113.5	T306 T310 A311 V312 L320 L323 L324 T330 P341	T306-L308 PolarHBondContact O-N 2.81Å; T306-L308 VanDerWaalsContact O-N 3.07Å; L308-T310 VanDerWaalsContact C-N 3.35Å; L308-A311 PolarHBondContact O-N 3.18Å; L308-V312 WeakPolarHBondContact O-CG2 3.5Å; L308-V312 PolarHBondContact O-N 2.63Å; L308-L320 HydrophobicContact CD2-CG 4.22Å; L308-L323 HydrophobicContact CD2-CB 3.81Å; L308-L323 HydrophobicContact CD2-CD1 4.1Å; L308-L323 HydrophobicContact CG-CD1 4.49Å; L308-L324 HydrophobicContact CD1-CD2 3.62Å; L308-L324 HydrophobicContact CD2-CD2 3.86Å; L308-L324 HydrophobicContact CD2-CG 3.9Å; L308-L324 HydrophobicContact CG-CD2 4.4Å; L308-T330 WeakPolarHBondContact CD1-O 3.36Å; L308-T330 VanDerWaalsContact CD1-OG1 3.32Å; L308-T330 WeakPolarHBondContact CD1-OG1 3.46Å; L308-P341 HydrophobicContact CB-CB 4.43Å; L308-P341 HydrophobicContact CB-CG 3.89Å; L308-P341 HydrophobicContact CD1-CG 4.45Å
309	H	91.1	Very high	88.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-44.5	175.2	-68.4	89.5	0	0	0	110.3	E305 T306 A311 V312 N313 A333 R339 T340 P341 Y344	E305-H309 HydrophobicContact CB-CB 3.75Å; E305-H309 HydrophobicContact CG-CB 4.3Å; T306-H309 PolarHBondContact N-ND1 2.83Å; T306-H309 WeakPolarHBondContact O-CA 3.49Å; T306-H309 WeakPolarHBondContact O-CB 3.19Å; T306-H309 PolarHBondContact O-N 2.89Å; T306-H309 PolarHBondContact OG1-ND1 3.21Å; H309-A311 VanDerWaalsContact C-N 3.34Å; H309-A311 PolarHBondContact O-N 2.92Å; H309-V312 PolarHBondContact O-N 2.7Å; H309-N313 VanDerWaalsContact O-CB 3.24Å; H309-N313 WeakPolarHBondContact O-CB 3.05Å; H309-N313 PolarHBondContact O-N 3.46Å; H309-A333 PolarHBondContact CE1-O 3.09Å; H309-R339 PolarHBondContact NE2-O 3.02Å; H309-T340 VanDerWaalsContact NE2-C 3.31Å; H309-P341 WeakPolarHBondContact NE2-CD 3.16Å; H309-Y344 AromaticContact CD2-CD2 3.6Å; H309-Y344 AromaticContact CD2-CE2 3.56Å
310	T	89.8	Confident	88.2	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.055	18%	0.184	C	C	.	.	H	α-helix	trans	-67.6	-31.3	175.6	46.4	0	0	0	0	113.2	H276 E305 T306 P307 L308 N314	H276-T310 WeakPolarHBondContact CE1-CB 3.13Å; H276-T310 WeakPolarHBondContact CE1-CG2 3.45Å; H276-T310 PolarHBondContact CE1-OG1 2.79Å; H276-T310 VanDerWaalsContact ND1-CG2 3.34Å; H276-T310 WeakPolarHBondContact ND1-CG2 3.4Å; H276-T310 PolarHBondContact ND1-OG1 3.41Å; H276-T310 VanDerWaalsContact ND1-OG1 3.09Å; E305-T310 HydrophobicContact CB-CG2 4.25Å; T306-T310 PolarHBondContact O-N 3.21Å; T306-T310 PolarHBondContact O-OG1 3.27Å; P307-T310 WeakPolarHBondContact CA-OG1 3.04Å; P307-T310 PolarHBondContact O-N 3.01Å; P307-T310 PolarHBondContact O-OG1 3.24Å; L308-T310 VanDerWaalsContact C-N 3.35Å; T310-N314 PolarHBondContact O-N 2.92Å; T310-N314 VanDerWaalsContact O-N 3.15Å; T310-N314 PolarHBondContact O-ND2 3.14Å
311	A	91.4	Very high	88.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-48.2	173.2	0	0	0	0	0	111.3	V279 P307 L308 H309 N314 D315 R316 I319 L320	V279-A311 HydrophobicContact CG1-CB 3.8Å; P307-A311 WeakPolarHBondContact O-CB 3.04Å; P307-A311 PolarHBondContact O-N 3.02Å; L308-A311 PolarHBondContact O-N 3.18Å; H309-A311 VanDerWaalsContact C-N 3.34Å; H309-A311 PolarHBondContact O-N 2.92Å; A311-N314 CarbonylContact O-C 3.49Å; A311-N314 PolarHBondContact O-N 3.32Å; A311-D315 PolarHBondContact O-N 3.48Å; A311-R316 HydrophobicContact CB-CB 4.36Å; A311-R316 PolarHBondContact O-N 2.88Å; A311-I319 HydrophobicContact CB-CG2 4.43Å; A311-L320 HydrophobicContact CB-CB 4.21Å
312	V	91	Very high	88.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-46.9	174.5	174.2	0	0	0	0	111.3	L308 H309 N314 D315 L320 P341 A345 K348 L358	L308-V312 WeakPolarHBondContact O-CG2 3.5Å; L308-V312 PolarHBondContact O-N 2.63Å; H309-V312 PolarHBondContact O-N 2.7Å; V312-N314 PolarHBondContact O-N 3.3Å; V312-N314 VanDerWaalsContact O-N 3.16Å; V312-D315 PolarHBondContact O-N 2.81Å; V312-D315 VanDerWaalsContact O-N 3.11Å; V312-L320 HydrophobicContact CG2-CD1 3.37Å; V312-P341 HydrophobicContact CG2-CB 4.11Å; V312-A345 HydrophobicContact CG1-CB 3.73Å; V312-K348 WeakPolarHBondContact O-CE 3.5Å; V312-K348 PolarHBondContact O-NZ 3.47Å; V312-L358 HydrophobicContact CG2-CD1 3.92Å
313	N	87.9	Confident	89.1	Confident	75 Å²	75	34 Å²	34	40%	0.401	16%	0.164	S	C	.	.	H	α-helix	trans	-65.3	-21.3	-176.3	-151.7	7.5	0	0	0	112.3	E305 H309 Y344 K348	E305-N313 PolarHBondContact OE1-ND2 2.67Å; H309-N313 VanDerWaalsContact O-CB 3.24Å; H309-N313 WeakPolarHBondContact O-CB 3.05Å; H309-N313 PolarHBondContact O-N 3.46Å; N313-Y344 HydrophobicContact CB-CD1 4.32Å; N313-K348 WeakPolarHBondContact O-CE 3.49Å; N313-K348 PolarHBondContact O-NZ 3.36Å
314	N	88.1	Confident	89.8	Confident	58 Å²	58	28.7 Å²	28.7	31%	0.31	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	14.2	174.2	-60.3	-81.4	0	0	0	114.4	T310 A311 V312 R316	T310-N314 PolarHBondContact O-N 2.92Å; T310-N314 VanDerWaalsContact O-N 3.15Å; T310-N314 PolarHBondContact O-ND2 3.14Å; A311-N314 CarbonylContact O-C 3.49Å; A311-N314 PolarHBondContact O-N 3.32Å; V312-N314 PolarHBondContact O-N 3.3Å; V312-N314 VanDerWaalsContact O-N 3.16Å; N314-R316 VanDerWaalsContact C-N 3.31Å; N314-R316 HydrophobicContact CB-CG 3.99Å; N314-R316 WeakPolarHBondContact O-CD 3.39Å; N314-R316 PolarHBondContact O-N 2.96Å
315	D	87.8	Confident	90.2	Very high	82 Å²	82	34.8 Å²	34.8	44%	0.439	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	38.2	179.7	-61.9	-43.9	0	0	0	115.2	A311 V312 L317 K348 N352	A311-D315 PolarHBondContact O-N 3.48Å; V312-D315 PolarHBondContact O-N 2.81Å; V312-D315 VanDerWaalsContact O-N 3.11Å; D315-L317 PolarHBondContact O-N 2.82Å; D315-L317 VanDerWaalsContact O-N 3.14Å; D315-K348 WeakPolarHBondContact OD1-CD 3.06Å; D315-K348 IonicContact OD1-NZ 2.89Å; D315-K348 PolarHBondContact OD1-NZ 2.88Å; D315-K348 IonicContact OD2-NZ 3.87Å; D315-K348 PolarHBondContact OD2-NZ 2.94Å; D315-N352 PolarHBondContact OD1-ND2 3.19Å
316	R	90	Very high	90.2	Very high	94 Å²	94	38.6 Å²	38.6	36%	0.355	19%	0.186	S	C	.	.			trans	-89.8	73.6	-178.4	-53.7	-55.3	-166.1	178.3	2.3	111.7	V279 K280 N281 A311 N314 D318 I319 L320	V279-R316 WeakPolarHBondContact O-CG 3.41Å; K280-R316 PolarHBondContact O-NE 3.09Å; K280-R316 PolarHBondContact O-NH2 3.37Å; N281-R316 VanDerWaalsContact C-NH2 3.34Å; N281-R316 PolarHBondContact O-NH2 3.34Å; N281-R316 VanDerWaalsContact O-NH2 3.11Å; A311-R316 HydrophobicContact CB-CB 4.36Å; A311-R316 PolarHBondContact O-N 2.88Å; N314-R316 VanDerWaalsContact C-N 3.31Å; N314-R316 HydrophobicContact CB-CG 3.99Å; N314-R316 WeakPolarHBondContact O-CD 3.39Å; N314-R316 PolarHBondContact O-N 2.96Å; R316-D318 PolarHBondContact O-N 2.82Å; R316-I319 HydrophobicContact CB-CB 4.22Å; R316-I319 HydrophobicContact CB-CD1 4.39Å; R316-I319 PolarHBondContact O-N 3.3Å; R316-L320 WeakPolarHBondContact O-CB 3.33Å; R316-L320 PolarHBondContact O-N 3.15Å
317	L	89.4	Confident	90.1	Very high	24 Å²	24	40 Å²	40	13%	0.126	19%	0.192	C	C	.	.	H	α-helix	trans	-52.3	-49.3	-176.9	-172	81.3	0	0	0	113.6	D315 I319 L320 K321 E353	D315-L317 PolarHBondContact O-N 2.82Å; D315-L317 VanDerWaalsContact O-N 3.14Å; L317-I319 PolarHBondContact O-N 3.14Å; L317-L320 CarbonylContact O-C 3.45Å; L317-L320 WeakPolarHBondContact O-CB 3.49Å; L317-L320 PolarHBondContact O-N 2.91Å; L317-L320 VanDerWaalsContact O-N 3.14Å; L317-K321 HydrophobicContact CD2-CD 4.3Å; L317-K321 HydrophobicContact CG-CD 4.13Å; L317-K321 HydrophobicContact CG-CG 4.47Å; L317-K321 WeakPolarHBondContact O-CG 3.41Å; L317-K321 PolarHBondContact O-N 3.23Å; L317-E353 HydrophobicContact CD1-CB 3.61Å; L317-E353 WeakPolarHBondContact CD2-OE2 3.33Å
318	D	90.7	Very high	89.9	Confident	107 Å²	107	43.9 Å²	43.9	57%	0.572	22%	0.217	S	C	*	.	H	α-helix	trans	-67.7	-38	-172.7	-56	-44.4	0	0	0	112.3	R316 K321 Y322	R316-D318 PolarHBondContact O-N 2.82Å; D318-K321 PolarHBondContact O-N 2.74Å; D318-Y322 WeakPolarHBondContact O-CB 3.27Å; D318-Y322 PolarHBondContact O-N 3.49Å
319	I	91.3	Very high	89.4	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.026	25%	0.25	C	C	.	.	H	α-helix	trans	-66.6	-39.9	173.3	-66.9	179.8	0	0	0	110.6	V279 M284 T287 A311 R316 L317 Y322 L323	V279-I319 HydrophobicContact CG1-CG2 4.24Å; V279-I319 HydrophobicContact CG2-CG2 4.04Å; M284-I319 HydrophobicContact CB-CG1 4.42Å; M284-I319 HydrophobicContact CG-CG1 4.23Å; T287-I319 HydrophobicContact CG2-CG2 3.98Å; A311-I319 HydrophobicContact CB-CG2 4.43Å; R316-I319 HydrophobicContact CB-CB 4.22Å; R316-I319 HydrophobicContact CB-CD1 4.39Å; R316-I319 PolarHBondContact O-N 3.3Å; L317-I319 PolarHBondContact O-N 3.14Å; I319-Y322 PolarHBondContact O-N 2.87Å; I319-L323 HydrophobicContact CG2-CD1 3.9Å; I319-L323 HydrophobicContact CG2-CG 4.33Å; I319-L323 WeakPolarHBondContact O-CB 3.37Å; I319-L323 VanDerWaalsContact O-CG 3.3Å; I319-L323 WeakPolarHBondContact O-CG 3.35Å; I319-L323 PolarHBondContact O-N 3.25Å
320	L	91.6	Very high	89.2	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-64.1	-45.1	175.3	-179.2	141.8	0	0	0	111.6	L308 A311 V312 R316 L317 L323 L324 C354 Y357 L358	L308-L320 HydrophobicContact CD2-CG 4.22Å; A311-L320 HydrophobicContact CB-CB 4.21Å; V312-L320 HydrophobicContact CG2-CD1 3.37Å; R316-L320 WeakPolarHBondContact O-CB 3.33Å; R316-L320 PolarHBondContact O-N 3.15Å; L317-L320 CarbonylContact O-C 3.45Å; L317-L320 WeakPolarHBondContact O-CB 3.49Å; L317-L320 PolarHBondContact O-N 2.91Å; L317-L320 VanDerWaalsContact O-N 3.14Å; L320-L323 PolarHBondContact O-N 3.24Å; L320-L324 HydrophobicContact CD2-CD1 3.76Å; L320-L324 HydrophobicContact CG-CD1 4.09Å; L320-L324 WeakPolarHBondContact O-CB 3.42Å; L320-L324 VanDerWaalsContact O-CG 3.24Å; L320-L324 WeakPolarHBondContact O-CG 3.38Å; L320-L324 PolarHBondContact O-N 2.67Å; L320-C354 HydrophobicContact CD1-CB 4.3Å; L320-Y357 HydrophobicContact CD2-CD1 3.55Å; L320-Y357 HydrophobicContact CD2-CE1 4.3Å; L320-Y357 HydrophobicContact CD2-CG 4.39Å; L320-L358 HydrophobicContact CD1-CD1 4.48Å; L320-L358 HydrophobicContact CD1-CG 4.46Å
321	K	91.3	Very high	89.2	Confident	71 Å²	71	50.7 Å²	50.7	31%	0.309	25%	0.249	S	C	.	.	H	α-helix	trans	-56.9	-50.2	172.8	-73.5	173.2	175	170.7	0	111.1	L317 D318 L324 Q325 Y357	L317-K321 HydrophobicContact CD2-CD 4.3Å; L317-K321 HydrophobicContact CG-CD 4.13Å; L317-K321 HydrophobicContact CG-CG 4.47Å; L317-K321 WeakPolarHBondContact O-CG 3.41Å; L317-K321 PolarHBondContact O-N 3.23Å; D318-K321 PolarHBondContact O-N 2.74Å; K321-L324 PolarHBondContact O-N 3.48Å; K321-Q325 WeakPolarHBondContact O-CB 3.29Å; K321-Q325 VanDerWaalsContact O-CG 3.3Å; K321-Q325 WeakPolarHBondContact O-CG 3.39Å; K321-Q325 PolarHBondContact O-N 3.23Å; K321-Y357 HydrophobicContact CB-CE1 4.22Å; K321-Y357 HydrophobicContact CG-CD1 4.1Å; K321-Y357 HydrophobicContact CG-CD2 4.38Å; K321-Y357 HydrophobicContact CG-CE1 3.75Å; K321-Y357 HydrophobicContact CG-CE2 4.06Å; K321-Y357 HydrophobicContact CG-CG 4.38Å
322	Y	91.2	Very high	89.1	Confident	43 Å²	43	53.9 Å²	53.9	17%	0.169	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-50.3	178.7	173.8	-99.2	0	0	0	112.7	Q288 D318 I319 L324 Q325 Q326	Q288-Y322 HydrophobicContact CB-CE1 4.5Å; Q288-Y322 HydrophobicContact CG-CD1 4.35Å; Q288-Y322 HydrophobicContact CG-CD2 4.31Å; Q288-Y322 HydrophobicContact CG-CE1 3.87Å; Q288-Y322 HydrophobicContact CG-CE2 3.81Å; D318-Y322 WeakPolarHBondContact O-CB 3.27Å; D318-Y322 PolarHBondContact O-N 3.49Å; I319-Y322 PolarHBondContact O-N 2.87Å; Y322-L324 VanDerWaalsContact C-N 3.29Å; Y322-L324 PolarHBondContact O-N 3.01Å; Y322-Q325 PolarHBondContact O-N 2.89Å; Y322-Q326 HydrophobicContact CD2-CG 4.14Å; Y322-Q326 HydrophobicContact CE1-CG 4.22Å; Y322-Q326 HydrophobicContact CE2-CG 3.64Å; Y322-Q326 WeakPolarHBondContact O-CG 3.38Å; Y322-Q326 PolarHBondContact O-N 3.25Å
323	L	90.2	Very high	89	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-36.8	-179.4	-74.3	173.1	0	0	0	112.2	A291 A297 P307 L308 I319 L320 F327	A291-L323 HydrophobicContact CB-CD2 4.18Å; A297-L323 HydrophobicContact CB-CD2 4.37Å; P307-L323 HydrophobicContact CB-CD1 3.93Å; L308-L323 HydrophobicContact CD2-CB 3.81Å; L308-L323 HydrophobicContact CD2-CD1 4.1Å; L308-L323 HydrophobicContact CG-CD1 4.49Å; I319-L323 HydrophobicContact CG2-CD1 3.9Å; I319-L323 HydrophobicContact CG2-CG 4.33Å; I319-L323 WeakPolarHBondContact O-CB 3.37Å; I319-L323 VanDerWaalsContact O-CG 3.3Å; I319-L323 WeakPolarHBondContact O-CG 3.35Å; I319-L323 PolarHBondContact O-N 3.25Å; L320-L323 PolarHBondContact O-N 3.24Å; L323-F327 WeakPolarHBondContact O-CA 3.41Å; L323-F327 WeakPolarHBondContact O-CB 3.22Å; L323-F327 PolarHBondContact O-N 3.36Å
324	L	91	Very high	89	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-77	-34.1	178.8	-67.7	-179	0	0	0	113.5	L308 L320 K321 Y322 P328 V331 Y357 L358 T361	L308-L324 HydrophobicContact CD1-CD2 3.62Å; L308-L324 HydrophobicContact CD2-CD2 3.86Å; L308-L324 HydrophobicContact CD2-CG 3.9Å; L308-L324 HydrophobicContact CG-CD2 4.4Å; L320-L324 HydrophobicContact CD2-CD1 3.76Å; L320-L324 HydrophobicContact CG-CD1 4.09Å; L320-L324 WeakPolarHBondContact O-CB 3.42Å; L320-L324 VanDerWaalsContact O-CG 3.24Å; L320-L324 WeakPolarHBondContact O-CG 3.38Å; L320-L324 PolarHBondContact O-N 2.67Å; K321-L324 PolarHBondContact O-N 3.48Å; Y322-L324 VanDerWaalsContact C-N 3.29Å; Y322-L324 PolarHBondContact O-N 3.01Å; L324-P328 VanDerWaalsContact O-CA 3.26Å; L324-P328 WeakPolarHBondContact O-CA 3.35Å; L324-P328 WeakPolarHBondContact O-CB 3.46Å; L324-P328 WeakPolarHBondContact O-CD 3.47Å; L324-P328 VanDerWaalsContact O-N 3.15Å; L324-V331 HydrophobicContact CD2-CB 4.26Å; L324-V331 HydrophobicContact CD2-CG2 3.46Å; L324-V331 VanDerWaalsContact CD2-CG2 3.46Å; L324-Y357 HydrophobicContact CB-CE1 4.36Å; L324-Y357 HydrophobicContact CD1-CD1 4.02Å; L324-Y357 HydrophobicContact CD1-CE1 4.03Å; L324-L358 HydrophobicContact CD1-CD2 3.88Å; L324-T361 HydrophobicContact CB-CG2 4.45Å; L324-T361 HydrophobicContact CD1-CG2 4.24Å
325	Q	89.7	Confident	88.9	Confident	128 Å²	128	51.7 Å²	51.7	60%	0.598	25%	0.253	S	S	*	.	H	α-helix	trans	-65.9	-42.5	172.4	-75.1	176.2	-2.7	0	0	112.1	K321 Y322	K321-Q325 WeakPolarHBondContact O-CB 3.29Å; K321-Q325 VanDerWaalsContact O-CG 3.3Å; K321-Q325 WeakPolarHBondContact O-CG 3.39Å; K321-Q325 PolarHBondContact O-N 3.23Å; Y322-Q325 PolarHBondContact O-N 2.89Å
326	Q	87.8	Confident	88.6	Confident	104 Å²	104	52.2 Å²	52.2	49%	0.486	25%	0.25	S	C	.	.	H	α-helix	trans	-77.3	-36.7	179.2	-63.6	-58.4	-45.4	0	0	112.8	Y322	Y322-Q326 HydrophobicContact CD2-CG 4.14Å; Y322-Q326 HydrophobicContact CE1-CG 4.22Å; Y322-Q326 HydrophobicContact CE2-CG 3.64Å; Y322-Q326 WeakPolarHBondContact O-CG 3.38Å; Y322-Q326 PolarHBondContact O-N 3.25Å
327	F	88.7	Confident	88.2	Confident	32 Å²	32	51.5 Å²	51.5	14%	0.14	25%	0.25	C	S	.	.			trans	-133.8	65.4	-173.9	-48.2	-64.3	0	0	0	112.3	A291 K294 A297 L323 E329 T330	A291-F327 VanDerWaalsContact O-CE2 3.28Å; A291-F327 WeakPolarHBondContact O-CE2 3.45Å; A291-F327 WeakPolarHBondContact O-CZ 3.48Å; K294-F327 HydrophobicContact CB-CD1 3.96Å; K294-F327 HydrophobicContact CB-CE1 4.25Å; K294-F327 VanDerWaalsContact N-CE1 3.33Å; A297-F327 HydrophobicContact CB-CB 4.42Å; A297-F327 HydrophobicContact CB-CD2 3.5Å; A297-F327 HydrophobicContact CB-CE2 3.99Å; A297-F327 HydrophobicContact CB-CG 4.08Å; L323-F327 WeakPolarHBondContact O-CA 3.41Å; L323-F327 WeakPolarHBondContact O-CB 3.22Å; L323-F327 PolarHBondContact O-N 3.36Å; F327-E329 PolarHBondContact O-N 2.89Å; F327-T330 HydrophobicContact CB-CG2 3.76Å; F327-T330 WeakPolarHBondContact O-CB 3.22Å; F327-T330 WeakPolarHBondContact O-CG2 3.41Å; F327-T330 PolarHBondContact O-N 2.83Å; F327-T330 PolarHBondContact O-OG1 3.03Å
328	P	86.7	Confident	87.9	Confident	83 Å²	83	54.3 Å²	54.3	54%	0.539	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-62.2	-19.7	-175.5	24.3	-35.1	0	0	0	114.2	L324 T330 V331	L324-P328 VanDerWaalsContact O-CA 3.26Å; L324-P328 WeakPolarHBondContact O-CA 3.35Å; L324-P328 WeakPolarHBondContact O-CB 3.46Å; L324-P328 WeakPolarHBondContact O-CD 3.47Å; L324-P328 VanDerWaalsContact O-N 3.15Å; P328-T330 PolarHBondContact O-N 3.29Å; P328-V331 VanDerWaalsContact O-CG2 3.24Å; P328-V331 WeakPolarHBondContact O-CG2 3.46Å
329	E	81.9	Confident	87.8	Confident	148 Å²	148	49.8 Å²	49.8	69%	0.692	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-66.3	-11.7	172	-67.3	-175.1	-113.8	0	0	114	K294 F327	K294-E329 IonicContact NZ-OE1 2.76Å; K294-E329 PolarHBondContact NZ-OE1 2.88Å; K294-E329 IonicContact NZ-OE2 3.7Å; K294-E329 PolarHBondContact NZ-OE2 2.8Å; F327-E329 PolarHBondContact O-N 2.89Å
330	T	85.5	Confident	87.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-87.8	-11.9	-175.4	63.7	0	0	0	0	114.5	A297 I298 L308 F327 P328 N332 A333	A297-T330 HydrophobicContact CB-CG2 4.34Å; I298-T330 HydrophobicContact CD1-CG2 3.97Å; I298-T330 HydrophobicContact CG1-CG2 3.53Å; L308-T330 WeakPolarHBondContact CD1-O 3.36Å; L308-T330 VanDerWaalsContact CD1-OG1 3.32Å; L308-T330 WeakPolarHBondContact CD1-OG1 3.46Å; F327-T330 HydrophobicContact CB-CG2 3.76Å; F327-T330 WeakPolarHBondContact O-CB 3.22Å; F327-T330 WeakPolarHBondContact O-CG2 3.41Å; F327-T330 PolarHBondContact O-N 2.83Å; F327-T330 PolarHBondContact O-OG1 3.03Å; P328-T330 PolarHBondContact O-N 3.29Å; T330-N332 PolarHBondContact O-N 3.08Å; T330-N332 VanDerWaalsContact O-N 3.1Å; T330-A333 WeakPolarHBondContact O-CB 3.36Å; T330-A333 PolarHBondContact O-N 3.37Å
331	V	89.8	Confident	87.7	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.018	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-44.6	-179.4	178.5	0	0	0	0	112.7	L324 P328 P341 L358 A363	L324-V331 HydrophobicContact CD2-CB 4.26Å; L324-V331 HydrophobicContact CD2-CG2 3.46Å; L324-V331 VanDerWaalsContact CD2-CG2 3.46Å; P328-V331 VanDerWaalsContact O-CG2 3.24Å; P328-V331 WeakPolarHBondContact O-CG2 3.46Å; V331-P341 WeakPolarHBondContact O-CD 3.46Å; V331-L358 HydrophobicContact CG1-CD2 4.25Å; V331-A363 VanDerWaalsContact CG1-CA 3.42Å; V331-A363 HydrophobicContact CG1-CB 3.5Å; V331-A363 VanDerWaalsContact CG1-CB 3.5Å
332	N	90.2	Very high	87.8	Confident	66 Å²	66	46.3 Å²	46.3	35%	0.353	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	21.4	-175.1	-67.4	-55.7	0	0	0	113.2	T330 G362 D364	T330-N332 PolarHBondContact O-N 3.08Å; T330-N332 VanDerWaalsContact O-N 3.1Å; N332-G362 PolarHBondContact ND2-O 3.14Å; N332-D364 PolarHBondContact OD1-N 2.69Å
333	A	88.3	Confident	87.7	Confident	18 Å²	18	44.2 Å²	44.2	15%	0.149	22%	0.217	C	C	.	.			trans	-57.8	147.7	170.3	0	0	0	0	0	110.4	T306 H309 T330 T340 P341	T306-A333 HydrophobicContact CG2-CB 4.09Å; H309-A333 PolarHBondContact CE1-O 3.09Å; T330-A333 WeakPolarHBondContact O-CB 3.36Å; T330-A333 PolarHBondContact O-N 3.37Å; A333-T340 WeakPolarHBondContact O-CA 3.2Å; A333-P341 VanDerWaalsContact O-CD 3.26Å; A333-P341 WeakPolarHBondContact O-CD 3.37Å
334	K	88.2	Confident	87.6	Confident	65 Å²	65	45.3 Å²	45.3	28%	0.283	22%	0.221	S	C	.	.			trans	-114.4	151.9	-177.5	-74	177.9	171.2	-112.1	0	112.2	R300 L338 R339 T340 K368	R300-K334 VanDerWaalsContact CZ-O 3.26Å; R300-K334 PolarHBondContact NE-O 3.48Å; R300-K334 VanDerWaalsContact NE-O 3.08Å; R300-K334 PolarHBondContact NH2-O 3.05Å; K334-L338 HydrophobicContact CD-CB 4.2Å; K334-L338 HydrophobicContact CD-CD2 4.13Å; K334-L338 WeakPolarHBondContact CD-O 3.46Å; K334-L338 WeakPolarHBondContact CE-O 3.41Å; K334-L338 PolarHBondContact NZ-O 2.89Å; K334-R339 CarbonylContact C-O 3.51Å; K334-R339 WeakPolarHBondContact CA-O 3.36Å; K334-T340 HydrophobicContact CG-CG2 3.89Å; K334-K368 PolarHBondContact NZ-O 2.89Å
335	D	86	Confident	87.6	Confident	5 Å²	5	45 Å²	45	3%	0.027	22%	0.22	C	C	.	.			trans	-82.6	-164.2	168.6	73.9	-6.5	0	0	0	112.3	R300 G304 Q337 L338 R339 Y344	R300-D335 PolarHBondContact NH2-O 2.83Å; R300-D335 VanDerWaalsContact NH2-O 3.17Å; G304-D335 VanDerWaalsContact O-CA 3.29Å; G304-D335 WeakPolarHBondContact O-CA 3.43Å; D335-Q337 VanDerWaalsContact C-N 3.35Å; D335-Q337 VanDerWaalsContact OD1-CA 3.28Å; D335-Q337 WeakPolarHBondContact OD1-CA 3.35Å; D335-Q337 PolarHBondContact OD1-N 3.21Å; D335-L338 PolarHBondContact OD1-N 3.02Å; D335-R339 PolarHBondContact N-O 3.48Å; D335-R339 PolarHBondContact OD1-N 2.9Å; D335-Y344 PolarHBondContact OD2-OH 3.48Å
336	Y	80.8	Confident	87.6	Confident	93 Å²	93	39 Å²	39	37%	0.365	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-24.9	172.1	-67.9	-43	0	0	0	113.9	S242 G243 C244 Q303 G304 L338	S242-Y336 WeakPolarHBondContact O-CE1 3.35Å; S242-Y336 PolarHBondContact O-OH 2.96Å; G243-Y336 VanDerWaalsContact CA-OH 3.28Å; G243-Y336 WeakPolarHBondContact CA-OH 3.46Å; G243-Y336 PolarHBondContact O-OH 3.21Å; C244-Y336 PolarHBondContact SG-OH 3.07Å; Q303-Y336 WeakPolarHBondContact O-CD2 3.38Å; G304-Y336 VanDerWaalsContact N-CE2 3.27Å; Y336-L338 VanDerWaalsContact C-N 3.3Å
337	Q	81.5	Confident	87.4	Confident	78 Å²	78	35 Å²	35	36%	0.364	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	13.9	177.5	-65.5	-178.6	-13.5	0	0	112.2	D335 R339 D369 C370	D335-Q337 VanDerWaalsContact C-N 3.35Å; D335-Q337 VanDerWaalsContact OD1-CA 3.28Å; D335-Q337 WeakPolarHBondContact OD1-CA 3.35Å; D335-Q337 PolarHBondContact OD1-N 3.21Å; Q337-R339 HydrophobicContact CB-CG 4.13Å; Q337-R339 PolarHBondContact O-N 3.17Å; Q337-R339 VanDerWaalsContact O-N 3.13Å; Q337-D369 WeakPolarHBondContact O-CB 3.37Å; Q337-C370 WeakPolarHBondContact O-CB 3.38Å; Q337-C370 PolarHBondContact O-N 3.06Å; Q337-C370 PolarHBondContact O-SG 3.41Å
338	L	84.5	Confident	87.2	Confident	83 Å²	83	36.9 Å²	36.9	44%	0.435	19%	0.186	S	C	.	.	S	Bend	trans	59.5	13.1	-176.7	-56.7	176.9	0	0	0	115.3	K334 D335 Y336	K334-L338 HydrophobicContact CD-CB 4.2Å; K334-L338 HydrophobicContact CD-CD2 4.13Å; K334-L338 WeakPolarHBondContact CD-O 3.46Å; K334-L338 WeakPolarHBondContact CE-O 3.41Å; K334-L338 PolarHBondContact NZ-O 2.89Å; D335-L338 PolarHBondContact OD1-N 3.02Å; Y336-L338 VanDerWaalsContact C-N 3.3Å
339	R	87.7	Confident	87	Confident	13 Å²	13	34 Å²	34	5%	0.049	17%	0.172	C	C	.	.			trans	-72.5	148.3	173	-60.3	169	171	-178.1	-6	109.3	H309 K334 D335 Q337 H343 Y344 D369 Y378 C384	H309-R339 PolarHBondContact NE2-O 3.02Å; K334-R339 CarbonylContact C-O 3.51Å; K334-R339 WeakPolarHBondContact CA-O 3.36Å; D335-R339 PolarHBondContact N-O 3.48Å; D335-R339 PolarHBondContact OD1-N 2.9Å; Q337-R339 HydrophobicContact CB-CG 4.13Å; Q337-R339 PolarHBondContact O-N 3.17Å; Q337-R339 VanDerWaalsContact O-N 3.13Å; R339-H343 HydrophobicContact CB-CB 4.03Å; R339-Y344 HydrophobicContact CB-CD2 4.49Å; R339-Y344 HydrophobicContact CB-CE2 4.13Å; R339-D369 HydrophobicContact CG-CB 3.65Å; R339-Y378 PolarHBondContact NE-OH 3.44Å; R339-Y378 PolarHBondContact NH2-OH 3.42Å; R339-C384 PolarHBondContact NH1-O 3Å; R339-C384 PolarHBondContact NH2-O 3.39Å
340	T	90.5	Very high	87	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	16%	0.159	C	C	.	.			trans	-105.5	166.7	175.5	59	0	0	0	0	110.4	H309 A333 K334 L342 H343 Y344 S367	H309-T340 VanDerWaalsContact NE2-C 3.31Å; A333-T340 WeakPolarHBondContact O-CA 3.2Å; K334-T340 HydrophobicContact CG-CG2 3.89Å; T340-L342 PolarHBondContact O-N 3.43Å; T340-L342 VanDerWaalsContact O-N 3.08Å; T340-H343 PolarHBondContact N-ND1 3.04Å; T340-H343 VanDerWaalsContact N-ND1 3.12Å; T340-H343 WeakPolarHBondContact O-CB 3.3Å; T340-H343 PolarHBondContact O-N 3.05Å; T340-H343 PolarHBondContact OG1-ND1 2.95Å; T340-Y344 PolarHBondContact O-N 2.9Å; T340-S367 PolarHBondContact OG1-OG 2.95Å
341	P	90.8	Very high	86.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-53.1	-32.4	174.7	-28.3	35.5	0	0	0	113.1	L308 H309 V312 V331 A333 H343 Y344 A345 L358	L308-P341 HydrophobicContact CB-CB 4.43Å; L308-P341 HydrophobicContact CB-CG 3.89Å; L308-P341 HydrophobicContact CD1-CG 4.45Å; H309-P341 WeakPolarHBondContact NE2-CD 3.16Å; V312-P341 HydrophobicContact CG2-CB 4.11Å; V331-P341 WeakPolarHBondContact O-CD 3.46Å; A333-P341 VanDerWaalsContact O-CD 3.26Å; A333-P341 WeakPolarHBondContact O-CD 3.37Å; P341-H343 VanDerWaalsContact C-N 3.32Å; P341-H343 PolarHBondContact O-N 3.01Å; P341-Y344 PolarHBondContact O-N 2.94Å; P341-A345 PolarHBondContact O-N 2.89Å; P341-L358 HydrophobicContact CB-CD1 3.94Å; P341-L358 HydrophobicContact CB-CD2 4.23Å
342	L	92	Very high	86.5	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-29.8	175.7	-170.2	67.4	0	0	0	113.2	T340 A346 Y355 L358 L359 A363 E365 P375	T340-L342 PolarHBondContact O-N 3.43Å; T340-L342 VanDerWaalsContact O-N 3.08Å; L342-A346 VanDerWaalsContact O-CB 3.26Å; L342-A346 WeakPolarHBondContact O-CB 3.36Å; L342-A346 PolarHBondContact O-N 3.07Å; L342-Y355 HydrophobicContact CD1-CD2 3.66Å; L342-Y355 HydrophobicContact CD1-CE2 3.6Å; L342-Y355 HydrophobicContact CD1-CG 4.41Å; L342-Y355 HydrophobicContact CG-CE2 4.21Å; L342-L358 HydrophobicContact CD1-CB 3.98Å; L342-L359 HydrophobicContact CD1-CD2 3.81Å; L342-L359 HydrophobicContact CD1-CG 4.1Å; L342-L359 HydrophobicContact CD2-CD2 3.75Å; L342-L359 HydrophobicContact CG-CD2 4.45Å; L342-A363 HydrophobicContact CB-CB 4.12Å; L342-A363 HydrophobicContact CD1-CB 4.36Å; L342-A363 HydrophobicContact CD2-CB 3.84Å; L342-A363 HydrophobicContact CG-CB 4.33Å; L342-E365 HydrophobicContact CD2-CG 4.24Å; L342-P375 HydrophobicContact CB-CB 4.46Å; L342-P375 HydrophobicContact CB-CG 4.33Å; L342-P375 HydrophobicContact CD2-CB 4.09Å; L342-P375 HydrophobicContact CD2-CG 3.87Å; L342-P375 HydrophobicContact CG-CB 3.91Å; L342-P375 HydrophobicContact CG-CG 4.06Å
343	H	90.6	Very high	86.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-43.3	172.2	-69.3	72.1	0	0	0	111.1	R339 T340 P341 A346 G347 S367 R373 P375 Y378 L385	R339-H343 HydrophobicContact CB-CB 4.03Å; T340-H343 PolarHBondContact N-ND1 3.04Å; T340-H343 VanDerWaalsContact N-ND1 3.12Å; T340-H343 WeakPolarHBondContact O-CB 3.3Å; T340-H343 PolarHBondContact O-N 3.05Å; T340-H343 PolarHBondContact OG1-ND1 2.95Å; P341-H343 VanDerWaalsContact C-N 3.32Å; P341-H343 PolarHBondContact O-N 3.01Å; H343-A346 PolarHBondContact O-N 3.3Å; H343-G347 PolarHBondContact O-N 2.85Å; H343-S367 PolarHBondContact CE1-O 3.24Å; H343-S367 PolarHBondContact CE1-OG 2.95Å; H343-R373 PolarHBondContact NE2-O 3.32Å; H343-P375 VanDerWaalsContact CE1-CD 3.44Å; H343-P375 WeakPolarHBondContact CE1-CD 3.43Å; H343-P375 WeakPolarHBondContact NE2-CD 3.32Å; H343-Y378 HydrophobicContact CB-CD2 4.45Å; H343-Y378 AromaticContact CD2-CD2 3.83Å; H343-Y378 AromaticContact CD2-CE2 3.71Å; H343-L385 VanDerWaalsContact O-CD1 3.29Å; H343-L385 WeakPolarHBondContact O-CD1 3.41Å
344	Y	88.2	Confident	86.5	Confident	23 Å²	23	41.5 Å²	41.5	9%	0.09	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-42.1	176.8	-80.7	-112	0	0	0	111.4	E305 H309 N313 D335 R339 T340 P341 A346 G347 K348 L385	E305-Y344 WeakPolarHBondContact OE1-CE1 3.4Å; E305-Y344 PolarHBondContact OE1-OH 2.98Å; H309-Y344 AromaticContact CD2-CD2 3.6Å; H309-Y344 AromaticContact CD2-CE2 3.56Å; N313-Y344 HydrophobicContact CB-CD1 4.32Å; D335-Y344 PolarHBondContact OD2-OH 3.48Å; R339-Y344 HydrophobicContact CB-CD2 4.49Å; R339-Y344 HydrophobicContact CB-CE2 4.13Å; T340-Y344 PolarHBondContact O-N 2.9Å; P341-Y344 PolarHBondContact O-N 2.94Å; Y344-A346 VanDerWaalsContact C-N 3.34Å; Y344-A346 PolarHBondContact O-N 3.36Å; Y344-G347 PolarHBondContact O-N 3.17Å; Y344-K348 PolarHBondContact O-N 3.22Å; Y344-L385 HydrophobicContact CD2-CD2 4.04Å; Y344-L385 HydrophobicContact CE2-CD2 4.23Å; Y344-L385 HydrophobicContact CG-CD2 4.21Å
345	A	89.9	Confident	86.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-40.2	177.3	0	0	0	0	0	111.3	V312 P341 G347 K348 G349 Y355 L358	V312-A345 HydrophobicContact CG1-CB 3.73Å; P341-A345 PolarHBondContact O-N 2.89Å; A345-G347 VanDerWaalsContact C-N 3.28Å; A345-G347 PolarHBondContact O-N 2.85Å; A345-K348 PolarHBondContact O-N 2.96Å; A345-G349 PolarHBondContact O-N 3.16Å; A345-Y355 HydrophobicContact CB-CD2 4.01Å; A345-L358 HydrophobicContact CB-CD1 3.97Å
346	A	89.3	Confident	86.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-38.8	174.2	0	0	0	0	0	112.5	L342 H343 Y344 K348 G349 Y355 P375 I379	L342-A346 VanDerWaalsContact O-CB 3.26Å; L342-A346 WeakPolarHBondContact O-CB 3.36Å; L342-A346 PolarHBondContact O-N 3.07Å; H343-A346 PolarHBondContact O-N 3.3Å; Y344-A346 VanDerWaalsContact C-N 3.34Å; Y344-A346 PolarHBondContact O-N 3.36Å; A346-K348 PolarHBondContact O-N 3.26Å; A346-G349 PolarHBondContact O-N 3.01Å; A346-Y355 HydrophobicContact CB-CD2 4.25Å; A346-Y355 HydrophobicContact CB-CE2 3.91Å; A346-P375 HydrophobicContact CB-CB 4.33Å; A346-P375 WeakPolarHBondContact CB-O 3.39Å; A346-I379 HydrophobicContact CB-CG1 3.9Å; A346-I379 WeakPolarHBondContact O-CA 3.4Å
347	G	85.2	Confident	87.2	Confident	20 Å²	20	41.4 Å²	41.4	21%	0.206	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.4	174.5	0	0	0	0	0	115.4	H343 Y344 A345 A382	H343-G347 PolarHBondContact O-N 2.85Å; Y344-G347 PolarHBondContact O-N 3.17Å; A345-G347 VanDerWaalsContact C-N 3.28Å; A345-G347 PolarHBondContact O-N 2.85Å; G347-A382 VanDerWaalsContact O-CB 3.25Å; G347-A382 WeakPolarHBondContact O-CB 3.27Å
348	K	83	Confident	87.7	Confident	72 Å²	72	37.7 Å²	37.7	31%	0.313	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	0.6	171.1	-65.9	-166.4	170.6	-172.5	0	113.7	V312 N313 D315 Y344 A345 A346 N352	V312-K348 WeakPolarHBondContact O-CE 3.5Å; V312-K348 PolarHBondContact O-NZ 3.47Å; N313-K348 WeakPolarHBondContact O-CE 3.49Å; N313-K348 PolarHBondContact O-NZ 3.36Å; D315-K348 WeakPolarHBondContact OD1-CD 3.06Å; D315-K348 IonicContact OD1-NZ 2.89Å; D315-K348 PolarHBondContact OD1-NZ 2.88Å; D315-K348 IonicContact OD2-NZ 3.87Å; D315-K348 PolarHBondContact OD2-NZ 2.94Å; Y344-K348 PolarHBondContact O-N 3.22Å; A345-K348 PolarHBondContact O-N 2.96Å; A346-K348 PolarHBondContact O-N 3.26Å; K348-N352 HydrophobicContact CB-CB 4.45Å; K348-N352 WeakPolarHBondContact CB-ND2 3.42Å
349	G	82.6	Confident	88	Confident	24 Å²	24	36.3 Å²	36.3	25%	0.247	18%	0.183	C	C	.	.			trans	96.1	156.5	-179.7	0	0	0	0	0	114.2	A345 A346 E351 N352	A345-G349 PolarHBondContact O-N 3.16Å; A346-G349 PolarHBondContact O-N 3.01Å; G349-E351 VanDerWaalsContact C-N 3.27Å; G349-E351 PolarHBondContact O-N 3.39Å; G349-N352 WeakPolarHBondContact O-CB 3.5Å; G349-N352 PolarHBondContact O-N 3.23Å
350	V	81.8	Confident	88.1	Confident	69 Å²	69	42.8 Å²	42.8	42%	0.418	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-26	-176.2	179.5	0	0	0	0	112.6	N352 Y355 I379	V350-N352 VanDerWaalsContact C-N 3.3Å; V350-N352 PolarHBondContact O-N 3.03Å; V350-Y355 HydrophobicContact CB-CD1 4.45Å; V350-Y355 HydrophobicContact CB-CE1 4.41Å; V350-Y355 HydrophobicContact CG1-CD1 4.12Å; V350-Y355 HydrophobicContact CG1-CE1 3.93Å; V350-Y355 HydrophobicContact CG2-CE1 4.38Å; V350-I379 HydrophobicContact CG2-CD1 3.57Å; V350-I379 HydrophobicContact CG2-CG1 4.02Å; V350-I379 HydrophobicContact CG2-CG2 3.8Å
351	E	81.2	Confident	87.9	Confident	169 Å²	169	45 Å²	45	79%	0.79	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.3	-177.5	-65.7	-180	174.3	0	0	113	G349 E353 K356	G349-E351 VanDerWaalsContact C-N 3.27Å; G349-E351 PolarHBondContact O-N 3.39Å; E351-E353 PolarHBondContact O-N 2.9Å; E351-K356 WeakPolarHBondContact O-CE 3.45Å; E351-K356 PolarHBondContact O-NZ 3.26Å
352	N	84.7	Confident	87.8	Confident	32 Å²	32	47.4 Å²	47.4	17%	0.171	25%	0.251	C	S	.	.	S	Bend	trans	-57.8	127	179.9	-173.4	-41	0	0	0	110.6	D315 K348 G349 V350 C354 Y355 K356	D315-N352 PolarHBondContact OD1-ND2 3.19Å; K348-N352 HydrophobicContact CB-CB 4.45Å; K348-N352 WeakPolarHBondContact CB-ND2 3.42Å; G349-N352 WeakPolarHBondContact O-CB 3.5Å; G349-N352 PolarHBondContact O-N 3.23Å; V350-N352 VanDerWaalsContact C-N 3.3Å; V350-N352 PolarHBondContact O-N 3.03Å; N352-C354 PolarHBondContact O-N 3.34Å; N352-C354 VanDerWaalsContact OD1-CB 3.27Å; N352-C354 WeakPolarHBondContact OD1-CB 3.5Å; N352-C354 PolarHBondContact OD1-N 2.79Å; N352-Y355 VanDerWaalsContact O-CB 3.3Å; N352-Y355 WeakPolarHBondContact O-CB 3.34Å; N352-Y355 PolarHBondContact O-N 3.05Å; N352-K356 PolarHBondContact O-N 3.1Å
353	E	88.2	Confident	87.6	Confident	121 Å²	121	47.8 Å²	47.8	57%	0.565	26%	0.255	S	S	*	.	H	α-helix	trans	-57.9	-32.3	-178.3	-61.1	-173.8	165.1	0	0	113	L317 E351 Y355 K356 Y357	L317-E353 HydrophobicContact CD1-CB 3.61Å; L317-E353 WeakPolarHBondContact CD2-OE2 3.33Å; E351-E353 PolarHBondContact O-N 2.9Å; E353-Y355 VanDerWaalsContact C-N 3.29Å; E353-Y355 PolarHBondContact O-N 3.18Å; E353-K356 PolarHBondContact O-N 3.12Å; E353-Y357 WeakPolarHBondContact O-CB 3.49Å; E353-Y357 PolarHBondContact O-N 3.25Å
354	C	88.7	Confident	87.5	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.014	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-34.2	174.2	-65.4	0	0	0	0	112.1	L320 N352 L358	L320-C354 HydrophobicContact CD1-CB 4.3Å; N352-C354 PolarHBondContact O-N 3.34Å; N352-C354 VanDerWaalsContact OD1-CB 3.27Å; N352-C354 WeakPolarHBondContact OD1-CB 3.5Å; N352-C354 PolarHBondContact OD1-N 2.79Å; C354-L358 WeakPolarHBondContact O-CB 3.3Å; C354-L358 WeakPolarHBondContact O-CD1 3.33Å; C354-L358 WeakPolarHBondContact O-CG 3.43Å; C354-L358 PolarHBondContact O-N 3Å; C354-L358 VanDerWaalsContact O-N 3.13Å
355	Y	90.1	Very high	87.6	Confident	18 Å²	18	55 Å²	55	7%	0.071	29%	0.292	C	S	.	.	H	α-helix	trans	-68.2	-47.8	176.6	-176.7	-94.5	0	0	0	110.8	L342 A345 A346 V350 N352 E353 L358 L359	L342-Y355 HydrophobicContact CD1-CD2 3.66Å; L342-Y355 HydrophobicContact CD1-CE2 3.6Å; L342-Y355 HydrophobicContact CD1-CG 4.41Å; L342-Y355 HydrophobicContact CG-CE2 4.21Å; A345-Y355 HydrophobicContact CB-CD2 4.01Å; A346-Y355 HydrophobicContact CB-CD2 4.25Å; A346-Y355 HydrophobicContact CB-CE2 3.91Å; V350-Y355 HydrophobicContact CB-CD1 4.45Å; V350-Y355 HydrophobicContact CB-CE1 4.41Å; V350-Y355 HydrophobicContact CG1-CD1 4.12Å; V350-Y355 HydrophobicContact CG1-CE1 3.93Å; V350-Y355 HydrophobicContact CG2-CE1 4.38Å; N352-Y355 VanDerWaalsContact O-CB 3.3Å; N352-Y355 WeakPolarHBondContact O-CB 3.34Å; N352-Y355 PolarHBondContact O-N 3.05Å; E353-Y355 VanDerWaalsContact C-N 3.29Å; E353-Y355 PolarHBondContact O-N 3.18Å; Y355-L358 PolarHBondContact O-N 2.76Å; Y355-L359 HydrophobicContact CD1-CD1 4.09Å; Y355-L359 HydrophobicContact CE1-CD1 3.51Å; Y355-L359 HydrophobicContact CE1-CG 4.37Å; Y355-L359 PolarHBondContact O-N 3.31Å
356	K	90	Very high	87.6	Confident	102 Å²	102	59.4 Å²	59.4	44%	0.443	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-49.8	178.1	-62.7	173.6	-176.2	159	0	111.5	E351 N352 E353 L358 L359 E360	E351-K356 WeakPolarHBondContact O-CE 3.45Å; E351-K356 PolarHBondContact O-NZ 3.26Å; N352-K356 PolarHBondContact O-N 3.1Å; E353-K356 PolarHBondContact O-N 3.12Å; K356-L358 PolarHBondContact O-N 2.88Å; K356-L359 WeakPolarHBondContact O-CB 3.49Å; K356-L359 PolarHBondContact O-N 3.27Å; K356-L359 VanDerWaalsContact O-N 3.11Å; K356-E360 WeakPolarHBondContact O-CG 3.38Å; K356-E360 PolarHBondContact O-N 2.94Å
357	Y	91.4	Very high	87.5	Confident	41 Å²	41	59.9 Å²	59.9	16%	0.161	32%	0.319	C	S	.	.	H	α-helix	trans	-67	-32.5	-178.1	-165.1	-98.1	0	0	0	113.5	L320 K321 L324 E353 L359 E360 T361	L320-Y357 HydrophobicContact CD2-CD1 3.55Å; L320-Y357 HydrophobicContact CD2-CE1 4.3Å; L320-Y357 HydrophobicContact CD2-CG 4.39Å; K321-Y357 HydrophobicContact CB-CE1 4.22Å; K321-Y357 HydrophobicContact CG-CD1 4.1Å; K321-Y357 HydrophobicContact CG-CD2 4.38Å; K321-Y357 HydrophobicContact CG-CE1 3.75Å; K321-Y357 HydrophobicContact CG-CE2 4.06Å; K321-Y357 HydrophobicContact CG-CG 4.38Å; L324-Y357 HydrophobicContact CB-CE1 4.36Å; L324-Y357 HydrophobicContact CD1-CD1 4.02Å; L324-Y357 HydrophobicContact CD1-CE1 4.03Å; E353-Y357 WeakPolarHBondContact O-CB 3.49Å; E353-Y357 PolarHBondContact O-N 3.25Å; Y357-L359 VanDerWaalsContact C-N 3.35Å; Y357-E360 PolarHBondContact O-N 3.5Å; Y357-T361 HydrophobicContact CD1-CG2 4.01Å; Y357-T361 HydrophobicContact CE1-CG2 3.57Å; Y357-T361 WeakPolarHBondContact O-CB 3.44Å; Y357-T361 WeakPolarHBondContact O-CG2 3.33Å; Y357-T361 PolarHBondContact O-N 3.45Å; Y357-T361 PolarHBondContact O-OG1 2.77Å
358	L	91.4	Very high	87.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.6	-37.9	171.9	-79.1	168.3	0	0	0	112	V312 L320 L324 V331 P341 L342 A345 C354 Y355 K356 T361 G362 A363	V312-L358 HydrophobicContact CG2-CD1 3.92Å; L320-L358 HydrophobicContact CD1-CD1 4.48Å; L320-L358 HydrophobicContact CD1-CG 4.46Å; L324-L358 HydrophobicContact CD1-CD2 3.88Å; V331-L358 HydrophobicContact CG1-CD2 4.25Å; P341-L358 HydrophobicContact CB-CD1 3.94Å; P341-L358 HydrophobicContact CB-CD2 4.23Å; L342-L358 HydrophobicContact CD1-CB 3.98Å; A345-L358 HydrophobicContact CB-CD1 3.97Å; C354-L358 WeakPolarHBondContact O-CB 3.3Å; C354-L358 WeakPolarHBondContact O-CD1 3.33Å; C354-L358 WeakPolarHBondContact O-CG 3.43Å; C354-L358 PolarHBondContact O-N 3Å; C354-L358 VanDerWaalsContact O-N 3.13Å; Y355-L358 PolarHBondContact O-N 2.76Å; K356-L358 PolarHBondContact O-N 2.88Å; L358-T361 WeakPolarHBondContact CA-OG1 3.28Å; L358-T361 PolarHBondContact O-OG1 3.44Å; L358-G362 PolarHBondContact O-N 3.42Å; L358-A363 HydrophobicContact CB-CB 4.08Å; L358-A363 WeakPolarHBondContact O-CB 3.21Å; L358-A363 PolarHBondContact O-N 2.89Å
359	L	90.1	Very high	87.7	Confident	54 Å²	54	61.7 Å²	61.7	28%	0.283	32%	0.321	S	S	.	.	H	α-helix	trans	-67.9	-44.5	174.5	-65.6	180	0	0	0	112	L342 Y355 K356 Y357 T361 G362 E365	L342-L359 HydrophobicContact CD1-CD2 3.81Å; L342-L359 HydrophobicContact CD1-CG 4.1Å; L342-L359 HydrophobicContact CD2-CD2 3.75Å; L342-L359 HydrophobicContact CG-CD2 4.45Å; Y355-L359 HydrophobicContact CD1-CD1 4.09Å; Y355-L359 HydrophobicContact CE1-CD1 3.51Å; Y355-L359 HydrophobicContact CE1-CG 4.37Å; Y355-L359 PolarHBondContact O-N 3.31Å; K356-L359 WeakPolarHBondContact O-CB 3.49Å; K356-L359 PolarHBondContact O-N 3.27Å; K356-L359 VanDerWaalsContact O-N 3.11Å; Y357-L359 VanDerWaalsContact C-N 3.35Å; L359-T361 VanDerWaalsContact C-N 3.27Å; L359-T361 PolarHBondContact O-N 2.79Å; L359-G362 PolarHBondContact O-N 2.78Å; L359-E365 HydrophobicContact CD2-CG 3.49Å; L359-E365 VanDerWaalsContact CD2-CG 3.49Å
360	E	89.5	Confident	87.5	Confident	149 Å²	149	63.8 Å²	63.8	70%	0.696	33%	0.332	S	S	*	.	H	α-helix	trans	-58.2	-37.2	176	-71.1	169.8	-173.8	0	0	112.7	K356 Y357 G362	K356-E360 WeakPolarHBondContact O-CG 3.38Å; K356-E360 PolarHBondContact O-N 2.94Å; Y357-E360 PolarHBondContact O-N 3.5Å; E360-G362 VanDerWaalsContact C-N 3.28Å; E360-G362 PolarHBondContact O-N 3.01Å
361	T	87.2	Confident	87.4	Confident	49 Å²	49	63.6 Å²	63.6	30%	0.301	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	2.3	177.1	51.4	0	0	0	0	114.3	L324 Y357 L358 L359	L324-T361 HydrophobicContact CB-CG2 4.45Å; L324-T361 HydrophobicContact CD1-CG2 4.24Å; Y357-T361 HydrophobicContact CD1-CG2 4.01Å; Y357-T361 HydrophobicContact CE1-CG2 3.57Å; Y357-T361 WeakPolarHBondContact O-CB 3.44Å; Y357-T361 WeakPolarHBondContact O-CG2 3.33Å; Y357-T361 PolarHBondContact O-N 3.45Å; Y357-T361 PolarHBondContact O-OG1 2.77Å; L358-T361 WeakPolarHBondContact CA-OG1 3.28Å; L358-T361 PolarHBondContact O-OG1 3.44Å; L359-T361 VanDerWaalsContact C-N 3.27Å; L359-T361 PolarHBondContact O-N 2.79Å
362	G	87.8	Confident	87.4	Confident	49 Å²	49	57.3 Å²	57.3	51%	0.505	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	33.2	172.8	0	0	0	0	0	115.4	N332 L358 L359 E360	N332-G362 PolarHBondContact ND2-O 3.14Å; L358-G362 PolarHBondContact O-N 3.42Å; L359-G362 PolarHBondContact O-N 2.78Å; E360-G362 VanDerWaalsContact C-N 3.28Å; E360-G362 PolarHBondContact O-N 3.01Å
363	A	89.1	Confident	87.5	Confident	10 Å²	10	59.4 Å²	59.4	8%	0.083	32%	0.315	C	S	.	.			trans	-64.3	138.3	170.6	0	0	0	0	0	112	V331 L342 L358 E365	V331-A363 VanDerWaalsContact CG1-CA 3.42Å; V331-A363 HydrophobicContact CG1-CB 3.5Å; V331-A363 VanDerWaalsContact CG1-CB 3.5Å; L342-A363 HydrophobicContact CB-CB 4.12Å; L342-A363 HydrophobicContact CD1-CB 4.36Å; L342-A363 HydrophobicContact CD2-CB 3.84Å; L342-A363 HydrophobicContact CG-CB 4.33Å; L358-A363 HydrophobicContact CB-CB 4.08Å; L358-A363 WeakPolarHBondContact O-CB 3.21Å; L358-A363 PolarHBondContact O-N 2.89Å; A363-E365 PolarHBondContact O-N 3.16Å; A363-E365 VanDerWaalsContact O-N 3.15Å
364	D	88.8	Confident	87.6	Confident	71 Å²	71	57.7 Å²	57.7	38%	0.38	31%	0.305	S	S	.	.			trans	-80.9	97.7	-177.6	179.7	17.6	0	0	0	111.4	N332 N366 S367	N332-D364 PolarHBondContact OD1-N 2.69Å; D364-N366 PolarHBondContact O-N 2.94Å; D364-N366 VanDerWaalsContact O-N 3.09Å; D364-N366 WeakPolarHBondContact OD1-CA 3.19Å; D364-N366 WeakPolarHBondContact OD1-CB 3.43Å; D364-N366 PolarHBondContact OD1-N 3.16Å; D364-S367 VanDerWaalsContact O-CB 3.28Å; D364-S367 WeakPolarHBondContact O-CB 3.44Å; D364-S367 PolarHBondContact O-N 3.44Å; D364-S367 PolarHBondContact O-OG 3Å; D364-S367 PolarHBondContact OD1-N 2.67Å; D364-S367 PolarHBondContact OD2-N 2.9Å
365	E	89.4	Confident	87.5	Confident	103 Å²	103	57.6 Å²	57.6	48%	0.481	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-21.5	170.4	-67.8	-174.3	-165.2	0	0	114.4	L342 L359 A363 P375	L342-E365 HydrophobicContact CD2-CG 4.24Å; L359-E365 HydrophobicContact CD2-CG 3.49Å; L359-E365 VanDerWaalsContact CD2-CG 3.49Å; A363-E365 PolarHBondContact O-N 3.16Å; A363-E365 VanDerWaalsContact O-N 3.15Å; E365-P375 WeakPolarHBondContact O-CD 3.46Å
366	N	89	Confident	87.4	Confident	93 Å²	93	64.3 Å²	64.3	50%	0.497	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-1.7	-178.8	-65.6	-74.5	0	0	0	113.4	D364 K374	D364-N366 PolarHBondContact O-N 2.94Å; D364-N366 VanDerWaalsContact O-N 3.09Å; D364-N366 WeakPolarHBondContact OD1-CA 3.19Å; D364-N366 WeakPolarHBondContact OD1-CB 3.43Å; D364-N366 PolarHBondContact OD1-N 3.16Å; N366-K374 PolarHBondContact OD1-NZ 3.2Å
367	S	87.8	Confident	87.2	Confident	10 Å²	10	63.1 Å²	63.1	7%	0.07	33%	0.327	C	S	.	.			trans	-57.4	138.3	173.8	61.3	0	0	0	0	110.4	T340 H343 D364 P375	T340-S367 PolarHBondContact OG1-OG 2.95Å; H343-S367 PolarHBondContact CE1-O 3.24Å; H343-S367 PolarHBondContact CE1-OG 2.95Å; D364-S367 VanDerWaalsContact O-CB 3.28Å; D364-S367 WeakPolarHBondContact O-CB 3.44Å; D364-S367 PolarHBondContact O-N 3.44Å; D364-S367 PolarHBondContact O-OG 3Å; D364-S367 PolarHBondContact OD1-N 2.67Å; D364-S367 PolarHBondContact OD2-N 2.9Å; S367-P375 VanDerWaalsContact O-CD 3.3Å; S367-P375 WeakPolarHBondContact O-CD 3.46Å
368	K	87.5	Confident	87	Confident	121 Å²	121	61.2 Å²	61.2	53%	0.526	32%	0.32	S	S	.	.			trans	-111.4	140.9	179.3	-65.8	-175.8	177.8	-171.1	0	112.2	K334 R373 K374	K334-K368 PolarHBondContact NZ-O 2.89Å; K368-R373 VanDerWaalsContact CA-O 3.27Å; K368-R373 WeakPolarHBondContact CA-O 3.47Å; K368-K374 HydrophobicContact CG-CG 4.5Å
369	D	84.7	Confident	86.7	Confident	8 Å²	8	63.8 Å²	63.8	4%	0.043	33%	0.333	C	S	.	.			trans	-78.3	-175.5	168.8	72.5	6.4	0	0	0	112.6	Q337 R339 D371 G372 R373 Y378	Q337-D369 WeakPolarHBondContact O-CB 3.37Å; R339-D369 HydrophobicContact CG-CB 3.65Å; D369-D371 PolarHBondContact O-N 3.35Å; D369-D371 WeakPolarHBondContact OD1-CA 3.45Å; D369-D371 PolarHBondContact OD1-N 3.17Å; D369-G372 PolarHBondContact O-N 3.07Å; D369-G372 VanDerWaalsContact O-N 3.11Å; D369-G372 PolarHBondContact OD1-N 2.91Å; D369-R373 PolarHBondContact N-O 3.37Å; D369-R373 WeakPolarHBondContact OD1-CB 3.31Å; D369-R373 PolarHBondContact OD1-N 3.42Å; D369-Y378 WeakPolarHBondContact OD2-CE2 3.41Å; D369-Y378 PolarHBondContact OD2-OH 3.34Å
370	C	78.3	Confident	86.4	Confident	69 Å²	69	66.5 Å²	66.5	47%	0.466	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-23.8	179.5	60.5	0	0	0	0	113.9	Q337 G372	Q337-C370 WeakPolarHBondContact O-CB 3.38Å; Q337-C370 PolarHBondContact O-N 3.06Å; Q337-C370 PolarHBondContact O-SG 3.41Å; C370-G372 VanDerWaalsContact C-N 3.34Å
371	D	79.6	Confident	86	Confident	64 Å²	64	63.2 Å²	63.2	34%	0.342	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	5.3	175.2	-68.7	-47.8	0	0	0	112.6	R94 D369 R373	R94-D371 IonicContact CZ-OD1 2.6Å; R94-D371 IonicContact NH1-OD1 3.33Å; R94-D371 PolarHBondContact NH1-OD1 3.17Å; R94-D371 IonicContact NH2-OD1 2.79Å; R94-D371 PolarHBondContact NH2-OD1 3.2Å; D369-D371 PolarHBondContact O-N 3.35Å; D369-D371 WeakPolarHBondContact OD1-CA 3.45Å; D369-D371 PolarHBondContact OD1-N 3.17Å; D371-R373 VanDerWaalsContact C-N 3.27Å; D371-R373 HydrophobicContact CB-CG 4.25Å; D371-R373 PolarHBondContact O-N 3.23Å
372	G	82.6	Confident	85.4	Confident	38 Å²	38	62.8 Å²	62.8	39%	0.392	34%	0.338	S	S	.	.	S	Bend	trans	77.7	7.4	177.6	0	0	0	0	0	114.9	D369 C370	D369-G372 PolarHBondContact O-N 3.07Å; D369-G372 VanDerWaalsContact O-N 3.11Å; D369-G372 PolarHBondContact OD1-N 2.91Å; C370-G372 VanDerWaalsContact C-N 3.34Å
373	R	87.2	Confident	84.6	Confident	76 Å²	76	68.8 Å²	68.8	29%	0.287	35%	0.353	S	S	.	.			trans	-77.7	151.2	179.3	-57	162.4	174.9	-168.6	-4.5	109.6	H343 K368 D369 D371 Y377 Y378	H343-R373 PolarHBondContact NE2-O 3.32Å; K368-R373 VanDerWaalsContact CA-O 3.27Å; K368-R373 WeakPolarHBondContact CA-O 3.47Å; D369-R373 PolarHBondContact N-O 3.37Å; D369-R373 WeakPolarHBondContact OD1-CB 3.31Å; D369-R373 PolarHBondContact OD1-N 3.42Å; D371-R373 VanDerWaalsContact C-N 3.27Å; D371-R373 HydrophobicContact CB-CG 4.25Å; D371-R373 PolarHBondContact O-N 3.23Å; R373-Y377 HydrophobicContact CB-CD1 4.12Å; R373-Y377 HydrophobicContact CB-CG 4.28Å; R373-Y377 HydrophobicContact CG-CD1 4.05Å; R373-Y377 HydrophobicContact CG-CE1 4.27Å; R373-Y377 HydrophobicContact CG-CG 4.36Å; R373-Y378 HydrophobicContact CB-CE2 4.01Å
374	K	89.7	Confident	83.6	Confident	84 Å²	84	70.7 Å²	70.7	37%	0.365	37%	0.365	S	S	.	.			trans	-98.8	162.1	174.8	-68.6	-172.5	179.8	-172.3	0	110.3	N366 K368 K376 Y377	N366-K374 PolarHBondContact OD1-NZ 3.2Å; K368-K374 HydrophobicContact CG-CG 4.5Å; K374-K376 PolarHBondContact O-N 3.27Å; K374-K376 VanDerWaalsContact O-N 3.14Å; K374-Y377 VanDerWaalsContact O-CB 3.3Å; K374-Y377 WeakPolarHBondContact O-CB 3.37Å; K374-Y377 PolarHBondContact O-N 3.01Å
375	P	86.7	Confident	82.5	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.006	35%	0.353	C	S	.	.	H	α-helix	trans	-47.3	-45.2	173	-25.9	29.5	0	0	0	113.2	L342 H343 A346 E365 S367 Y377 Y378	L342-P375 HydrophobicContact CB-CB 4.46Å; L342-P375 HydrophobicContact CB-CG 4.33Å; L342-P375 HydrophobicContact CD2-CB 4.09Å; L342-P375 HydrophobicContact CD2-CG 3.87Å; L342-P375 HydrophobicContact CG-CB 3.91Å; L342-P375 HydrophobicContact CG-CG 4.06Å; H343-P375 VanDerWaalsContact CE1-CD 3.44Å; H343-P375 WeakPolarHBondContact CE1-CD 3.43Å; H343-P375 WeakPolarHBondContact NE2-CD 3.32Å; A346-P375 HydrophobicContact CB-CB 4.33Å; A346-P375 WeakPolarHBondContact CB-O 3.39Å; E365-P375 WeakPolarHBondContact O-CD 3.46Å; S367-P375 VanDerWaalsContact O-CD 3.3Å; S367-P375 WeakPolarHBondContact O-CD 3.46Å; P375-Y377 PolarHBondContact O-N 3.17Å; P375-Y378 PolarHBondContact O-N 2.89Å
376	K	87.2	Confident	80.7	Confident	158 Å²	158	74 Å²	74	69%	0.687	37%	0.37	S	S	*	.	H	α-helix	trans	-55.8	-24.6	-179.2	-164.6	172.2	-176.2	167.4	0	114.7	K374 I379	K374-K376 PolarHBondContact O-N 3.27Å; K374-K376 VanDerWaalsContact O-N 3.14Å; K376-I379 HydrophobicContact CB-CD1 4.33Å; K376-I379 HydrophobicContact CG-CD1 3.85Å
377	Y	87.3	Confident	78.3	Confident	78 Å²	78	75.4 Å²	75.4	31%	0.306	38%	0.381	S	S	.	.	H	α-helix	trans	-68	-35.3	175.6	176.3	-95.2	0	0	0	112.4	R373 K374 P375 I379 T380 H381	R373-Y377 HydrophobicContact CB-CD1 4.12Å; R373-Y377 HydrophobicContact CB-CG 4.28Å; R373-Y377 HydrophobicContact CG-CD1 4.05Å; R373-Y377 HydrophobicContact CG-CE1 4.27Å; R373-Y377 HydrophobicContact CG-CG 4.36Å; K374-Y377 VanDerWaalsContact O-CB 3.3Å; K374-Y377 WeakPolarHBondContact O-CB 3.37Å; K374-Y377 PolarHBondContact O-N 3.01Å; P375-Y377 PolarHBondContact O-N 3.17Å; Y377-I379 VanDerWaalsContact C-N 3.28Å; Y377-I379 PolarHBondContact O-N 3.3Å; Y377-T380 PolarHBondContact O-N 3.32Å; Y377-T380 PolarHBondContact O-OG1 3.46Å; Y377-H381 HydrophobicContact CD1-CB 4.16Å; Y377-H381 AromaticContact CD2-ND1 4Å; Y377-H381 HydrophobicContact CE1-CB 3.67Å; Y377-H381 AromaticContact CE1-CG 3.77Å; Y377-H381 AromaticContact CE2-CE1 3.68Å; Y377-H381 AromaticContact CE2-ND1 3.64Å; Y377-H381 AromaticContact CZ-CD2 3.74Å; Y377-H381 AromaticContact CZ-CE1 3.94Å; Y377-H381 AromaticContact CZ-CG 3.55Å; Y377-H381 AromaticContact CZ-ND1 3.68Å; Y377-H381 AromaticContact CZ-NE2 3.95Å; Y377-H381 PolarHBondContact O-N 2.99Å; Y377-H381 PolarHBondContact O-ND1 2.74Å; Y377-H381 PolarHBondContact OH-CD2 2.81Å
378	Y	86	Confident	75.5	Confident	0 Å²	0	84 Å²	84	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-76.5	-14.5	-175.3	-72.9	-82.4	0	0	0	113.7	R339 H343 D369 R373 P375 T380 H381 A382 C384 L385	R339-Y378 PolarHBondContact NE-OH 3.44Å; R339-Y378 PolarHBondContact NH2-OH 3.42Å; H343-Y378 HydrophobicContact CB-CD2 4.45Å; H343-Y378 AromaticContact CD2-CD2 3.83Å; H343-Y378 AromaticContact CD2-CE2 3.71Å; D369-Y378 WeakPolarHBondContact OD2-CE2 3.41Å; D369-Y378 PolarHBondContact OD2-OH 3.34Å; R373-Y378 HydrophobicContact CB-CE2 4.01Å; P375-Y378 PolarHBondContact O-N 2.89Å; Y378-T380 VanDerWaalsContact C-N 3.25Å; Y378-T380 PolarHBondContact O-N 2.72Å; Y378-H381 CarbonylContact O-C 3.54Å; Y378-H381 PolarHBondContact O-N 2.76Å; Y378-A382 PolarHBondContact O-N 2.73Å; Y378-C384 HydrophobicContact CD1-CB 4.06Å; Y378-C384 HydrophobicContact CE1-CB 3.53Å; Y378-L385 HydrophobicContact CD1-CD1 3.43Å; Y378-L385 VanDerWaalsContact CD1-CD1 3.43Å; Y378-L385 HydrophobicContact CD1-CD2 4.27Å; Y378-L385 HydrophobicContact CD1-CG 3.49Å; Y378-L385 VanDerWaalsContact CD1-CG 3.49Å; Y378-L385 HydrophobicContact CE1-CD1 4.2Å; Y378-L385 HydrophobicContact CE1-CD2 4.26Å; Y378-L385 HydrophobicContact CE1-CG 3.76Å; Y378-L385 HydrophobicContact CG-CD1 3.77Å; Y378-L385 HydrophobicContact CG-CG 4.24Å
379	I	85.7	Confident	72.6	Confident	55 Å²	55	86.6 Å²	86.6	28%	0.282	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-39.9	171	-57.5	169.3	0	0	0	111	A346 V350 K376 Y377	A346-I379 HydrophobicContact CB-CG1 3.9Å; A346-I379 WeakPolarHBondContact O-CA 3.4Å; V350-I379 HydrophobicContact CG2-CD1 3.57Å; V350-I379 HydrophobicContact CG2-CG1 4.02Å; V350-I379 HydrophobicContact CG2-CG2 3.8Å; K376-I379 HydrophobicContact CB-CD1 4.33Å; K376-I379 HydrophobicContact CG-CD1 3.85Å; Y377-I379 VanDerWaalsContact C-N 3.28Å; Y377-I379 PolarHBondContact O-N 3.3Å
380	T	83	Confident	69.7	Low	110 Å²	110	90.9 Å²	90.9	68%	0.675	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-13.7	179	50.6	0	0	0	0	113.6	Y377 Y378	Y377-T380 PolarHBondContact O-N 3.32Å; Y377-T380 PolarHBondContact O-OG1 3.46Å; Y378-T380 VanDerWaalsContact C-N 3.25Å; Y378-T380 PolarHBondContact O-N 2.72Å
381	H	82	Confident	67.2	Low	80 Å²	80	99.2 Å²	99.2	37%	0.37	49%	0.488	S	S	.	.			trans	-125.7	47.7	-175.2	-61.2	79.3	0	0	0	112	Y377 Y378 E383 C384	Y377-H381 HydrophobicContact CD1-CB 4.16Å; Y377-H381 AromaticContact CD2-ND1 4Å; Y377-H381 HydrophobicContact CE1-CB 3.67Å; Y377-H381 AromaticContact CE1-CG 3.77Å; Y377-H381 AromaticContact CE2-CE1 3.68Å; Y377-H381 AromaticContact CE2-ND1 3.64Å; Y377-H381 AromaticContact CZ-CD2 3.74Å; Y377-H381 AromaticContact CZ-CE1 3.94Å; Y377-H381 AromaticContact CZ-CG 3.55Å; Y377-H381 AromaticContact CZ-ND1 3.68Å; Y377-H381 AromaticContact CZ-NE2 3.95Å; Y377-H381 PolarHBondContact O-N 2.99Å; Y377-H381 PolarHBondContact O-ND1 2.74Å; Y377-H381 PolarHBondContact OH-CD2 2.81Å; Y378-H381 CarbonylContact O-C 3.54Å; Y378-H381 PolarHBondContact O-N 2.76Å; H381-E383 PolarHBondContact O-N 3Å; H381-E383 VanDerWaalsContact O-N 3.15Å; H381-C384 WeakPolarHBondContact O-CB 3.45Å; H381-C384 PolarHBondContact O-N 2.7Å
382	A	74.6	Confident	64.5	Low	41 Å²	41	100.5 Å²	100.5	34%	0.339	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-54.6	-32.9	-177.3	0	0	0	0	0	113.6	G347 Y378 C384 L385	G347-A382 VanDerWaalsContact O-CB 3.25Å; G347-A382 WeakPolarHBondContact O-CB 3.27Å; Y378-A382 PolarHBondContact O-N 2.73Å; A382-C384 PolarHBondContact O-N 3.32Å; A382-C384 VanDerWaalsContact O-N 3.13Å; A382-L385 PolarHBondContact O-N 2.83Å
383	E	71.5	Confident	61.8	Low	175 Å²	175	105.2 Å²	105.2	82%	0.818	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-56.5	-30.1	177.9	-59.3	-168.8	174.4	0	0	113.3	H381 L385 R386	H381-E383 PolarHBondContact O-N 3Å; H381-E383 VanDerWaalsContact O-N 3.15Å; E383-L385 PolarHBondContact O-N 3.1Å; E383-L385 VanDerWaalsContact O-N 3.11Å; E383-R386 PolarHBondContact O-N 3.1Å
384	C	67.5	Low	58.9	Low	50 Å²	50	107 Å²	107	34%	0.338	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-67.8	-8.2	179.1	-69.7	0	0	0	0	114.2	R339 Y378 H381 A382	R339-C384 PolarHBondContact NH1-O 3Å; R339-C384 PolarHBondContact NH2-O 3.39Å; Y378-C384 HydrophobicContact CD1-CB 4.06Å; Y378-C384 HydrophobicContact CE1-CB 3.53Å; H381-C384 WeakPolarHBondContact O-CB 3.45Å; H381-C384 PolarHBondContact O-N 2.7Å; A382-C384 PolarHBondContact O-N 3.32Å; A382-C384 VanDerWaalsContact O-N 3.13Å
385	L	64.8	Low	55.9	Low	24 Å²	24	107.6 Å²	107.6	13%	0.126	57%	0.566	C	S	.	*	G	3₁₀ helix	trans	-100.5	-21.1	175	-74.8	153.2	0	0	0	113.4	H343 Y344 Y378 A382 E383 V387	H343-L385 VanDerWaalsContact O-CD1 3.29Å; H343-L385 WeakPolarHBondContact O-CD1 3.41Å; Y344-L385 HydrophobicContact CD2-CD2 4.04Å; Y344-L385 HydrophobicContact CE2-CD2 4.23Å; Y344-L385 HydrophobicContact CG-CD2 4.21Å; Y378-L385 HydrophobicContact CD1-CD1 3.43Å; Y378-L385 VanDerWaalsContact CD1-CD1 3.43Å; Y378-L385 HydrophobicContact CD1-CD2 4.27Å; Y378-L385 HydrophobicContact CD1-CG 3.49Å; Y378-L385 VanDerWaalsContact CD1-CG 3.49Å; Y378-L385 HydrophobicContact CE1-CD1 4.2Å; Y378-L385 HydrophobicContact CE1-CD2 4.26Å; Y378-L385 HydrophobicContact CE1-CG 3.76Å; Y378-L385 HydrophobicContact CG-CD1 3.77Å; Y378-L385 HydrophobicContact CG-CG 4.24Å; A382-L385 PolarHBondContact O-N 2.83Å; E383-L385 PolarHBondContact O-N 3.1Å; E383-L385 VanDerWaalsContact O-N 3.11Å; L385-V387 PolarHBondContact O-N 2.76Å
386	R	51.8	Low	52.9	Low	220 Å²	220	114.3 Å²	114.3	83%	0.83	60%	0.6	S	S	*	*			trans	-78.5	88.4	-176.5	-86.1	-177.2	165.5	167.9	-3.8	112	E383 K388	E383-R386 PolarHBondContact O-N 3.1Å; R386-K388 PolarHBondContact O-N 3.34Å
387	V	40	Very low	50	Low	121 Å²	121	113 Å²	113	73%	0.733	61%	0.605	S	S	*	*			trans	-66.4	116.2	158.4	-179.2	0	0	0	0	108	L385 L389	L385-V387 PolarHBondContact O-N 2.76Å; V387-L389 PolarHBondContact O-N 3.43Å
388	K	27.4	Very low	47.1	Very low	191 Å²	191	116.8 Å²	116.8	83%	0.83	63%	0.625	S	S	*	*			trans	-64	105.5	179.9	-73.4	-178.3	177	178.8	0	110.6	R386 S390	R386-K388 PolarHBondContact O-N 3.34Å; K388-S390 VanDerWaalsContact C-N 3.33Å; K388-S390 PolarHBondContact O-N 3.2Å
389	L	26.4	Very low	44.2	Very low	176 Å²	176	123.1 Å²	123.1	92%	0.921	66%	0.659	S	S	*	*			trans	-70.4	86.8	164	-88.6	153.2	0	0	0	109.3	V387	V387-L389 PolarHBondContact O-N 3.43Å
390	S	24.3	Very low	41.3	Very low	97 Å²	97	127.3 Å²	127.3	68%	0.678	68%	0.682	S	S	*	*			trans	-109.9	120.6	170.2	59.1	0	0	0	0	110.9	K388	K388-S390 VanDerWaalsContact C-N 3.33Å; K388-S390 PolarHBondContact O-N 3.2Å
391	R	25.5	Very low	38.5	Very low	244 Å²	244	127.1 Å²	127.1	92%	0.921	69%	0.685	S	S	*	*			trans	81.3	99.6	171.5	-55.5	-177.8	178.2	178.6	-1.6	116.5
392	S	23.6	Very low	35.9	Very low	91 Å²	91	130.9 Å²	130.9	64%	0.636	71%	0.708	S	S	*	*			trans	-67.2	137.9	156.7	45	0	0	0	0	111.5	T394	S392-T394 PolarHBondContact O-N 3.19Å
393	P	26.2	Very low	33.6	Very low	138 Å²	138	133.1 Å²	133.1	90%	0.896	73%	0.726	S	S	*	*			trans	-84.9	82.6	168.4	33.1	-30.7	0	0	0	110.1
394	T	26.4	Very low	31.5	Very low	113 Å²	113	130 Å²	130	69%	0.693	72%	0.724	S	S	*	*			trans	-86.5	129.1	166.7	42.1	0	0	0	0	110.2	S392	S392-T394 PolarHBondContact O-N 3.19Å
395	A	25.3	Very low	29.7	Very low	97 Å²	97	132.9 Å²	132.9	80%	0.802	75%	0.745	S	S	*	*			trans	-0.7	113.3	167	0	0	0	0	0	118.6
396	I	25.5	Very low	28.1	Very low	142 Å²	142	139.2 Å²	139.2	73%	0.728	78%	0.778	S	S	*	*			trans	-130.7	102.8	143.6	-60.9	-177.6	0	0	0	107.9	H398	I396-H398 HydrophobicContact CG2-CB 3.86Å
397	V	25.1	Very low	27.1	Very low	129 Å²	129	135.5 Å²	135.5	78%	0.782	78%	0.775	S	S	*	*			trans	-96.6	89.7	158.5	174.3	0	0	0	0	106
398	H	27	Very low	26.8	Very low	158 Å²	158	134.1 Å²	134.1	73%	0.731	77%	0.771	S	S	*	*			trans	-135	103.6	166.6	-75.4	33	0	0	0	104.8	I396	I396-H398 HydrophobicContact CG2-CB 3.86Å
399	N	24.7	Very low	27	Very low	134 Å²	134	133.5 Å²	133.5	72%	0.717	77%	0.771	S	S	*	*				65.6	104.6	82.2	-72.1	-4.1	0	0	0	113.2
400	N	24.7	Very low	27.2	Very low	143 Å²	143	131.9 Å²	131.9	77%	0.765	76%	0.763	S	S	*	*			trans	48.5	133.4	139.7	-59.5	-2.8	0	0	0	121.7
401	S	24.8	Very low	27.4	Very low	105 Å²	105	132 Å²	132	73%	0.734	76%	0.763	S	S	*	*			trans	52.4	91.9	139.4	62.5	0	0	0	0	119.1
402	N	26.7	Very low	27.7	Very low	160 Å²	160	127.8 Å²	127.8	86%	0.856	76%	0.758	S	S	*	*			trans	-133.6	116.4	136.5	-70.4	-54.1	0	0	0	104.7
403	A	27.5	Very low	27.9	Very low	87 Å²	87	131.8 Å²	131.8	72%	0.719	77%	0.767	S	S	*	*			cis	61.4	130.8	49.4	0	0	0	0	0	111.6
404	S	26.8	Very low	28.2	Very low	111 Å²	111	132.9 Å²	132.9	78%	0.776	76%	0.764	S	S	*	*			cis	-169.8	-178.5	-2.2	47	0	0	0	0	110.5
405	S	29.3	Very low	28.2	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	76%	0.76	S	S	*	*			trans	112.8	132.9	157.2	73.4	0	0	0	0	117.4
406	L	31.5	Very low	28.3	Very low	156 Å²	156	133.2 Å²	133.2	82%	0.817	76%	0.76	S	S	*	*	S	Bend	trans	65.3	101.4	-165.5	-51.8	171.7	0	0	0	113.7
407	D	30.8	Very low	28.4	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	76%	0.762	S	S	*	*			cis	-173	155.3	-9.1	-106.2	5.2	0	0	0	105.9
408	S	32.5	Very low	28.5	Very low	93 Å²	93	131.4 Å²	131.4	65%	0.65	77%	0.765	S	S	*	*			cis	-157.3	177.3	2.7	-90.2	0	0	0	0	110.8
409	Q	31.6	Very low	28.7	Very low	178 Å²	178	127.7 Å²	127.7	83%	0.832	77%	0.77	S	S	*	*			trans	77.4	113.5	161.7	-75.3	174.4	-20.3	0	0	120.7
410	D	31.5	Very low	28.8	Very low	141 Å²	141	128.6 Å²	128.6	75%	0.754	78%	0.78	S	S	*	*			trans	89.9	83.6	141.5	-57.4	1.9	0	0	0	122.7
411	S	27.7	Very low	29	Very low	99 Å²	99	125.6 Å²	125.6	69%	0.692	78%	0.783	S	S	*	*				89.7	109.6	118.3	-57.3	0	0	0	0	123.7
412	L	31.6	Very low	29	Very low	156 Å²	156	130.7 Å²	130.7	82%	0.817	79%	0.792	S	S	*	*			trans	67.3	107.2	141.9	-56.1	164.5	0	0	0	118.4
413	E	29.3	Very low	29	Very low	176 Å²	176	126.1 Å²	126.1	82%	0.822	78%	0.782	S	S	*	*				59.8	138	77.2	-58.8	-164.2	-176.7	0	0	114.3
414	I	31.1	Very low	28.9	Very low	160 Å²	160	129.9 Å²	129.9	82%	0.821	79%	0.791	S	S	*	*			cis	-148.4	174	39.9	-70.8	174.3	0	0	0	111.9
415	S	28	Very low	28.9	Very low	88 Å²	88	134.3 Å²	134.3	62%	0.615	80%	0.796	S	S	*	*			trans	-101.2	179	-161	54.6	0	0	0	0	120.3
416	T	26.8	Very low	28.7	Very low	130 Å²	130	140.9 Å²	140.9	80%	0.798	80%	0.804	S	S	*	*			trans	79.2	155.8	159	72.9	0	0	0	0	118.5
417	S	26.9	Very low	28.4	Very low	112 Å²	112	142.2 Å²	142.2	78%	0.783	81%	0.806	S	S	*	*			cis	-154.9	-178	-6.9	39.8	0	0	0	0	112.2
418	S	26.7	Very low	28.3	Very low	120 Å²	120	142.9 Å²	142.9	84%	0.839	81%	0.809	S	S	*	*			trans	-61	153.9	-177.5	52.1	0	0	0	0	118.5
419	G	31.4	Very low	28.1	Very low	80 Å²	80	144 Å²	144	83%	0.825	81%	0.814	S	S	*	*			trans	-162.7	126.8	163.7	0	0	0	0	0	114.7
420	T	26.5	Very low	27.8	Very low	153 Å²	153	141.7 Å²	141.7	94%	0.939	81%	0.812	S	S	*	*			trans	-88.6	139.4	-179.7	52	0	0	0	0	113
421	G	29.2	Very low	27.5	Very low	80 Å²	80	144.2 Å²	144.2	83%	0.825	82%	0.816	S	S	*	*			trans	-150.4	115.9	178.7	0	0	0	0	0	115
422	K	26.1	Very low	27.2	Very low	213 Å²	213	147.4 Å²	147.4	93%	0.926	82%	0.822	S	S	*	*			trans	-71.9	141.5	-177.1	-64.8	163.5	177.9	169.6	0	113.5
423	G	25.2	Very low	26.9	Very low	63 Å²	63	147.9 Å²	147.9	65%	0.649	83%	0.825	S	S	*	*			trans	68.1	117.3	130.6	0	0	0	0	0	120.5
424	N	26.4	Very low	26.7	Very low	167 Å²	167	147 Å²	147	89%	0.893	83%	0.825	S	S	*	*				-171.4	139.9	101.6	-99.8	-37.5	0	0	0	112.9
425	K	26	Very low	26.4	Very low	203 Å²	203	148 Å²	148	88%	0.883	83%	0.826	S	S	*	*			trans	-81.2	124.8	164.4	-71.9	174.9	177.1	173.8	0	108.6
426	R	25.5	Very low	26.2	Very low	249 Å²	249	151.1 Å²	151.1	94%	0.94	84%	0.836	S	S	*	*			trans	-130.6	146.9	151.6	-84.3	-170	170.3	-179.8	-2.9	109.7
427	Q	26	Very low	26.1	Very low	184 Å²	184	151.9 Å²	151.9	86%	0.86	84%	0.84	S	S	*	*			trans	-88.9	151.1	-170.2	-64.3	159.9	-26.5	0	0	110.6
428	N	28.7	Very low	26	Very low	155 Å²	155	154.2 Å²	154.2	83%	0.829	84%	0.844	S	S	*	*			trans	21.8	141.3	143.3	-62.8	-0.7	0	0	0	119
429	P	28.8	Very low	26	Very low	117 Å²	117	160.1 Å²	160.1	76%	0.76	85%	0.848	S	S	*	*				-155.9	-170.6	61.7	35.9	-11.2	0	0	0	117.5
430	V	23.6	Very low	25.7	Very low	129 Å²	129	161 Å²	161	78%	0.782	84%	0.842	S	S	*	*			trans	70.1	108.9	162.8	-166.6	0	0	0	0	116.3
431	K	25.6	Very low	25.9	Very low	195 Å²	195	160.5 Å²	160.5	85%	0.848	84%	0.838	S	S	*	*				64.7	130.9	71.8	-103.5	-177.6	178.3	-178.6	0	116.4
432	M	21.9	Very low	25.9	Very low	166 Å²	166	160.6 Å²	160.6	82%	0.818	83%	0.832	S	S	*	*			trans	92.8	145.4	172.2	-61.9	-177.2	56.9	0	0	118.1
433	L	25.6	Very low	26.3	Very low	166 Å²	166	154.1 Å²	154.1	87%	0.869	81%	0.81	S	S	*	*			trans	57.7	96.7	-168.4	-61.7	116.8	0	0	0	113.8
434	L	25.3	Very low	26.8	Very low	157 Å²	157	155.8 Å²	155.8	82%	0.822	81%	0.81	S	S	*	*			cis	68.2	112.8	22.2	-89.3	170.8	0	0	0	116.4
435	Q	23.5	Very low	27.1	Very low	182 Å²	182	153.5 Å²	153.5	85%	0.85	80%	0.797	S	S	*	*			trans	80.5	152.9	171.8	-66.3	174.1	-27.6	0	0	117.5
436	D	24	Very low	27.6	Very low	153 Å²	153	148.9 Å²	148.9	82%	0.818	78%	0.781	S	S	*	*			trans	68.8	85.5	178.6	-58.8	-18.6	0	0	0	119.7
437	T	25.7	Very low	28.4	Very low	145 Å²	145	142.5 Å²	142.5	89%	0.89	76%	0.762	S	S	*	*			trans	-162	26.9	143.4	11.1	0	0	0	0	114.9	R439	T437-R439 PolarHBondContact O-N 3.34Å
438	D	24.7	Very low	29.1	Very low	161 Å²	161	141.2 Å²	141.2	86%	0.861	75%	0.75	S	S	*	*			trans	-80.8	93.6	170.8	-81.1	-37	0	0	0	111.1
439	R	25.7	Very low	29.7	Very low	244 Å²	244	139.9 Å²	139.9	92%	0.921	74%	0.737	S	S	*	*			trans	174.7	94.7	162.4	-96	152.1	-164.2	-154	10.3	112.3	T437	T437-R439 PolarHBondContact O-N 3.34Å
440	S	26.3	Very low	30.3	Very low	100 Å²	100	138.4 Å²	138.4	70%	0.699	72%	0.721	S	S	*	*	S	Bend	trans	-168.2	-5.4	164.2	51.9	0	0	0	0	119.2
441	T	29.7	Very low	31.3	Very low	141 Å²	141	137.6 Å²	137.6	87%	0.865	71%	0.709	S	S	*	*	S	Bend	trans	-123.9	26	-165.4	39.9	0	0	0	0	116.9
442	A	30.4	Very low	32.2	Very low	83 Å²	83	133.1 Å²	133.1	69%	0.686	69%	0.693	S	S	*	*	S	Bend	trans	-125.9	8.2	-177.5	0	0	0	0	0	115.8
443	T	33.2	Very low	33.3	Very low	77 Å²	77	126.8 Å²	126.8	47%	0.472	67%	0.668	S	S	.	*			trans	-78.3	-44.6	-161.8	37.6	0	0	0	0	117.4	L445 L446 E447	T443-L445 VanDerWaalsContact C-N 3.32Å; T443-L445 PolarHBondContact O-N 3.19Å; T443-L445 VanDerWaalsContact O-N 3.14Å; T443-L446 PolarHBondContact O-N 2.65Å; T443-E447 PolarHBondContact O-N 2.89Å; T443-E447 VanDerWaalsContact O-N 3.14Å
444	P	35.3	Very low	34.1	Very low	98 Å²	98	127 Å²	127	64%	0.636	66%	0.657	S	S	*	*	H	α-helix	trans	-65.5	-32.4	-164.5	-21.6	32.3	0	0	0	114.5	Y448	P444-Y448 WeakPolarHBondContact O-CB 3.34Å; P444-Y448 PolarHBondContact O-N 3.44Å
445	L	33.9	Very low	35.2	Very low	119 Å²	119	123.9 Å²	123.9	62%	0.623	65%	0.648	S	S	*	*	H	α-helix	trans	-92.4	-4.5	-172.7	-127.4	157.2	0	0	0	113.2	T443 K449	T443-L445 VanDerWaalsContact C-N 3.32Å; T443-L445 PolarHBondContact O-N 3.19Å; T443-L445 VanDerWaalsContact O-N 3.14Å; L445-K449 VanDerWaalsContact CD2-NZ 3.28Å; L445-K449 VanDerWaalsContact O-CD 3.25Å; L445-K449 WeakPolarHBondContact O-CD 3.3Å; L445-K449 WeakPolarHBondContact O-CE 3.38Å; L445-K449 WeakPolarHBondContact O-CG 3.47Å; L445-K449 PolarHBondContact O-NZ 2.93Å
446	L	37	Very low	36.2	Very low	106 Å²	106	119.4 Å²	119.4	56%	0.555	63%	0.63	S	S	*	*	H	α-helix	trans	-97.4	-42.4	169.3	-143.1	86.9	0	0	0	110.2	T443 K449 M450	T443-L446 PolarHBondContact O-N 2.65Å; L446-K449 PolarHBondContact O-N 3.42Å; L446-M450 HydrophobicContact CD2-CE 4.16Å; L446-M450 WeakPolarHBondContact O-CG 3.39Å; L446-M450 PolarHBondContact O-N 2.94Å
447	E	41.4	Very low	37.1	Very low	114 Å²	114	118.3 Å²	118.3	53%	0.533	63%	0.631	S	S	.	*	H	α-helix	trans	-61.6	-48.7	176.7	-72.2	173.8	131.5	0	0	111.8	T443 K449 M450 E451	T443-E447 PolarHBondContact O-N 2.89Å; T443-E447 VanDerWaalsContact O-N 3.14Å; E447-K449 PolarHBondContact O-N 3.38Å; E447-K449 VanDerWaalsContact O-N 3.12Å; E447-M450 CarbonylContact O-C 3.53Å; E447-M450 WeakPolarHBondContact O-CA 3.34Å; E447-M450 WeakPolarHBondContact O-CB 3.49Å; E447-M450 PolarHBondContact O-N 3.28Å; E447-E451 PolarHBondContact O-N 3.15Å
448	Y	40.3	Very low	38.2	Very low	157 Å²	157	114.1 Å²	114.1	62%	0.616	60%	0.603	S	S	*	*	H	α-helix	trans	-58.5	-29.2	175.8	-165.6	-102	0	0	0	113.4	P444 L452	P444-Y448 WeakPolarHBondContact O-CB 3.34Å; P444-Y448 PolarHBondContact O-N 3.44Å; Y448-L452 HydrophobicContact CD1-CD1 4.32Å; Y448-L452 HydrophobicContact CE1-CD1 4.02Å; Y448-L452 PolarHBondContact O-N 3.08Å
449	K	42.2	Very low	40	Very low	127 Å²	127	109.2 Å²	109.2	55%	0.552	58%	0.581	S	S	*	*	H	α-helix	trans	-81.5	-26.8	174.4	-70.8	177.3	-173.4	145.3	0	113	L445 L446 E447 A453	L445-K449 VanDerWaalsContact CD2-NZ 3.28Å; L445-K449 VanDerWaalsContact O-CD 3.25Å; L445-K449 WeakPolarHBondContact O-CD 3.3Å; L445-K449 WeakPolarHBondContact O-CE 3.38Å; L445-K449 WeakPolarHBondContact O-CG 3.47Å; L445-K449 PolarHBondContact O-NZ 2.93Å; L446-K449 PolarHBondContact O-N 3.42Å; E447-K449 PolarHBondContact O-N 3.38Å; E447-K449 VanDerWaalsContact O-N 3.12Å; K449-A453 PolarHBondContact O-N 3.08Å
450	M	41.3	Very low	41.4	Very low	87 Å²	87	102.6 Å²	102.6	43%	0.429	57%	0.57	S	S	.	*	H	α-helix	trans	-74.3	-36.5	171.4	-71.1	-167.5	176.1	0	0	111.4	L446 E447 A453 R454	L446-M450 HydrophobicContact CD2-CE 4.16Å; L446-M450 WeakPolarHBondContact O-CG 3.39Å; L446-M450 PolarHBondContact O-N 2.94Å; E447-M450 CarbonylContact O-C 3.53Å; E447-M450 WeakPolarHBondContact O-CA 3.34Å; E447-M450 WeakPolarHBondContact O-CB 3.49Å; E447-M450 PolarHBondContact O-N 3.28Å; M450-A453 PolarHBondContact O-N 3.41Å; M450-R454 VanDerWaalsContact O-CG 3.32Å; M450-R454 WeakPolarHBondContact O-CG 3.31Å; M450-R454 PolarHBondContact O-N 3.38Å
451	E	45.3	Very low	42.5	Very low	111 Å²	111	104.2 Å²	104.2	52%	0.519	57%	0.571	S	S	.	*	H	α-helix	trans	-63.2	-46.4	173.7	-71	-177.8	130.1	0	0	112.2	E447 A453 R454 S455	E447-E451 PolarHBondContact O-N 3.15Å; E451-A453 PolarHBondContact O-N 3.02Å; E451-A453 VanDerWaalsContact O-N 3.16Å; E451-R454 WeakPolarHBondContact O-CB 3.47Å; E451-R454 PolarHBondContact O-N 3.2Å; E451-S455 PolarHBondContact O-N 3.16Å; E451-S455 VanDerWaalsContact O-N 3.16Å; E451-S455 PolarHBondContact O-OG 3.38Å
452	L	44	Very low	43.3	Very low	101 Å²	101	102.3 Å²	102.3	53%	0.529	55%	0.554	S	S	.	*	H	α-helix	trans	-60.5	-21.8	173.5	-109.9	150.4	0	0	0	114	Y448 S455	Y448-L452 HydrophobicContact CD1-CD1 4.32Å; Y448-L452 HydrophobicContact CE1-CD1 4.02Å; Y448-L452 PolarHBondContact O-N 3.08Å; L452-S455 PolarHBondContact O-OG 3.18Å
453	A	43.8	Very low	44.3	Very low	34 Å²	34	103.1 Å²	103.1	28%	0.281	54%	0.54	S	S	.	.	H	α-helix	trans	-89.4	-20.8	172.9	0	0	0	0	0	113.4	K449 M450 E451	K449-A453 PolarHBondContact O-N 3.08Å; M450-A453 PolarHBondContact O-N 3.41Å; E451-A453 PolarHBondContact O-N 3.02Å; E451-A453 VanDerWaalsContact O-N 3.16Å
454	R	44	Very low	45	Very low	171 Å²	171	101 Å²	101	65%	0.645	53%	0.53	S	S	*	.	H	α-helix	trans	-77.6	-33.3	175.2	-72.1	169	-169.3	176.2	3.8	112.1	M450 E451 L456 R463	M450-R454 VanDerWaalsContact O-CG 3.32Å; M450-R454 WeakPolarHBondContact O-CG 3.31Å; M450-R454 PolarHBondContact O-N 3.38Å; E451-R454 WeakPolarHBondContact O-CB 3.47Å; E451-R454 PolarHBondContact O-N 3.2Å; R454-L456 VanDerWaalsContact C-N 3.32Å; R454-L456 PolarHBondContact O-N 3.03Å; R454-R463 PolarHBondContact O-NH2 3.32Å
455	S	47.9	Very low	45.6	Very low	91 Å²	91	98.6 Å²	98.6	64%	0.636	52%	0.519	S	S	*	.	S	Bend	trans	-77.8	-6.2	-177.3	57.3	0	0	0	0	115.5	E451 L452	E451-S455 PolarHBondContact O-N 3.16Å; E451-S455 VanDerWaalsContact O-N 3.16Å; E451-S455 PolarHBondContact O-OG 3.38Å; L452-S455 PolarHBondContact O-OG 3.18Å
456	L	45	Very low	46.4	Very low	87 Å²	87	97.7 Å²	97.7	46%	0.455	51%	0.51	S	S	.	.	S	Bend	trans	-82.3	130.2	177	-80.2	157.8	0	0	0	112	R454 L458 R463	R454-L456 VanDerWaalsContact C-N 3.32Å; R454-L456 PolarHBondContact O-N 3.03Å; L456-L458 VanDerWaalsContact C-N 3.27Å; L456-L458 HydrophobicContact CB-CD1 3.96Å; L456-L458 HydrophobicContact CB-CG 4.16Å; L456-L458 PolarHBondContact O-N 2.82Å; L456-R463 PolarHBondContact O-NH2 2.95Å
457	P	42.8	Very low	47	Very low	130 Å²	130	98 Å²	98	84%	0.844	51%	0.509	S	S	*	.			trans	-77	75.7	177.4	32.8	-35	0	0	0	110.8
458	L	48.7	Very low	47.5	Very low	57 Å²	57	97.2 Å²	97.2	30%	0.298	51%	0.507	S	S	.	.			trans	-103.2	138.8	177.4	-69.5	162.7	0	0	0	110.1	L456 L462 R463	L456-L458 VanDerWaalsContact C-N 3.27Å; L456-L458 HydrophobicContact CB-CD1 3.96Å; L456-L458 HydrophobicContact CB-CG 4.16Å; L456-L458 PolarHBondContact O-N 2.82Å; L458-L462 HydrophobicContact CB-CB 4.29Å; L458-L462 HydrophobicContact CD2-CB 4.21Å; L458-L462 HydrophobicContact CD2-CD1 4.5Å; L458-R463 HydrophobicContact CB-CB 4.36Å
459	S	62.2	Low	48.1	Very low	58 Å²	58	93.6 Å²	93.6	41%	0.406	50%	0.501	S	S	.	.			trans	-60.5	155.1	173.2	73.1	0	0	0	0	111.1	N461 L462 R463	S459-N461 PolarHBondContact O-N 3.36Å; S459-N461 VanDerWaalsContact O-N 3.14Å; S459-L462 PolarHBondContact O-N 2.87Å; S459-R463 PolarHBondContact O-N 3.32Å
460	P	54.9	Low	48.6	Very low	106 Å²	106	88.2 Å²	88.2	69%	0.688	48%	0.482	S	S	*	.	H	α-helix	trans	-53.6	-39.8	-176.2	-27.7	35.2	0	0	0	113.3	R463 A464	P460-R463 PolarHBondContact O-N 2.73Å; P460-A464 WeakPolarHBondContact O-CB 3.42Å; P460-A464 PolarHBondContact O-N 2.92Å
461	N	48.3	Very low	49.1	Very low	134 Å²	134	88.5 Å²	88.5	72%	0.717	49%	0.485	S	S	*	.	H	α-helix	trans	-68	-40.4	178.8	-63.2	-10	0	0	0	112.2	S459 A465	S459-N461 PolarHBondContact O-N 3.36Å; S459-N461 VanDerWaalsContact O-N 3.14Å; N461-A465 WeakPolarHBondContact O-CB 3.11Å; N461-A465 PolarHBondContact O-N 3.31Å
462	L	47.9	Very low	49.5	Very low	100 Å²	100	85.4 Å²	85.4	52%	0.524	47%	0.474	S	S	.	.	H	α-helix	trans	-67.9	-40.3	174.8	-93.5	160.6	0	0	0	111.9	L458 S459 A465 F466	L458-L462 HydrophobicContact CB-CB 4.29Å; L458-L462 HydrophobicContact CD2-CB 4.21Å; L458-L462 HydrophobicContact CD2-CD1 4.5Å; S459-L462 PolarHBondContact O-N 2.87Å; L462-A465 PolarHBondContact O-N 3.16Å; L462-F466 VanDerWaalsContact O-CB 3.31Å; L462-F466 WeakPolarHBondContact O-CB 3.33Å; L462-F466 PolarHBondContact O-N 3.02Å
463	R	51.5	Low	50.1	Low	100 Å²	100	84.1 Å²	84.1	38%	0.377	47%	0.468	S	S	.	.	H	α-helix	trans	-64.7	-40.6	176.4	-169.9	173.5	-79.9	170.8	-6.9	111.3	R454 L456 L458 S459 P460 Q467	R454-R463 PolarHBondContact O-NH2 3.32Å; L456-R463 PolarHBondContact O-NH2 2.95Å; L458-R463 HydrophobicContact CB-CB 4.36Å; S459-R463 PolarHBondContact O-N 3.32Å; P460-R463 PolarHBondContact O-N 2.73Å; R463-Q467 WeakPolarHBondContact O-CG 3.45Å; R463-Q467 PolarHBondContact O-N 3.02Å; R463-Q467 VanDerWaalsContact O-N 3.08Å
464	A	48.2	Very low	50.5	Low	32 Å²	32	88.1 Å²	88.1	26%	0.264	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-45.9	172.8	0	0	0	0	0	112.6	P460 F466 Q467 I468	P460-A464 WeakPolarHBondContact O-CB 3.42Å; P460-A464 PolarHBondContact O-N 2.92Å; A464-F466 VanDerWaalsContact C-N 3.33Å; A464-F466 PolarHBondContact O-N 2.7Å; A464-Q467 PolarHBondContact O-N 3.02Å; A464-I468 WeakPolarHBondContact O-CB 3.47Å; A464-I468 WeakPolarHBondContact O-CD1 3.33Å; A464-I468 VanDerWaalsContact O-CG1 3.25Å; A464-I468 WeakPolarHBondContact O-CG1 3.22Å; A464-I468 PolarHBondContact O-N 3.05Å
465	A	47.6	Very low	51	Low	49 Å²	49	84.3 Å²	84.3	41%	0.405	47%	0.471	S	S	.	.	H	α-helix	trans	-61.3	-40.7	176.7	0	0	0	0	0	112.3	N461 L462 I468 V469	N461-A465 WeakPolarHBondContact O-CB 3.11Å; N461-A465 PolarHBondContact O-N 3.31Å; L462-A465 PolarHBondContact O-N 3.16Å; A465-I468 PolarHBondContact O-N 3.49Å; A465-V469 WeakPolarHBondContact O-CB 3.25Å; A465-V469 PolarHBondContact O-N 2.82Å
466	F	49.3	Very low	51.3	Low	100 Å²	100	80 Å²	80	44%	0.439	44%	0.441	S	S	.	.	I	π-helix	trans	-65.9	-38.1	177.2	-166.3	-95.4	0	0	0	112.5	L462 A464 G470 L471	L462-F466 VanDerWaalsContact O-CB 3.31Å; L462-F466 WeakPolarHBondContact O-CB 3.33Å; L462-F466 PolarHBondContact O-N 3.02Å; A464-F466 VanDerWaalsContact C-N 3.33Å; A464-F466 PolarHBondContact O-N 2.7Å; F466-G470 CarbonylContact O-C 3.57Å; F466-G470 WeakPolarHBondContact O-CA 3.47Å; F466-G470 PolarHBondContact O-N 3.11Å; F466-L471 PolarHBondContact O-N 3.35Å; F466-L471 VanDerWaalsContact O-N 3.09Å
467	Q	50.2	Low	51.7	Low	113 Å²	113	80.4 Å²	80.4	53%	0.528	44%	0.443	S	S	.	.	I	π-helix	trans	-69.2	-42.5	174.4	-74.8	176.9	-12.5	0	0	112.9	R463 A464	R463-Q467 WeakPolarHBondContact O-CG 3.45Å; R463-Q467 PolarHBondContact O-N 3.02Å; R463-Q467 VanDerWaalsContact O-N 3.08Å; A464-Q467 PolarHBondContact O-N 3.02Å
468	I	51.6	Low	52.4	Low	96 Å²	96	78 Å²	78	49%	0.492	43%	0.426	S	S	.	.	I	π-helix	trans	-76.5	-41.8	-174.9	-64.8	164.9	0	0	0	111.8	A464 A465 P472	A464-I468 WeakPolarHBondContact O-CB 3.47Å; A464-I468 WeakPolarHBondContact O-CD1 3.33Å; A464-I468 VanDerWaalsContact O-CG1 3.25Å; A464-I468 WeakPolarHBondContact O-CG1 3.22Å; A464-I468 PolarHBondContact O-N 3.05Å; A465-I468 PolarHBondContact O-N 3.49Å; I468-P472 WeakPolarHBondContact O-CG 3.5Å
469	V	53.7	Low	52.7	Low	81 Å²	81	77.1 Å²	77.1	49%	0.491	42%	0.421	S	S	.	.	I	π-helix	trans	-112.7	-38.6	-170.8	-175.8	0	0	0	0	111.9	A465 L473	A465-V469 WeakPolarHBondContact O-CB 3.25Å; A465-V469 PolarHBondContact O-N 2.82Å; V469-L473 HydrophobicContact CG1-CD1 3.72Å; V469-L473 HydrophobicContact CG1-CG 4.32Å; V469-L473 WeakPolarHBondContact O-CB 3.45Å; V469-L473 WeakPolarHBondContact O-CG 3.44Å; V469-L473 PolarHBondContact O-N 2.95Å; V469-L473 VanDerWaalsContact O-N 3.09Å
470	G	52.2	Low	52.5	Low	15 Å²	15	75.4 Å²	75.4	16%	0.155	41%	0.408	C	S	.	.	I	π-helix	trans	-66.5	-45.5	-176.9	0	0	0	0	0	113.7	F466 L473 M474	F466-G470 CarbonylContact O-C 3.57Å; F466-G470 WeakPolarHBondContact O-CA 3.47Å; F466-G470 PolarHBondContact O-N 3.11Å; G470-L473 PolarHBondContact O-N 3Å; G470-M474 WeakPolarHBondContact O-CB 3.44Å; G470-M474 VanDerWaalsContact O-CG 3.22Å; G470-M474 WeakPolarHBondContact O-CG 3.47Å; G470-M474 PolarHBondContact O-N 2.96Å
471	L	52.8	Low	52.3	Low	93 Å²	93	72.7 Å²	72.7	49%	0.487	40%	0.395	S	S	.	.	H	α-helix	trans	-61.8	-52	178.5	-77.9	168.7	0	0	0	112.7	F466 L473 M474 E475	F466-L471 PolarHBondContact O-N 3.35Å; F466-L471 VanDerWaalsContact O-N 3.09Å; L471-L473 PolarHBondContact O-N 2.56Å; L471-M474 PolarHBondContact O-N 3.23Å; L471-E475 WeakPolarHBondContact O-CB 3.28Å; L471-E475 PolarHBondContact O-N 3.34Å
472	P	53.8	Low	52.2	Low	45 Å²	45	70.1 Å²	70.1	29%	0.292	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-39.3	174.7	-25.4	35.7	0	0	0	113.4	I468 E475 T476	I468-P472 WeakPolarHBondContact O-CG 3.5Å; P472-E475 PolarHBondContact O-N 2.81Å; P472-T476 WeakPolarHBondContact O-CG2 3.49Å; P472-T476 PolarHBondContact O-N 3.3Å; P472-T476 PolarHBondContact O-OG1 3.25Å
473	L	54.8	Low	52.5	Low	75 Å²	75	70.8 Å²	70.8	39%	0.393	38%	0.381	S	S	.	.	H	α-helix	trans	-65	-46.9	177.7	-81.8	176.4	0	0	0	112	V469 G470 L471 E475 T476 L477	V469-L473 HydrophobicContact CG1-CD1 3.72Å; V469-L473 HydrophobicContact CG1-CG 4.32Å; V469-L473 WeakPolarHBondContact O-CB 3.45Å; V469-L473 WeakPolarHBondContact O-CG 3.44Å; V469-L473 PolarHBondContact O-N 2.95Å; V469-L473 VanDerWaalsContact O-N 3.09Å; G470-L473 PolarHBondContact O-N 3Å; L471-L473 PolarHBondContact O-N 2.56Å; L473-E475 VanDerWaalsContact C-N 3.27Å; L473-E475 PolarHBondContact O-N 3.31Å; L473-T476 WeakPolarHBondContact CA-OG1 3.23Å; L473-T476 PolarHBondContact O-N 3.34Å; L473-T476 VanDerWaalsContact O-N 3.15Å; L473-T476 PolarHBondContact O-OG1 3.04Å; L473-L477 WeakPolarHBondContact O-CB 3.15Å; L473-L477 VanDerWaalsContact O-CG 3.31Å; L473-L477 WeakPolarHBondContact O-CG 3.43Å; L473-L477 PolarHBondContact O-N 3.35Å
474	M	53.8	Low	52.4	Low	117 Å²	117	73.9 Å²	73.9	58%	0.576	39%	0.393	S	S	*	.	H	α-helix	trans	-56.1	-44.3	175.1	-76.1	-74.5	-78.8	0	0	111.1	G470 L471 L477 V478	G470-M474 WeakPolarHBondContact O-CB 3.44Å; G470-M474 VanDerWaalsContact O-CG 3.22Å; G470-M474 WeakPolarHBondContact O-CG 3.47Å; G470-M474 PolarHBondContact O-N 2.96Å; L471-M474 PolarHBondContact O-N 3.23Å; M474-L477 PolarHBondContact O-N 3.29Å; M474-V478 WeakPolarHBondContact O-CB 3.25Å; M474-V478 VanDerWaalsContact O-CG2 3.23Å; M474-V478 WeakPolarHBondContact O-CG2 3.42Å; M474-V478 PolarHBondContact O-N 3.19Å
475	E	53.3	Low	52.8	Low	91 Å²	91	73.9 Å²	73.9	43%	0.425	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-40.1	177.1	-155.2	-168.6	156.2	0	0	112.5	L471 P472 L473 V478 N479 R499	L471-E475 WeakPolarHBondContact O-CB 3.28Å; L471-E475 PolarHBondContact O-N 3.34Å; P472-E475 PolarHBondContact O-N 2.81Å; L473-E475 VanDerWaalsContact C-N 3.27Å; L473-E475 PolarHBondContact O-N 3.31Å; E475-V478 PolarHBondContact O-N 3.26Å; E475-N479 WeakPolarHBondContact O-CB 3.45Å; E475-N479 PolarHBondContact O-N 3.34Å; E475-N479 PolarHBondContact O-ND2 3.4Å; E475-R499 IonicContact OE1-CZ 3.29Å; E475-R499 IonicContact OE1-NH1 2.84Å; E475-R499 IonicContact OE1-NH2 3.53Å; E475-R499 PolarHBondContact OE1-NH2 2.79Å; E475-R499 IonicContact OE2-CZ 2.89Å; E475-R499 IonicContact OE2-NH1 2.83Å; E475-R499 PolarHBondContact OE2-NH1 3.26Å; E475-R499 IonicContact OE2-NH2 3.08Å; E475-R499 PolarHBondContact OE2-NH2 3.22Å; E475-R499 VanDerWaalsContact OE2-NH2 3.09Å
476	T	54.2	Low	53	Low	1 Å²	1	79.8 Å²	79.8	1%	0.006	41%	0.414	C	S	.	.	H	α-helix	trans	-65.3	-40.4	174.6	67.4	0	0	0	0	112.2	P472 L473 N479 V480 M495 L496	P472-T476 WeakPolarHBondContact O-CG2 3.49Å; P472-T476 PolarHBondContact O-N 3.3Å; P472-T476 PolarHBondContact O-OG1 3.25Å; L473-T476 WeakPolarHBondContact CA-OG1 3.23Å; L473-T476 PolarHBondContact O-N 3.34Å; L473-T476 VanDerWaalsContact O-N 3.15Å; L473-T476 PolarHBondContact O-OG1 3.04Å; T476-N479 PolarHBondContact O-N 3.4Å; T476-V480 WeakPolarHBondContact O-CG2 3.45Å; T476-V480 PolarHBondContact O-N 2.92Å; T476-M495 HydrophobicContact CG2-CE 3.42Å; T476-M495 VanDerWaalsContact CG2-CE 3.42Å; T476-M495 HydrophobicContact CG2-SD 4.1Å; T476-L496 HydrophobicContact CG2-CD2 4.06Å
477	L	54.9	Low	53.4	Low	95 Å²	95	81 Å²	81	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-69.6	-38.1	178.6	-72.1	168.3	0	0	0	111.5	L473 M474 V480 A481	L473-L477 WeakPolarHBondContact O-CB 3.15Å; L473-L477 VanDerWaalsContact O-CG 3.31Å; L473-L477 WeakPolarHBondContact O-CG 3.43Å; L473-L477 PolarHBondContact O-N 3.35Å; M474-L477 PolarHBondContact O-N 3.29Å; L477-V480 PolarHBondContact O-N 2.87Å; L477-A481 WeakPolarHBondContact O-CB 3.43Å; L477-A481 PolarHBondContact O-N 3.36Å
478	V	57.5	Low	53.5	Low	79 Å²	79	78.8 Å²	78.8	48%	0.479	42%	0.416	S	S	.	.	H	α-helix	trans	-61	-46.7	169.6	166.3	0	0	0	0	110.3	M474 E475 V480 A481 I482	M474-V478 WeakPolarHBondContact O-CB 3.25Å; M474-V478 VanDerWaalsContact O-CG2 3.23Å; M474-V478 WeakPolarHBondContact O-CG2 3.42Å; M474-V478 PolarHBondContact O-N 3.19Å; E475-V478 PolarHBondContact O-N 3.26Å; V478-V480 PolarHBondContact O-N 3.41Å; V478-A481 WeakPolarHBondContact O-CB 3.42Å; V478-A481 PolarHBondContact O-N 2.85Å; V478-I482 HydrophobicContact CG1-CD1 3.59Å; V478-I482 HydrophobicContact CG1-CG1 4.41Å; V478-I482 WeakPolarHBondContact O-CB 3.34Å; V478-I482 VanDerWaalsContact O-CG1 3.23Å; V478-I482 WeakPolarHBondContact O-CG1 3.49Å; V478-I482 PolarHBondContact O-N 3.15Å
479	N	53.2	Low	53.9	Low	39 Å²	39	81 Å²	81	21%	0.209	43%	0.427	C	S	.	.	H	α-helix	trans	-64.5	-38.7	177.3	-76	-39.4	0	0	0	113.2	E475 T476 I482 Q483 M495	E475-N479 WeakPolarHBondContact O-CB 3.45Å; E475-N479 PolarHBondContact O-N 3.34Å; E475-N479 PolarHBondContact O-ND2 3.4Å; T476-N479 PolarHBondContact O-N 3.4Å; N479-I482 PolarHBondContact O-N 3.4Å; N479-Q483 WeakPolarHBondContact O-CB 3.46Å; N479-Q483 PolarHBondContact O-N 3.09Å; N479-M495 HydrophobicContact CB-CE 4.16Å
480	V	58.4	Low	54.1	Low	22 Å²	22	86.3 Å²	86.3	13%	0.133	44%	0.438	C	S	.	.	H	α-helix	trans	-61	-43.7	171.3	171.3	0	0	0	0	111.3	T476 L477 V478 I482 R484 P488 Y491 I492	T476-V480 WeakPolarHBondContact O-CG2 3.45Å; T476-V480 PolarHBondContact O-N 2.92Å; L477-V480 PolarHBondContact O-N 2.87Å; V478-V480 PolarHBondContact O-N 3.41Å; V480-I482 VanDerWaalsContact C-N 3.34Å; V480-R484 PolarHBondContact O-N 2.91Å; V480-P488 HydrophobicContact CG1-CB 3.91Å; V480-Y491 HydrophobicContact CG2-CD1 3.61Å; V480-Y491 HydrophobicContact CG2-CE1 3.8Å; V480-I492 HydrophobicContact CG2-CD1 3.92Å; V480-I492 HydrophobicContact CG2-CG1 3.39Å
481	A	51.2	Low	54.6	Low	50 Å²	50	87.4 Å²	87.4	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-66	-36	177.9	0	0	0	0	0	112.3	R229 L477 V478	R229-A481 PolarHBondContact NH2-O 2.76Å; L477-A481 WeakPolarHBondContact O-CB 3.43Å; L477-A481 PolarHBondContact O-N 3.36Å; V478-A481 WeakPolarHBondContact O-CB 3.42Å; V478-A481 PolarHBondContact O-N 2.85Å
482	I	46.7	Very low	55	Low	79 Å²	79	85 Å²	85	41%	0.405	43%	0.426	S	S	.	.	H	α-helix	trans	-72	-48.2	177.6	-70.2	165.5	0	0	0	111.6	S254 V478 N479 V480	S254-I482 WeakPolarHBondContact CB-O 3.28Å; S254-I482 PolarHBondContact OG-O 2.99Å; V478-I482 HydrophobicContact CG1-CD1 3.59Å; V478-I482 HydrophobicContact CG1-CG1 4.41Å; V478-I482 WeakPolarHBondContact O-CB 3.34Å; V478-I482 VanDerWaalsContact O-CG1 3.23Å; V478-I482 WeakPolarHBondContact O-CG1 3.49Å; V478-I482 PolarHBondContact O-N 3.15Å; N479-I482 PolarHBondContact O-N 3.4Å; V480-I482 VanDerWaalsContact C-N 3.34Å
483	Q	54.3	Low	55.2	Low	115 Å²	115	85.5 Å²	85.5	54%	0.537	43%	0.433	S	S	.	.	H	α-helix	trans	-92.1	-16	-169.5	-62.7	-167.3	6.1	0	0	114.8	N479 Y491	N479-Q483 WeakPolarHBondContact O-CB 3.46Å; N479-Q483 PolarHBondContact O-N 3.09Å; Q483-Y491 HydrophobicContact CB-CE2 4.45Å; Q483-Y491 VanDerWaalsContact OE1-CE2 3.24Å; Q483-Y491 PolarHBondContact OE1-OH 3.21Å
484	R	49.8	Very low	55.4	Low	165 Å²	165	84.5 Å²	84.5	62%	0.623	43%	0.433	S	S	*	.			trans	42	58.2	178.5	-79.4	-167.7	163.4	-180	-2.9	114.7	R229 V480	R229-R484 VanDerWaalsContact CZ-CZ 3.41Å; R229-R484 VanDerWaalsContact CZ-NE 3.26Å; V480-R484 PolarHBondContact O-N 2.91Å
485	P	55.2	Low	55.6	Low	32 Å²	32	79.9 Å²	79.9	21%	0.208	41%	0.41	C	S	.	.			trans	-60.2	144.5	174	29.9	-40.3	0	0	0	112.4	H487 Y491	P485-H487 PolarHBondContact O-N 3.44Å; P485-H487 VanDerWaalsContact O-N 3.07Å; P485-Y491 VanDerWaalsContact CB-CB 3.5Å; P485-Y491 HydrophobicContact CB-CD2 3.79Å; P485-Y491 HydrophobicContact CB-CG 3.72Å; P485-Y491 VanDerWaalsContact CG-CB 3.42Å; P485-Y491 HydrophobicContact CG-CD1 3.86Å; P485-Y491 HydrophobicContact CG-CD2 3.97Å; P485-Y491 HydrophobicContact CG-CG 3.49Å; P485-Y491 VanDerWaalsContact CG-CG 3.49Å
486	L	52.7	Low	55.6	Low	172 Å²	172	78.9 Å²	78.9	90%	0.901	41%	0.407	S	S	*	.	S	Bend	trans	-54.2	-27.6	176.8	-86.5	158.9	0	0	0	114.2
487	H	57.6	Low	55.5	Low	127 Å²	127	86.4 Å²	86.4	59%	0.588	44%	0.44	S	S	*	.	S	Bend	trans	-131.6	100.4	171.3	-69.2	-70.5	0	0	0	109.3	P485 I489 R490 Y491	P485-H487 PolarHBondContact O-N 3.44Å; P485-H487 VanDerWaalsContact O-N 3.07Å; H487-I489 VanDerWaalsContact C-N 3.31Å; H487-I489 PolarHBondContact O-N 3.04Å; H487-R490 HydrophobicContact CB-CB 3.71Å; H487-R490 PolarHBondContact O-N 2.86Å; H487-R490 VanDerWaalsContact O-N 3.14Å; H487-Y491 PolarHBondContact O-N 2.97Å; H487-Y491 VanDerWaalsContact O-N 3.08Å
488	P	51.7	Low	55.4	Low	65 Å²	65	87.3 Å²	87.3	42%	0.422	44%	0.441	S	S	.	.	H	α-helix	trans	-60.9	-39.5	-177.2	22.9	-32.8	0	0	0	112	V480 R490 Y491 I492	V480-P488 HydrophobicContact CG1-CB 3.91Å; P488-R490 PolarHBondContact O-N 3.09Å; P488-Y491 PolarHBondContact O-N 3.29Å; P488-I492 WeakPolarHBondContact O-CB 3.45Å; P488-I492 WeakPolarHBondContact O-CD1 3.49Å; P488-I492 VanDerWaalsContact O-CG1 3.22Å; P488-I492 WeakPolarHBondContact O-CG1 3.3Å; P488-I492 PolarHBondContact O-N 3.2Å
489	I	60.6	Low	54.7	Low	143 Å²	143	88.8 Å²	88.8	73%	0.733	44%	0.438	S	S	*	.	H	α-helix	trans	-61	-42.8	176.5	-58.9	172	0	0	0	111.3	H487 Y491 A493	H487-I489 VanDerWaalsContact C-N 3.31Å; H487-I489 PolarHBondContact O-N 3.04Å; I489-Y491 VanDerWaalsContact C-N 3.34Å; I489-Y491 PolarHBondContact O-N 3.23Å; I489-A493 VanDerWaalsContact O-CB 3.22Å; I489-A493 WeakPolarHBondContact O-CB 3.44Å; I489-A493 PolarHBondContact O-N 3.09Å
490	R	58.6	Low	54	Low	192 Å²	192	90.2 Å²	90.2	73%	0.725	46%	0.455	S	S	*	.	H	α-helix	trans	-68.8	-33.4	-180	-170.7	175.6	-178.1	159.7	2.2	112.4	H487 P488 S494	H487-R490 HydrophobicContact CB-CB 3.71Å; H487-R490 PolarHBondContact O-N 2.86Å; H487-R490 VanDerWaalsContact O-N 3.14Å; P488-R490 PolarHBondContact O-N 3.09Å; R490-S494 PolarHBondContact O-N 2.98Å
491	Y	61.4	Low	52.9	Low	39 Å²	39	95.9 Å²	95.9	15%	0.153	48%	0.478	C	S	.	.	H	α-helix	trans	-77.4	-39.9	176.7	174.1	-84.1	0	0	0	112.6	V480 Q483 P485 H487 P488 I489 A493 S494 M495	V480-Y491 HydrophobicContact CG2-CD1 3.61Å; V480-Y491 HydrophobicContact CG2-CE1 3.8Å; Q483-Y491 HydrophobicContact CB-CE2 4.45Å; Q483-Y491 VanDerWaalsContact OE1-CE2 3.24Å; Q483-Y491 PolarHBondContact OE1-OH 3.21Å; P485-Y491 VanDerWaalsContact CB-CB 3.5Å; P485-Y491 HydrophobicContact CB-CD2 3.79Å; P485-Y491 HydrophobicContact CB-CG 3.72Å; P485-Y491 VanDerWaalsContact CG-CB 3.42Å; P485-Y491 HydrophobicContact CG-CD1 3.86Å; P485-Y491 HydrophobicContact CG-CD2 3.97Å; P485-Y491 HydrophobicContact CG-CG 3.49Å; P485-Y491 VanDerWaalsContact CG-CG 3.49Å; H487-Y491 PolarHBondContact O-N 2.97Å; H487-Y491 VanDerWaalsContact O-N 3.08Å; P488-Y491 PolarHBondContact O-N 3.29Å; I489-Y491 VanDerWaalsContact C-N 3.34Å; I489-Y491 PolarHBondContact O-N 3.23Å; Y491-A493 VanDerWaalsContact C-N 3.27Å; Y491-A493 PolarHBondContact O-N 3.12Å; Y491-S494 WeakPolarHBondContact CA-OG 3.47Å; Y491-S494 PolarHBondContact O-N 3.25Å; Y491-S494 PolarHBondContact O-OG 3.33Å; Y491-M495 WeakPolarHBondContact O-CB 3.36Å; Y491-M495 PolarHBondContact O-N 3.47Å
492	I	60.6	Low	52.2	Low	43 Å²	43	101.4 Å²	101.4	22%	0.221	50%	0.498	C	S	.	.	H	α-helix	trans	-58.6	-46.5	168.8	-69.3	163.6	0	0	0	108.6	V480 P488 S494 M495 L496	V480-I492 HydrophobicContact CG2-CD1 3.92Å; V480-I492 HydrophobicContact CG2-CG1 3.39Å; P488-I492 WeakPolarHBondContact O-CB 3.45Å; P488-I492 WeakPolarHBondContact O-CD1 3.49Å; P488-I492 VanDerWaalsContact O-CG1 3.22Å; P488-I492 WeakPolarHBondContact O-CG1 3.3Å; P488-I492 PolarHBondContact O-N 3.2Å; I492-S494 PolarHBondContact O-N 3.44Å; I492-M495 PolarHBondContact O-N 2.88Å; I492-L496 HydrophobicContact CG2-CD1 3.61Å; I492-L496 HydrophobicContact CG2-CG 4.13Å; I492-L496 WeakPolarHBondContact O-CB 3.28Å; I492-L496 VanDerWaalsContact O-CG 3.23Å; I492-L496 WeakPolarHBondContact O-CG 3.22Å; I492-L496 PolarHBondContact O-N 2.93Å
493	A	58.3	Low	52.4	Low	55 Å²	55	100.5 Å²	100.5	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175.2	0	0	0	0	0	112.8	I489 Y491 K497	I489-A493 VanDerWaalsContact O-CB 3.22Å; I489-A493 WeakPolarHBondContact O-CB 3.44Å; I489-A493 PolarHBondContact O-N 3.09Å; Y491-A493 VanDerWaalsContact C-N 3.27Å; Y491-A493 PolarHBondContact O-N 3.12Å; A493-K497 WeakPolarHBondContact O-CB 3.15Å; A493-K497 PolarHBondContact O-N 2.79Å
494	S	58.5	Low	52.4	Low	54 Å²	54	100.2 Å²	100.2	38%	0.378	49%	0.494	S	S	.	.	H	α-helix	trans	-69.8	-41.4	177.1	67.3	0	0	0	0	112.4	R490 Y491 I492 K497 E498	R490-S494 PolarHBondContact O-N 2.98Å; Y491-S494 WeakPolarHBondContact CA-OG 3.47Å; Y491-S494 PolarHBondContact O-N 3.25Å; Y491-S494 PolarHBondContact O-OG 3.33Å; I492-S494 PolarHBondContact O-N 3.44Å; S494-K497 CarbonylContact O-C 3.41Å; S494-K497 WeakPolarHBondContact O-CB 3.5Å; S494-K497 PolarHBondContact O-N 2.9Å; S494-E498 WeakPolarHBondContact O-CG 3.23Å; S494-E498 PolarHBondContact O-N 3.37Å
495	M	58	Low	53.1	Low	19 Å²	19	94.7 Å²	94.7	9%	0.094	47%	0.474	C	S	.	.	H	α-helix	trans	-77	-35.2	-177.3	-154.8	-85.8	-95.1	0	0	111.9	T476 N479 Y491 I492 K497 E498 R499	T476-M495 HydrophobicContact CG2-CE 3.42Å; T476-M495 VanDerWaalsContact CG2-CE 3.42Å; T476-M495 HydrophobicContact CG2-SD 4.1Å; N479-M495 HydrophobicContact CB-CE 4.16Å; Y491-M495 WeakPolarHBondContact O-CB 3.36Å; Y491-M495 PolarHBondContact O-N 3.47Å; I492-M495 PolarHBondContact O-N 2.88Å; M495-K497 VanDerWaalsContact C-N 3.34Å; M495-E498 PolarHBondContact O-N 3.2Å; M495-R499 WeakPolarHBondContact O-CG 3.25Å; M495-R499 PolarHBondContact O-N 3.22Å; M495-R499 HydrophobicContact SD-CG 3.98Å; M495-R499 PolarHBondContact SD-NE 2.94Å
496	L	53.5	Low	54	Low	70 Å²	70	98.3 Å²	98.3	37%	0.366	49%	0.491	S	S	.	.	H	α-helix	trans	-64.6	-37.8	165.2	-70.2	176.7	0	0	0	111.4	T476 I492 E498 R499 A500	T476-L496 HydrophobicContact CG2-CD2 4.06Å; I492-L496 HydrophobicContact CG2-CD1 3.61Å; I492-L496 HydrophobicContact CG2-CG 4.13Å; I492-L496 WeakPolarHBondContact O-CB 3.28Å; I492-L496 VanDerWaalsContact O-CG 3.23Å; I492-L496 WeakPolarHBondContact O-CG 3.22Å; I492-L496 PolarHBondContact O-N 2.93Å; L496-E498 VanDerWaalsContact C-N 3.33Å; L496-R499 PolarHBondContact O-N 3.37Å; L496-A500 WeakPolarHBondContact O-CB 3.19Å; L496-A500 PolarHBondContact O-N 2.89Å
497	K	53.3	Low	55.3	Low	159 Å²	159	90.9 Å²	90.9	69%	0.691	45%	0.452	S	S	*	.	H	α-helix	trans	-68	-31.2	174.6	-172.2	175.4	-173.1	-178.8	0	112.3	A493 S494 M495 K501	A493-K497 WeakPolarHBondContact O-CB 3.15Å; A493-K497 PolarHBondContact O-N 2.79Å; S494-K497 CarbonylContact O-C 3.41Å; S494-K497 WeakPolarHBondContact O-CB 3.5Å; S494-K497 PolarHBondContact O-N 2.9Å; M495-K497 VanDerWaalsContact C-N 3.34Å; K497-K501 WeakPolarHBondContact O-CG 3.22Å; K497-K501 PolarHBondContact O-N 2.96Å
498	E	51.6	Low	56.6	Low	114 Å²	114	92 Å²	92	53%	0.533	46%	0.455	S	S	.	.	H	α-helix	trans	-72.8	-43.4	171.7	-77.5	178.8	146.3	0	0	112.5	S494 M495 L496 A500 K501	S494-E498 WeakPolarHBondContact O-CG 3.23Å; S494-E498 PolarHBondContact O-N 3.37Å; M495-E498 PolarHBondContact O-N 3.2Å; L496-E498 VanDerWaalsContact C-N 3.33Å; E498-A500 VanDerWaalsContact C-N 3.29Å; E498-A500 PolarHBondContact O-N 3.12Å; E498-K501 WeakPolarHBondContact O-CB 3.42Å; E498-K501 PolarHBondContact O-N 3.2Å
499	R	42.9	Very low	58.2	Low	110 Å²	110	91.8 Å²	91.8	42%	0.415	47%	0.465	S	S	.	.	H	α-helix	trans	-68.5	-29	173.1	-71.8	-175.1	173.7	-151.9	-8.5	113	E475 M495 L496 K501	E475-R499 IonicContact OE1-CZ 3.29Å; E475-R499 IonicContact OE1-NH1 2.84Å; E475-R499 IonicContact OE1-NH2 3.53Å; E475-R499 PolarHBondContact OE1-NH2 2.79Å; E475-R499 IonicContact OE2-CZ 2.89Å; E475-R499 IonicContact OE2-NH1 2.83Å; E475-R499 PolarHBondContact OE2-NH1 3.26Å; E475-R499 IonicContact OE2-NH2 3.08Å; E475-R499 PolarHBondContact OE2-NH2 3.22Å; E475-R499 VanDerWaalsContact OE2-NH2 3.09Å; M495-R499 WeakPolarHBondContact O-CG 3.25Å; M495-R499 PolarHBondContact O-N 3.22Å; M495-R499 HydrophobicContact SD-CG 3.98Å; M495-R499 PolarHBondContact SD-NE 2.94Å; L496-R499 PolarHBondContact O-N 3.37Å; R499-K501 PolarHBondContact O-N 2.75Å
500	A	38.9	Very low	59.5	Low	69 Å²	69	85.7 Å²	85.7	57%	0.57	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	2.3	169.5	0	0	0	0	0	113.4	L496 E498 M502	L496-A500 WeakPolarHBondContact O-CB 3.19Å; L496-A500 PolarHBondContact O-N 2.89Å; E498-A500 VanDerWaalsContact C-N 3.29Å; E498-A500 PolarHBondContact O-N 3.12Å; A500-M502 PolarHBondContact O-N 2.82Å
501	K	36.6	Very low	61.1	Low	141 Å²	141	78.8 Å²	78.8	61%	0.613	41%	0.412	S	S	*	.			trans	-72.9	46.3	162.2	-62.5	175.7	-178.1	171.3	0	111.5	K497 E498 R499 V503	K497-K501 WeakPolarHBondContact O-CG 3.22Å; K497-K501 PolarHBondContact O-N 2.96Å; E498-K501 WeakPolarHBondContact O-CB 3.42Å; E498-K501 PolarHBondContact O-N 3.2Å; R499-K501 PolarHBondContact O-N 2.75Å; K501-V503 PolarHBondContact O-N 2.8Å
502	M	35.9	Very low	62.6	Low	167 Å²	167	80.9 Å²	80.9	82%	0.823	43%	0.429	S	S	*	.	S	Bend	trans	-68.2	75.3	142.3	-81.1	-170.3	167.4	0	0	107.3	A500 H504	A500-M502 PolarHBondContact O-N 2.82Å; M502-H504 VanDerWaalsContact C-N 3.3Å; M502-H504 PolarHBondContact O-N 2.72Å
503	V	50	Low	64.2	Low	60 Å²	60	79.1 Å²	79.1	36%	0.364	42%	0.42	S	S	.	.	S	Bend	trans	30.3	49.6	161.4	-158.5	0	0	0	0	116.8	K501 Y505	K501-V503 PolarHBondContact O-N 2.8Å; V503-Y505 HydrophobicContact CG1-CD2 3.98Å; V503-Y505 HydrophobicContact CG1-CE1 4.18Å; V503-Y505 HydrophobicContact CG1-CE2 3.23Å; V503-Y505 WeakPolarHBondContact CG1-OH 3.35Å
504	H	54.7	Low	65.9	Low	109 Å²	109	77.4 Å²	77.4	51%	0.505	41%	0.405	S	S	.	.			trans	-93.7	98.9	163.7	-161.9	69.9	0	0	0	109.7	M502 N506	M502-H504 VanDerWaalsContact C-N 3.3Å; M502-H504 PolarHBondContact O-N 2.72Å; H504-N506 PolarHBondContact O-N 3.2Å
505	Y	65.4	Low	67.6	Low	48 Å²	48	76.7 Å²	76.7	19%	0.188	40%	0.4	C	S	.	.			trans	-69.7	112.7	178.2	-62.9	-77.2	0	0	0	110.4	V503 F507 I576 H577 Y580	V503-Y505 HydrophobicContact CG1-CD2 3.98Å; V503-Y505 HydrophobicContact CG1-CE1 4.18Å; V503-Y505 HydrophobicContact CG1-CE2 3.23Å; V503-Y505 WeakPolarHBondContact CG1-OH 3.35Å; Y505-F507 HydrophobicContact CD1-CZ 4.48Å; Y505-F507 HydrophobicContact CG-CZ 4.24Å; Y505-I576 HydrophobicContact CE1-CG2 3.91Å; Y505-H577 HydrophobicContact CE2-CB 4.09Å; Y505-H577 WeakPolarHBondContact OH-CB 3.09Å; Y505-H577 PolarHBondContact OH-N 2.83Å; Y505-Y580 AromaticContact CD2-CD2 3.48Å; Y505-Y580 HydrophobicContact CD2-CD2 3.48Å; Y505-Y580 VanDerWaalsContact CD2-CD2 3.48Å; Y505-Y580 AromaticContact CD2-CE2 3.25Å; Y505-Y580 HydrophobicContact CD2-CE2 3.25Å; Y505-Y580 HydrophobicContact CD2-CG 4.46Å; Y505-Y580 AromaticContact CE2-CD2 3.58Å; Y505-Y580 HydrophobicContact CE2-CD2 3.58Å; Y505-Y580 AromaticContact CE2-CE2 3.75Å; Y505-Y580 HydrophobicContact CE2-CE2 3.75Å; Y505-Y580 HydrophobicContact CG-CD2 4.2Å; Y505-Y580 HydrophobicContact CG-CE2 4.05Å
506	N	72.5	Confident	69.3	Low	108 Å²	108	76.4 Å²	76.4	58%	0.578	40%	0.4	S	S	*	.			trans	-117.4	93.3	176.5	-176	-5.5	0	0	0	110.6	H504 K508	H504-N506 PolarHBondContact O-N 3.2Å; N506-K508 PolarHBondContact O-N 3.05Å; N506-K508 WeakPolarHBondContact OD1-CB 3.26Å; N506-K508 PolarHBondContact OD1-N 3.09Å; N506-K508 VanDerWaalsContact OD1-N 3.15Å
507	F	81.8	Confident	71.2	Confident	16 Å²	16	79.9 Å²	79.9	7%	0.07	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-74.4	-8.8	-178.6	-53.2	-62.9	0	0	0	114.3	Y505 G509 P571 Y580 M584 L659	Y505-F507 HydrophobicContact CD1-CZ 4.48Å; Y505-F507 HydrophobicContact CG-CZ 4.24Å; F507-G509 PolarHBondContact O-N 3.49Å; F507-G509 VanDerWaalsContact O-N 3.16Å; F507-P571 HydrophobicContact CD1-CG 4.43Å; F507-P571 HydrophobicContact CE1-CG 4.22Å; F507-Y580 AromaticContact CE2-CD1 3.9Å; F507-Y580 HydrophobicContact CE2-CD1 3.9Å; F507-Y580 AromaticContact CE2-CE1 3.59Å; F507-Y580 HydrophobicContact CE2-CE1 3.59Å; F507-Y580 AromaticContact CZ-CD1 3.79Å; F507-Y580 HydrophobicContact CZ-CD1 3.79Å; F507-Y580 AromaticContact CZ-CE1 3.9Å; F507-Y580 HydrophobicContact CZ-CE1 3.9Å; F507-Y580 HydrophobicContact CZ-CG 4.35Å; F507-M584 HydrophobicContact CD1-CE 4.35Å; F507-M584 HydrophobicContact CE1-CE 3.52Å; F507-M584 HydrophobicContact CE2-CE 4.41Å; F507-M584 HydrophobicContact CZ-CE 3.55Å; F507-L659 HydrophobicContact CB-CB 4.14Å; F507-L659 WeakPolarHBondContact CB-O 3.49Å; F507-L659 HydrophobicContact CG-CD2 4.46Å
508	K	84.7	Confident	73.1	Confident	151 Å²	151	77.1 Å²	77.1	66%	0.657	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-70.5	-6.7	177.9	-59	-176.8	177	179.1	0	113.3	N506 S660	N506-K508 PolarHBondContact O-N 3.05Å; N506-K508 WeakPolarHBondContact OD1-CB 3.26Å; N506-K508 PolarHBondContact OD1-N 3.09Å; N506-K508 VanDerWaalsContact OD1-N 3.15Å; K508-S660 WeakPolarHBondContact CE-O 3.29Å
509	G	84.3	Confident	75.1	Confident	61 Å²	61	71.8 Å²	71.8	63%	0.629	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-83	-8.1	-179.3	0	0	0	0	0	116.4	F507	F507-G509 PolarHBondContact O-N 3.49Å; F507-G509 VanDerWaalsContact O-N 3.16Å
510	I	89.1	Confident	77.6	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.072	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-78.2	129.5	-174.1	-52.1	172.6	0	0	0	110.6	E569 F570 R656 L659	I510-E569 HydrophobicContact CG2-CB 4.08Å; I510-F570 HydrophobicContact CG2-CD2 4.01Å; I510-F570 HydrophobicContact CG2-CE2 3.76Å; I510-F570 HydrophobicContact CG2-CZ 4.26Å; I510-R656 HydrophobicContact CB-CG 3.88Å; I510-R656 HydrophobicContact CG2-CG 3.67Å; I510-L659 HydrophobicContact CD1-CD1 4.07Å
511	T	90.8	Very high	80.2	Confident	47 Å²	47	72.2 Å²	72.2	29%	0.288	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-74.8	149.4	-178.4	68.1	0	0	0	0	112.8	V513 R562 L565 E569 R656	T511-V513 PolarHBondContact O-N 3.13Å; T511-R562 PolarHBondContact OG1-NH1 3.49Å; T511-L565 VanDerWaalsContact OG1-CD2 3.28Å; T511-L565 WeakPolarHBondContact OG1-CD2 3.5Å; T511-E569 WeakPolarHBondContact CA-OE2 3.23Å; T511-E569 VanDerWaalsContact CB-OE2 3.25Å; T511-E569 WeakPolarHBondContact CB-OE2 3.48Å; T511-E569 VanDerWaalsContact CG2-OE1 3.27Å; T511-E569 WeakPolarHBondContact CG2-OE1 3.4Å; T511-E569 WeakPolarHBondContact CG2-OE2 3.46Å; T511-E569 PolarHBondContact N-OE2 3.45Å; T511-E569 PolarHBondContact OG1-OE2 2.77Å; T511-R656 WeakPolarHBondContact O-CD 3.37Å
512	V	93.9	Very high	83	Confident	84 Å²	84	69.4 Å²	69.4	51%	0.509	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-55.7	124.8	178.7	-176.5	0	0	0	0	111.3	P514 R562	V512-P514 VanDerWaalsContact O-CD 3.26Å; V512-P514 WeakPolarHBondContact O-CD 3.44Å; V512-R562 PolarHBondContact O-NH2 3.08Å
513	V	93.8	Very high	85.9	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.03	32%	0.322	C	S	.	.			trans	-86.4	108.3	177.8	178.4	0	0	0	0	108.4	T511 I566 F570 L649 E653	T511-V513 PolarHBondContact O-N 3.13Å; V513-I566 HydrophobicContact CG1-CD1 4.28Å; V513-I566 HydrophobicContact CG2-CG1 4.43Å; V513-I566 HydrophobicContact CG2-CG2 4.49Å; V513-F570 HydrophobicContact CG2-CE2 3.77Å; V513-F570 HydrophobicContact CG2-CZ 4.11Å; V513-L649 HydrophobicContact CG1-CB 4.41Å; V513-L649 HydrophobicContact CG1-CD2 3.61Å; V513-E653 HydrophobicContact CB-CB 4.07Å; V513-E653 PolarHBondContact N-OE2 2.96Å
514	P	93.6	Very high	88.1	Confident	19 Å²	19	61.8 Å²	61.8	12%	0.123	32%	0.321	C	S	.	.			trans	-75.7	150.9	-177.6	-10.6	29	0	0	0	110.7	V512 Q518 L519 I522	V512-P514 VanDerWaalsContact O-CD 3.26Å; V512-P514 WeakPolarHBondContact O-CD 3.44Å; P514-Q518 HydrophobicContact CB-CB 4.07Å; P514-L519 HydrophobicContact CB-CD2 3.97Å; P514-L519 HydrophobicContact CB-CG 4.1Å; P514-L519 HydrophobicContact CG-CD2 3.76Å; P514-L519 HydrophobicContact CG-CG 4.4Å; P514-I522 HydrophobicContact CB-CD1 4.5Å
515	S	94.2	Very high	90	Very high	40 Å²	40	58.7 Å²	58.7	28%	0.28	31%	0.311	S	S	.	.			trans	-60.5	156.1	175.9	63.9	0	0	0	0	112.3	K517 Q518 L519	S515-K517 PolarHBondContact O-N 2.82Å; S515-K517 VanDerWaalsContact O-N 3.15Å; S515-Q518 PolarHBondContact O-N 3.02Å; S515-Q518 VanDerWaalsContact OG-CG 3.3Å; S515-Q518 WeakPolarHBondContact OG-CG 3.31Å; S515-Q518 PolarHBondContact OG-N 3Å; S515-Q518 PolarHBondContact OG-OE1 2.87Å; S515-L519 PolarHBondContact O-N 3.31Å
516	S	93.7	Very high	91.5	Very high	13 Å²	13	59.2 Å²	59.2	9%	0.091	32%	0.315	C	S	.	.	H	α-helix	trans	-56.4	-33.4	-179.1	63.3	0	0	0	0	113.6	K520 L642	S516-K520 WeakPolarHBondContact O-CB 3.2Å; S516-K520 PolarHBondContact O-N 3.38Å; S516-K520 VanDerWaalsContact O-N 3.11Å; S516-L642 WeakPolarHBondContact CB-O 3.29Å
517	K	93.2	Very high	92.6	Very high	143 Å²	143	54.4 Å²	54.4	62%	0.622	29%	0.289	S	S	*	.	H	α-helix	trans	-66.1	-50	173.2	-175.9	-179.2	174.6	-173.2	0	111.7	S515 L519 K520 E521	S515-K517 PolarHBondContact O-N 2.82Å; S515-K517 VanDerWaalsContact O-N 3.15Å; K517-L519 PolarHBondContact O-N 3.35Å; K517-K520 WeakPolarHBondContact O-CB 3.26Å; K517-K520 PolarHBondContact O-N 3.2Å; K517-E521 WeakPolarHBondContact CE-OE1 3.42Å; K517-E521 WeakPolarHBondContact CG-OE1 3.27Å; K517-E521 PolarHBondContact O-N 3.13Å; K517-E521 VanDerWaalsContact O-N 3.11Å
518	Q	94.3	Very high	93.3	Very high	100 Å²	100	60.1 Å²	60.1	47%	0.467	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-43.9	177.2	-72	163.3	-23.7	0	0	111.4	P514 S515 K520 E521 I522	P514-Q518 HydrophobicContact CB-CB 4.07Å; S515-Q518 PolarHBondContact O-N 3.02Å; S515-Q518 VanDerWaalsContact OG-CG 3.3Å; S515-Q518 WeakPolarHBondContact OG-CG 3.31Å; S515-Q518 PolarHBondContact OG-N 3Å; S515-Q518 PolarHBondContact OG-OE1 2.87Å; Q518-K520 PolarHBondContact O-N 3.14Å; Q518-E521 PolarHBondContact O-N 2.93Å; Q518-I522 WeakPolarHBondContact O-CB 3.35Å; Q518-I522 WeakPolarHBondContact O-CD1 3.21Å; Q518-I522 WeakPolarHBondContact O-CG1 3.34Å; Q518-I522 PolarHBondContact O-N 3.2Å
519	L	93.7	Very high	93.8	Very high	2 Å²	2	62 Å²	62	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-57.2	-46.9	175.5	-75.8	-176.5	0	0	0	112	P514 S515 K517 E521 I522 F523 R562 L649	P514-L519 HydrophobicContact CB-CD2 3.97Å; P514-L519 HydrophobicContact CB-CG 4.1Å; P514-L519 HydrophobicContact CG-CD2 3.76Å; P514-L519 HydrophobicContact CG-CG 4.4Å; S515-L519 PolarHBondContact O-N 3.31Å; K517-L519 PolarHBondContact O-N 3.35Å; L519-E521 VanDerWaalsContact C-N 3.34Å; L519-E521 PolarHBondContact O-N 3.15Å; L519-I522 PolarHBondContact O-N 3.11Å; L519-F523 HydrophobicContact CB-CD2 4.28Å; L519-F523 HydrophobicContact CB-CE2 3.85Å; L519-F523 HydrophobicContact CD2-CE2 4Å; L519-F523 HydrophobicContact CD2-CZ 4.01Å; L519-F523 HydrophobicContact CG-CE2 4.36Å; L519-F523 WeakPolarHBondContact O-CD2 3.2Å; L519-F523 WeakPolarHBondContact O-CG 3.3Å; L519-F523 PolarHBondContact O-N 3.29Å; L519-R562 HydrophobicContact CD2-CG 4.32Å; L519-L649 HydrophobicContact CD1-CD1 3.57Å; L519-L649 HydrophobicContact CD1-CD2 4.3Å
520	K	93.8	Very high	94.4	Very high	85 Å²	85	65.8 Å²	65.8	37%	0.37	32%	0.318	S	S	.	.	H	α-helix	trans	-55.5	-48.1	175.9	173.4	-172.8	172.6	-167.6	0	111.6	S516 K517 Q518 L524 C639 T643	S516-K520 WeakPolarHBondContact O-CB 3.2Å; S516-K520 PolarHBondContact O-N 3.38Å; S516-K520 VanDerWaalsContact O-N 3.11Å; K517-K520 WeakPolarHBondContact O-CB 3.26Å; K517-K520 PolarHBondContact O-N 3.2Å; Q518-K520 PolarHBondContact O-N 3.14Å; K520-L524 HydrophobicContact CG-CD1 3.98Å; K520-L524 WeakPolarHBondContact O-CB 3.48Å; K520-L524 VanDerWaalsContact O-CG 3.31Å; K520-L524 WeakPolarHBondContact O-CG 3.35Å; K520-L524 PolarHBondContact O-N 3.06Å; K520-L524 VanDerWaalsContact O-N 3.09Å; K520-C639 HydrophobicContact CG-CB 4.5Å; K520-T643 HydrophobicContact CD-CG2 4.43Å
521	E	94.7	Very high	94.7	Very high	104 Å²	104	65.3 Å²	65.3	49%	0.486	32%	0.316	S	S	.	.	H	α-helix	trans	-64.4	-45.8	179.4	-71.1	165.6	-166.6	0	0	111.7	K517 Q518 L519 F523 S525	K517-E521 WeakPolarHBondContact CE-OE1 3.42Å; K517-E521 WeakPolarHBondContact CG-OE1 3.27Å; K517-E521 PolarHBondContact O-N 3.13Å; K517-E521 VanDerWaalsContact O-N 3.11Å; Q518-E521 PolarHBondContact O-N 2.93Å; L519-E521 VanDerWaalsContact C-N 3.34Å; L519-E521 PolarHBondContact O-N 3.15Å; E521-F523 PolarHBondContact O-N 3.07Å; E521-S525 WeakPolarHBondContact O-CB 3.4Å; E521-S525 PolarHBondContact O-N 3.01Å
522	I	95.1	Very high	95	Very high	81 Å²	81	66.1 Å²	66.1	42%	0.415	32%	0.322	S	S	.	.	H	α-helix	trans	-56.8	-50.2	176	-70.4	163.3	0	0	0	111	P514 Q518 L519 K526	P514-I522 HydrophobicContact CB-CD1 4.5Å; Q518-I522 WeakPolarHBondContact O-CB 3.35Å; Q518-I522 WeakPolarHBondContact O-CD1 3.21Å; Q518-I522 WeakPolarHBondContact O-CG1 3.34Å; Q518-I522 PolarHBondContact O-N 3.2Å; L519-I522 PolarHBondContact O-N 3.11Å; I522-K526 WeakPolarHBondContact O-CB 3.36Å; I522-K526 PolarHBondContact O-N 2.85Å
523	F	96.3	Very high	95.1	Very high	4 Å²	4	66.5 Å²	66.5	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-71	-39.3	-175.9	-63.1	-49.6	0	0	0	113.4	L519 E521 T527 S558 I559 R562 L642	L519-F523 HydrophobicContact CB-CD2 4.28Å; L519-F523 HydrophobicContact CB-CE2 3.85Å; L519-F523 HydrophobicContact CD2-CE2 4Å; L519-F523 HydrophobicContact CD2-CZ 4.01Å; L519-F523 HydrophobicContact CG-CE2 4.36Å; L519-F523 WeakPolarHBondContact O-CD2 3.2Å; L519-F523 WeakPolarHBondContact O-CG 3.3Å; L519-F523 PolarHBondContact O-N 3.29Å; E521-F523 PolarHBondContact O-N 3.07Å; F523-T527 VanDerWaalsContact O-CB 3.3Å; F523-T527 WeakPolarHBondContact O-CB 3.18Å; F523-T527 PolarHBondContact O-N 3.35Å; F523-T527 PolarHBondContact O-OG1 2.82Å; F523-S558 WeakPolarHBondContact CE1-O 3.24Å; F523-I559 HydrophobicContact CB-CG1 4.45Å; F523-I559 HydrophobicContact CD1-CG1 4.16Å; F523-I559 HydrophobicContact CD2-CD1 4.39Å; F523-I559 HydrophobicContact CD2-CG1 3.61Å; F523-I559 HydrophobicContact CE1-CG1 4.32Å; F523-I559 HydrophobicContact CE2-CB 4.48Å; F523-I559 HydrophobicContact CE2-CG1 3.76Å; F523-I559 HydrophobicContact CG-CG1 3.83Å; F523-I559 HydrophobicContact CZ-CG1 4.13Å; F523-R562 HydrophobicContact CE1-CB 4.04Å; F523-R562 HydrophobicContact CZ-CB 3.78Å; F523-R562 HydrophobicContact CZ-CG 4.04Å; F523-L642 HydrophobicContact CD2-CD1 3.56Å; F523-L642 HydrophobicContact CE2-CD1 3.85Å; F523-L642 HydrophobicContact CE2-CD2 4.37Å
524	L	95.5	Very high	95.1	Very high	64 Å²	64	71 Å²	71	34%	0.335	35%	0.352	S	S	.	.	H	α-helix	trans	-65	-46.7	175	-70.1	173.4	0	0	0	110.7	K520 T527 Q528 M555	K520-L524 HydrophobicContact CG-CD1 3.98Å; K520-L524 WeakPolarHBondContact O-CB 3.48Å; K520-L524 VanDerWaalsContact O-CG 3.31Å; K520-L524 WeakPolarHBondContact O-CG 3.35Å; K520-L524 PolarHBondContact O-N 3.06Å; K520-L524 VanDerWaalsContact O-N 3.09Å; L524-T527 PolarHBondContact O-N 3.07Å; L524-Q528 WeakPolarHBondContact O-CB 3.26Å; L524-Q528 PolarHBondContact O-N 3.08Å; L524-M555 HydrophobicContact CD2-CE 4.32Å; L524-M555 HydrophobicContact CD2-SD 4.02Å
525	S	96.3	Very high	95.1	Very high	43 Å²	43	71.5 Å²	71.5	30%	0.301	35%	0.353	S	S	.	.	H	α-helix	trans	-60.5	-45.9	176	178.2	0	0	0	0	112.5	E521 T527 Q528 R529	E521-S525 WeakPolarHBondContact O-CB 3.4Å; E521-S525 PolarHBondContact O-N 3.01Å; S525-T527 VanDerWaalsContact C-N 3.33Å; S525-T527 PolarHBondContact O-N 3.24Å; S525-Q528 PolarHBondContact O-N 3.42Å; S525-R529 WeakPolarHBondContact O-CB 3.47Å; S525-R529 WeakPolarHBondContact O-CG 3.29Å; S525-R529 PolarHBondContact O-N 3.14Å; S525-R529 PolarHBondContact O-NE 3.48Å; S525-R529 VanDerWaalsContact OG-CZ 3.31Å; S525-R529 PolarHBondContact OG-NE 2.99Å; S525-R529 PolarHBondContact OG-NH2 2.92Å
526	K	96	Very high	95.1	Very high	60 Å²	60	73.6 Å²	73.6	26%	0.261	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-40.7	176.7	-169.8	-174.9	-179.7	-163.6	0	111	I522 K530 F554 S558	I522-K526 WeakPolarHBondContact O-CB 3.36Å; I522-K526 PolarHBondContact O-N 2.85Å; K526-K530 HydrophobicContact CG-CD 4.14Å; K526-K530 VanDerWaalsContact O-CB 3.3Å; K526-K530 WeakPolarHBondContact O-CB 3.25Å; K526-K530 PolarHBondContact O-N 3.19Å; K526-F554 HydrophobicContact CG-CE1 4.1Å; K526-F554 HydrophobicContact CG-CZ 4.32Å; K526-S558 WeakPolarHBondContact CE-OG 3.27Å; K526-S558 PolarHBondContact NZ-OG 3.25Å; K526-S558 VanDerWaalsContact NZ-OG 3.09Å
527	T	96.7	Very high	95	Very high	6 Å²	6	83.5 Å²	83.5	4%	0.037	39%	0.394	C	S	.	.	H	α-helix	trans	-68.4	-42.2	177.9	-57.4	0	0	0	0	111.9	F523 L524 S525 T531 F554 M555	F523-T527 VanDerWaalsContact O-CB 3.3Å; F523-T527 WeakPolarHBondContact O-CB 3.18Å; F523-T527 PolarHBondContact O-N 3.35Å; F523-T527 PolarHBondContact O-OG1 2.82Å; L524-T527 PolarHBondContact O-N 3.07Å; S525-T527 VanDerWaalsContact C-N 3.33Å; S525-T527 PolarHBondContact O-N 3.24Å; T527-T531 PolarHBondContact O-N 3.45Å; T527-T531 PolarHBondContact O-OG1 3.28Å; T527-F554 HydrophobicContact CG2-CD1 4.16Å; T527-M555 HydrophobicContact CG2-CB 4.34Å
528	Q	95.6	Very high	95	Very high	137 Å²	137	83.5 Å²	83.5	64%	0.64	40%	0.396	S	S	*	.	H	α-helix	trans	-64.4	-45.5	176.8	-178.6	171.2	-9.9	0	0	111.9	L524 S525	L524-Q528 WeakPolarHBondContact O-CB 3.26Å; L524-Q528 PolarHBondContact O-N 3.08Å; S525-Q528 PolarHBondContact O-N 3.42Å
529	R	96.2	Very high	95.1	Very high	191 Å²	191	81.7 Å²	81.7	72%	0.721	39%	0.385	S	S	*	.	H	α-helix	trans	-72.9	-39.9	-178	-70.5	-176.3	-75.8	163.2	-7	113.9	S525	S525-R529 WeakPolarHBondContact O-CB 3.47Å; S525-R529 WeakPolarHBondContact O-CG 3.29Å; S525-R529 PolarHBondContact O-N 3.14Å; S525-R529 PolarHBondContact O-NE 3.48Å; S525-R529 VanDerWaalsContact OG-CZ 3.31Å; S525-R529 PolarHBondContact OG-NE 2.99Å; S525-R529 PolarHBondContact OG-NH2 2.92Å
530	K	96.2	Very high	95.2	Very high	139 Å²	139	85.1 Å²	85.1	60%	0.604	41%	0.414	S	S	*	.	H	α-helix	trans	-93	-2	-172.7	-65.4	-168.6	168.8	-162.8	0	115.4	K526 F554	K526-K530 HydrophobicContact CG-CD 4.14Å; K526-K530 VanDerWaalsContact O-CB 3.3Å; K526-K530 WeakPolarHBondContact O-CB 3.25Å; K526-K530 PolarHBondContact O-N 3.19Å; K530-F554 HydrophobicContact CB-CE1 4.02Å; K530-F554 HydrophobicContact CB-CE2 4.08Å; K530-F554 HydrophobicContact CB-CZ 3.53Å; K530-F554 HydrophobicContact CD-CZ 3.79Å; K530-F554 HydrophobicContact CG-CZ 4.21Å
531	T	95.3	Very high	95.2	Very high	5 Å²	5	83.8 Å²	83.8	3%	0.031	41%	0.41	C	S	.	.	S	Bend	trans	-125.9	142.3	177.9	67.8	0	0	0	0	111.3	T527 T533 K551 F554	T527-T531 PolarHBondContact O-N 3.45Å; T527-T531 PolarHBondContact O-OG1 3.28Å; T531-T533 PolarHBondContact O-N 3.39Å; T531-K551 PolarHBondContact O-NZ 3.47Å; T531-K551 PolarHBondContact OG1-NZ 3.01Å; T531-F554 HydrophobicContact CG2-CB 3.73Å; T531-F554 HydrophobicContact CG2-CD1 3.81Å; T531-F554 HydrophobicContact CG2-CD2 3.95Å; T531-F554 HydrophobicContact CG2-CE1 4.5Å; T531-F554 HydrophobicContact CG2-CG 3.51Å
532	P	96.6	Very high	95.2	Very high	63 Å²	63	82.9 Å²	82.9	41%	0.409	42%	0.415	S	S	.	.			trans	-54.9	141.5	-175.6	23.2	-35	0	0	0	111.7	F547 K551	P532-F547 HydrophobicContact CB-CE2 4.16Å; P532-F547 HydrophobicContact CG-CD2 4.27Å; P532-F547 HydrophobicContact CG-CE2 4.21Å; P532-F547 WeakPolarHBondContact O-CE2 3.29Å; P532-F547 WeakPolarHBondContact O-CZ 3.28Å; P532-K551 WeakPolarHBondContact O-CE 3.39Å; P532-K551 PolarHBondContact O-NZ 2.84Å
533	T	95.3	Very high	95.3	Very high	93 Å²	93	85.4 Å²	85.4	57%	0.571	42%	0.42	S	S	*	.			trans	-103.9	-34	-169.5	47.2	0	0	0	0	113.9	T531 F547	T531-T533 PolarHBondContact O-N 3.39Å; T533-F547 WeakPolarHBondContact O-CZ 3.32Å
534	V	95.2	Very high	95.3	Very high	100 Å²	100	85.5 Å²	85.5	61%	0.606	42%	0.42	S	S	*	.			trans	-88.1	133.6	-174.8	-175.6	0	0	0	0	111.6	H536 F547	V534-H536 WeakPolarHBondContact CG1-NE2 3.38Å; V534-F547 WeakPolarHBondContact O-CE2 3.45Å
535	I	92.6	Very high	95.4	Very high	28 Å²	28	86.2 Å²	86.2	14%	0.144	42%	0.418	C	S	.	.			trans	-153	140	170	-172.8	151.9	0	0	0	110.6	Y539 I544 F547 L624	I535-Y539 HydrophobicContact CD1-CD2 4.41Å; I535-Y539 HydrophobicContact CG1-CD2 3.86Å; I535-Y539 HydrophobicContact CG1-CE2 4.43Å; I535-I544 HydrophobicContact CD1-CB 4.24Å; I535-I544 HydrophobicContact CD1-CG1 3.8Å; I535-I544 HydrophobicContact CG1-CG1 4.32Å; I535-F547 HydrophobicContact CB-CD1 4.26Å; I535-F547 HydrophobicContact CB-CD2 4.27Å; I535-F547 HydrophobicContact CB-CE1 4.15Å; I535-F547 HydrophobicContact CB-CE2 4.12Å; I535-F547 HydrophobicContact CB-CG 4.34Å; I535-F547 HydrophobicContact CB-CZ 4.07Å; I535-F547 HydrophobicContact CD1-CB 3.59Å; I535-F547 HydrophobicContact CD1-CD1 3.89Å; I535-F547 HydrophobicContact CD1-CD2 4.09Å; I535-F547 HydrophobicContact CD1-CG 3.61Å; I535-F547 HydrophobicContact CG2-CD1 3.94Å; I535-F547 HydrophobicContact CG2-CE1 3.59Å; I535-F547 HydrophobicContact CG2-CE2 4.41Å; I535-F547 HydrophobicContact CG2-CZ 3.85Å; I535-L624 HydrophobicContact CG1-CD1 4.17Å; I535-L624 HydrophobicContact CG2-CD1 4.04Å
536	H	94.3	Very high	95.3	Very high	84 Å²	84	90.6 Å²	90.6	39%	0.389	43%	0.434	S	S	.	.			trans	-109.1	155.9	-177.8	-58.6	-92.6	0	0	0	112.2	V534 H538 Y539	V534-H536 WeakPolarHBondContact CG1-NE2 3.38Å; H536-H538 VanDerWaalsContact C-N 3.29Å; H536-H538 VanDerWaalsContact CB-CE1 3.41Å; H536-H538 WeakPolarHBondContact CB-CE1 3.34Å; H536-H538 AromaticContact CG-CE1 3.92Å; H536-H538 PolarHBondContact O-N 3.28Å; H536-Y539 HydrophobicContact CB-CD1 4.27Å; H536-Y539 HydrophobicContact CB-CE1 4.16Å; H536-Y539 AromaticContact CD2-CZ 3.64Å; H536-Y539 PolarHBondContact CD2-OH 3.46Å; H536-Y539 PolarHBondContact O-N 2.85Å
537	R	92.7	Very high	95.4	Very high	221 Å²	221	88.8 Å²	88.8	83%	0.834	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.6	-176.5	66.7	173.1	75.3	178.3	4	114.7	L624	R537-L624 HydrophobicContact CB-CD2 4.17Å
538	H	93.2	Very high	95.4	Very high	144 Å²	144	89.2 Å²	89.2	67%	0.667	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	1.9	-176.3	61.4	-101.8	0	0	0	113.8	H536	H536-H538 VanDerWaalsContact C-N 3.29Å; H536-H538 VanDerWaalsContact CB-CE1 3.41Å; H536-H538 WeakPolarHBondContact CB-CE1 3.34Å; H536-H538 AromaticContact CG-CE1 3.92Å; H536-H538 PolarHBondContact O-N 3.28Å
539	Y	95.4	Very high	95.4	Very high	61 Å²	61	83.9 Å²	83.9	24%	0.239	41%	0.405	C	S	.	.	S	Bend	trans	-73.4	145.2	176.5	-74	-0.1	0	0	0	111.2	I535 H536 I541 R543 I544	I535-Y539 HydrophobicContact CD1-CD2 4.41Å; I535-Y539 HydrophobicContact CG1-CD2 3.86Å; I535-Y539 HydrophobicContact CG1-CE2 4.43Å; H536-Y539 HydrophobicContact CB-CD1 4.27Å; H536-Y539 HydrophobicContact CB-CE1 4.16Å; H536-Y539 AromaticContact CD2-CZ 3.64Å; H536-Y539 PolarHBondContact CD2-OH 3.46Å; H536-Y539 PolarHBondContact O-N 2.85Å; Y539-I541 PolarHBondContact O-N 3.38Å; Y539-R543 HydrophobicContact CD2-CG 4.37Å; Y539-I544 VanDerWaalsContact O-CD1 3.29Å; Y539-I544 WeakPolarHBondContact O-CD1 3.29Å
540	A	95.4	Very high	95.5	Very high	74 Å²	74	81.9 Å²	81.9	61%	0.612	40%	0.398	S	S	*	.			trans	-50.1	135.6	175.8	0	0	0	0	0	111.8	S542 R543 I544	A540-S542 PolarHBondContact O-N 3.43Å; A540-R543 WeakPolarHBondContact O-CA 3.41Å; A540-R543 WeakPolarHBondContact O-CB 3.34Å; A540-R543 PolarHBondContact O-N 2.72Å; A540-I544 PolarHBondContact O-N 2.73Å
541	I	94.3	Very high	95.5	Very high	58 Å²	58	76.2 Å²	76.2	30%	0.297	37%	0.373	S	S	.	.	H	α-helix	trans	-57.2	-31.3	-171.8	-168.6	56	0	0	0	113.1	Y539 R543 I544 R545 G621 D622	Y539-I541 PolarHBondContact O-N 3.38Å; I541-R543 PolarHBondContact O-N 3.33Å; I541-I544 HydrophobicContact CD1-CB 4.15Å; I541-I544 HydrophobicContact CD1-CD1 4.35Å; I541-I544 HydrophobicContact CD1-CG2 4.18Å; I541-I544 PolarHBondContact O-N 2.89Å; I541-R545 HydrophobicContact CG1-CG 4.34Å; I541-R545 VanDerWaalsContact O-CG 3.32Å; I541-R545 WeakPolarHBondContact O-CG 3.26Å; I541-R545 PolarHBondContact O-N 3.37Å; I541-G621 WeakPolarHBondContact CD1-O 3.41Å; I541-G621 WeakPolarHBondContact CG1-O 3.44Å; I541-D622 WeakPolarHBondContact CD1-O 3.16Å
542	S	95.5	Very high	95.6	Very high	85 Å²	85	76 Å²	76	59%	0.594	37%	0.372	S	S	*	.	H	α-helix	trans	-56.5	-46	171.9	-176.3	0	0	0	0	112.6	A540 I544 R545 Q546	A540-S542 PolarHBondContact O-N 3.43Å; S542-I544 VanDerWaalsContact C-N 3.34Å; S542-I544 PolarHBondContact O-N 3.32Å; S542-R545 PolarHBondContact O-N 2.92Å; S542-Q546 VanDerWaalsContact O-CB 3.32Å; S542-Q546 WeakPolarHBondContact O-CB 3.01Å; S542-Q546 PolarHBondContact O-N 3.45Å
543	R	96	Very high	95.7	Very high	134 Å²	134	78.6 Å²	78.6	51%	0.506	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-37.8	177.1	-171.8	175.5	179.6	-174.9	-0.4	111.5	Y539 A540 I541 F547	Y539-R543 HydrophobicContact CD2-CG 4.37Å; A540-R543 WeakPolarHBondContact O-CA 3.41Å; A540-R543 WeakPolarHBondContact O-CB 3.34Å; A540-R543 PolarHBondContact O-N 2.72Å; I541-R543 PolarHBondContact O-N 3.33Å; R543-F547 WeakPolarHBondContact O-CB 3.09Å; R543-F547 PolarHBondContact O-N 3.19Å
544	I	96.5	Very high	95.8	Very high	5 Å²	5	76.8 Å²	76.8	3%	0.026	36%	0.361	C	S	.	.	H	α-helix	trans	-64.8	-49.7	175.1	-67.2	172.8	0	0	0	111.3	I535 Y539 A540 I541 S542 Q546 F547 Y548 L624 C627	I535-I544 HydrophobicContact CD1-CB 4.24Å; I535-I544 HydrophobicContact CD1-CG1 3.8Å; I535-I544 HydrophobicContact CG1-CG1 4.32Å; Y539-I544 VanDerWaalsContact O-CD1 3.29Å; Y539-I544 WeakPolarHBondContact O-CD1 3.29Å; A540-I544 PolarHBondContact O-N 2.73Å; I541-I544 HydrophobicContact CD1-CB 4.15Å; I541-I544 HydrophobicContact CD1-CD1 4.35Å; I541-I544 HydrophobicContact CD1-CG2 4.18Å; I541-I544 PolarHBondContact O-N 2.89Å; S542-I544 VanDerWaalsContact C-N 3.34Å; S542-I544 PolarHBondContact O-N 3.32Å; I544-Q546 PolarHBondContact O-N 3.05Å; I544-F547 PolarHBondContact O-N 3.41Å; I544-Y548 HydrophobicContact CG2-CD2 4.01Å; I544-Y548 HydrophobicContact CG2-CE2 4.03Å; I544-Y548 WeakPolarHBondContact O-CD2 3.34Å; I544-Y548 PolarHBondContact O-N 2.82Å; I544-L624 HydrophobicContact CD1-CB 4.3Å; I544-L624 HydrophobicContact CD1-CD1 4.07Å; I544-L624 HydrophobicContact CG1-CD1 4.12Å; I544-L624 HydrophobicContact CG2-CD1 4.02Å; I544-C627 HydrophobicContact CG2-CB 3.99Å
545	R	97.1	Very high	95.9	Very high	79 Å²	79	72 Å²	72	30%	0.298	33%	0.332	S	S	.	.	H	α-helix	trans	-59.2	-45.7	176.5	-68.3	176.7	-174.1	165.4	5.7	111.1	I541 S542 S549 M618 K619 G621	I541-R545 HydrophobicContact CG1-CG 4.34Å; I541-R545 VanDerWaalsContact O-CG 3.32Å; I541-R545 WeakPolarHBondContact O-CG 3.26Å; I541-R545 PolarHBondContact O-N 3.37Å; S542-R545 PolarHBondContact O-N 2.92Å; R545-S549 WeakPolarHBondContact O-CB 3.43Å; R545-S549 PolarHBondContact O-N 3.49Å; R545-S549 PolarHBondContact O-OG 2.9Å; R545-M618 WeakPolarHBondContact CD-O 3.46Å; R545-M618 WeakPolarHBondContact CG-O 3.48Å; R545-K619 PolarHBondContact NE-O 3.06Å; R545-K619 PolarHBondContact NH1-O 3.4Å; R545-G621 PolarHBondContact NE-O 3.04Å; R545-G621 PolarHBondContact NH2-O 2.9Å
546	Q	95.8	Very high	96.1	Very high	135 Å²	135	72 Å²	72	63%	0.631	33%	0.331	S	S	*	.	H	α-helix	trans	-64.1	-44.1	179.2	-168.9	-174.2	25.3	0	0	112.3	S542 I544 Y548 S549 R550	S542-Q546 VanDerWaalsContact O-CB 3.32Å; S542-Q546 WeakPolarHBondContact O-CB 3.01Å; S542-Q546 PolarHBondContact O-N 3.45Å; I544-Q546 PolarHBondContact O-N 3.05Å; Q546-Y548 PolarHBondContact O-N 3.21Å; Q546-S549 PolarHBondContact O-N 3.2Å; Q546-R550 WeakPolarHBondContact O-CB 3.37Å; Q546-R550 PolarHBondContact O-N 3.13Å
547	F	97.1	Very high	96.3	Very high	23 Å²	23	72.3 Å²	72.3	10%	0.101	33%	0.333	C	S	.	.	H	α-helix	trans	-57.9	-49.3	178.7	175.9	-88.5	0	0	0	112.1	P532 T533 V534 I535 R543 I544 K551	P532-F547 HydrophobicContact CB-CE2 4.16Å; P532-F547 HydrophobicContact CG-CD2 4.27Å; P532-F547 HydrophobicContact CG-CE2 4.21Å; P532-F547 WeakPolarHBondContact O-CE2 3.29Å; P532-F547 WeakPolarHBondContact O-CZ 3.28Å; T533-F547 WeakPolarHBondContact O-CZ 3.32Å; V534-F547 WeakPolarHBondContact O-CE2 3.45Å; I535-F547 HydrophobicContact CB-CD1 4.26Å; I535-F547 HydrophobicContact CB-CD2 4.27Å; I535-F547 HydrophobicContact CB-CE1 4.15Å; I535-F547 HydrophobicContact CB-CE2 4.12Å; I535-F547 HydrophobicContact CB-CG 4.34Å; I535-F547 HydrophobicContact CB-CZ 4.07Å; I535-F547 HydrophobicContact CD1-CB 3.59Å; I535-F547 HydrophobicContact CD1-CD1 3.89Å; I535-F547 HydrophobicContact CD1-CD2 4.09Å; I535-F547 HydrophobicContact CD1-CG 3.61Å; I535-F547 HydrophobicContact CG2-CD1 3.94Å; I535-F547 HydrophobicContact CG2-CE1 3.59Å; I535-F547 HydrophobicContact CG2-CE2 4.41Å; I535-F547 HydrophobicContact CG2-CZ 3.85Å; R543-F547 WeakPolarHBondContact O-CB 3.09Å; R543-F547 PolarHBondContact O-N 3.19Å; I544-F547 PolarHBondContact O-N 3.41Å; F547-K551 HydrophobicContact CE1-CD 4.21Å; F547-K551 VanDerWaalsContact CZ-CE 3.46Å; F547-K551 PolarHBondContact O-N 3.22Å
548	Y	97.4	Very high	96.4	Very high	14 Å²	14	62 Å²	62	6%	0.055	30%	0.295	C	S	.	.	H	α-helix	trans	-74.7	-36.7	179.6	-71	-57.6	0	0	0	112.9	I544 Q546 R550 K551 V552 L624 C627 K628 K631	I544-Y548 HydrophobicContact CG2-CD2 4.01Å; I544-Y548 HydrophobicContact CG2-CE2 4.03Å; I544-Y548 WeakPolarHBondContact O-CD2 3.34Å; I544-Y548 PolarHBondContact O-N 2.82Å; Q546-Y548 PolarHBondContact O-N 3.21Å; Y548-R550 VanDerWaalsContact C-N 3.3Å; Y548-R550 PolarHBondContact O-N 2.82Å; Y548-K551 PolarHBondContact O-N 2.78Å; Y548-K551 VanDerWaalsContact O-N 3.16Å; Y548-V552 PolarHBondContact O-N 2.88Å; Y548-V552 VanDerWaalsContact O-N 3.16Å; Y548-L624 HydrophobicContact CE2-CD1 3.93Å; Y548-C627 HydrophobicContact CD2-CB 3.39Å; Y548-C627 HydrophobicContact CE2-CB 3.9Å; Y548-C627 HydrophobicContact CG-CB 4.24Å; Y548-K628 HydrophobicContact CE1-CB 4.5Å; Y548-K628 HydrophobicContact CE2-CB 4.35Å; Y548-K631 HydrophobicContact CD1-CB 3.85Å; Y548-K631 HydrophobicContact CD1-CD 4.32Å; Y548-K631 HydrophobicContact CD1-CG 3.86Å; Y548-K631 HydrophobicContact CG-CB 4.24Å
549	S	96.2	Very high	96.6	Very high	26 Å²	26	55.1 Å²	55.1	18%	0.182	26%	0.263	C	S	.	.	H	α-helix	trans	-60.3	-39.4	173.6	-61.2	0	0	0	0	111.8	R545 Q546 K551 V552 K553	R545-S549 WeakPolarHBondContact O-CB 3.43Å; R545-S549 PolarHBondContact O-N 3.49Å; R545-S549 PolarHBondContact O-OG 2.9Å; Q546-S549 PolarHBondContact O-N 3.2Å; S549-K551 VanDerWaalsContact C-N 3.35Å; S549-K551 PolarHBondContact O-N 3.17Å; S549-V552 PolarHBondContact O-N 3.36Å; S549-K553 PolarHBondContact O-N 2.65Å
550	R	96.8	Very high	96.7	Very high	148 Å²	148	54.6 Å²	54.6	56%	0.558	26%	0.263	S	S	*	.	H	α-helix	trans	-61.5	-40.5	175.5	-176	174.8	179.5	170.8	-0.1	111.8	Q546 Y548 F554	Q546-R550 WeakPolarHBondContact O-CB 3.37Å; Q546-R550 PolarHBondContact O-N 3.13Å; Y548-R550 VanDerWaalsContact C-N 3.3Å; Y548-R550 PolarHBondContact O-N 2.82Å; R550-F554 WeakPolarHBondContact O-CB 3.2Å; R550-F554 PolarHBondContact O-N 2.82Å
551	K	97.1	Very high	96.7	Very high	21 Å²	21	54.6 Å²	54.6	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-65.2	-42	177.4	-71.5	-171.6	-179.8	-71.6	0	112.4	T531 P532 F547 Y548 S549 M555 K631	T531-K551 PolarHBondContact O-NZ 3.47Å; T531-K551 PolarHBondContact OG1-NZ 3.01Å; P532-K551 WeakPolarHBondContact O-CE 3.39Å; P532-K551 PolarHBondContact O-NZ 2.84Å; F547-K551 HydrophobicContact CE1-CD 4.21Å; F547-K551 VanDerWaalsContact CZ-CE 3.46Å; F547-K551 PolarHBondContact O-N 3.22Å; Y548-K551 PolarHBondContact O-N 2.78Å; Y548-K551 VanDerWaalsContact O-N 3.16Å; S549-K551 VanDerWaalsContact C-N 3.35Å; S549-K551 PolarHBondContact O-N 3.17Å; K551-M555 PolarHBondContact O-N 3.45Å; K551-K631 HydrophobicContact CB-CG 4.49Å
552	V	97.6	Very high	96.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-50.7	177.2	176.4	0	0	0	0	111.3	Y548 S549 F554 M555 Q556 T615 M618 K631 A634 L635 M638	Y548-V552 PolarHBondContact O-N 2.88Å; Y548-V552 VanDerWaalsContact O-N 3.16Å; S549-V552 PolarHBondContact O-N 3.36Å; V552-F554 VanDerWaalsContact C-N 3.33Å; V552-F554 PolarHBondContact O-N 3.43Å; V552-M555 PolarHBondContact O-N 3.21Å; V552-Q556 PolarHBondContact O-N 3.14Å; V552-T615 HydrophobicContact CG1-CG2 4.38Å; V552-M618 HydrophobicContact CG2-CE 3.61Å; V552-M618 HydrophobicContact CG2-SD 4.35Å; V552-K631 HydrophobicContact CG2-CG 4.34Å; V552-A634 HydrophobicContact CG1-CB 3.99Å; V552-A634 HydrophobicContact CG2-CB 3.69Å; V552-L635 HydrophobicContact CG2-CD2 4.43Å; V552-M638 HydrophobicContact CG1-CE 3.79Å
553	K	97.6	Very high	96.7	Very high	118 Å²	118	50.6 Å²	50.6	51%	0.513	22%	0.22	S	C	.	.	H	α-helix	trans	-60.9	-39.8	177.8	-71.7	-166.7	171.5	-164.8	0	112.9	S549 M555 Q556 Q557 T615	S549-K553 PolarHBondContact O-N 2.65Å; K553-M555 PolarHBondContact O-N 3.14Å; K553-Q556 PolarHBondContact O-N 3.5Å; K553-Q557 WeakPolarHBondContact O-CB 3.43Å; K553-Q557 PolarHBondContact O-N 3.27Å; K553-T615 HydrophobicContact CD-CG2 4.49Å; K553-T615 HydrophobicContact CG-CG2 3.88Å
554	F	97.9	Very high	96.7	Very high	55 Å²	55	44.8 Å²	44.8	24%	0.241	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-39.3	-179.8	-175.5	-86.8	0	0	0	113	K526 T527 K530 T531 R550 V552 S558	K526-F554 HydrophobicContact CG-CE1 4.1Å; K526-F554 HydrophobicContact CG-CZ 4.32Å; T527-F554 HydrophobicContact CG2-CD1 4.16Å; K530-F554 HydrophobicContact CB-CE1 4.02Å; K530-F554 HydrophobicContact CB-CE2 4.08Å; K530-F554 HydrophobicContact CB-CZ 3.53Å; K530-F554 HydrophobicContact CD-CZ 3.79Å; K530-F554 HydrophobicContact CG-CZ 4.21Å; T531-F554 HydrophobicContact CG2-CB 3.73Å; T531-F554 HydrophobicContact CG2-CD1 3.81Å; T531-F554 HydrophobicContact CG2-CD2 3.95Å; T531-F554 HydrophobicContact CG2-CE1 4.5Å; T531-F554 HydrophobicContact CG2-CG 3.51Å; R550-F554 WeakPolarHBondContact O-CB 3.2Å; R550-F554 PolarHBondContact O-N 2.82Å; V552-F554 VanDerWaalsContact C-N 3.33Å; V552-F554 PolarHBondContact O-N 3.43Å; F554-S558 WeakPolarHBondContact O-CB 3.47Å; F554-S558 PolarHBondContact O-N 3.33Å; F554-S558 VanDerWaalsContact O-N 3.1Å; F554-S558 PolarHBondContact O-OG 3.46Å; F554-S558 VanDerWaalsContact O-OG 3.09Å
555	M	97.4	Very high	96.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-69	-44.9	175.2	-177.4	164	162.9	0	0	111.2	L524 T527 K551 V552 K553 S558 I559 L635 M638	L524-M555 HydrophobicContact CD2-CE 4.32Å; L524-M555 HydrophobicContact CD2-SD 4.02Å; T527-M555 HydrophobicContact CG2-CB 4.34Å; K551-M555 PolarHBondContact O-N 3.45Å; V552-M555 PolarHBondContact O-N 3.21Å; K553-M555 PolarHBondContact O-N 3.14Å; M555-S558 PolarHBondContact O-N 3.1Å; M555-I559 HydrophobicContact CE-CD1 3.79Å; M555-I559 HydrophobicContact CG-CD1 3.84Å; M555-I559 HydrophobicContact CG-CG1 4.5Å; M555-I559 WeakPolarHBondContact O-CG1 3.5Å; M555-I559 PolarHBondContact O-N 2.81Å; M555-L635 HydrophobicContact CB-CD2 3.79Å; M555-L635 HydrophobicContact CG-CD2 4.17Å; M555-L635 HydrophobicContact SD-CB 4.01Å; M555-L635 HydrophobicContact SD-CD2 3.47Å; M555-L635 WeakPolarHBondContact SD-CD2 3.46Å; M555-L635 HydrophobicContact SD-CG 4.17Å; M555-M638 HydrophobicContact CB-SD 4.43Å; M555-M638 HydrophobicContact CE-CB 3.84Å; M555-M638 HydrophobicContact CG-SD 4.22Å
556	Q	97.4	Very high	96.5	Very high	27 Å²	27	43.6 Å²	43.6	13%	0.126	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-50.8	175.2	165.6	-97.2	-37.3	0	0	111.8	V552 K553 S558 I559 H560 V607 D608 S611 M638	V552-Q556 PolarHBondContact O-N 3.14Å; K553-Q556 PolarHBondContact O-N 3.5Å; Q556-S558 VanDerWaalsContact C-N 3.32Å; Q556-S558 PolarHBondContact O-N 3.09Å; Q556-I559 PolarHBondContact O-N 2.87Å; Q556-I559 VanDerWaalsContact O-N 3.15Å; Q556-H560 WeakPolarHBondContact O-CB 3.16Å; Q556-H560 PolarHBondContact O-N 3.43Å; Q556-V607 HydrophobicContact CB-CG1 4.11Å; Q556-V607 HydrophobicContact CG-CG1 4.02Å; Q556-D608 VanDerWaalsContact CG-OD1 3.29Å; Q556-D608 WeakPolarHBondContact CG-OD1 3.36Å; Q556-D608 PolarHBondContact NE2-OD1 3.06Å; Q556-S611 PolarHBondContact OE1-OG 3.01Å; Q556-M638 HydrophobicContact CB-CE 3.79Å; Q556-M638 HydrophobicContact CB-SD 4.34Å
557	Q	97.1	Very high	96.4	Very high	91 Å²	91	38.6 Å²	38.6	43%	0.425	18%	0.177	S	C	.	.	H	α-helix	trans	-57	-46.3	177.4	-168.7	68.1	49.3	0	0	111.3	K553 I559 H560 D561	K553-Q557 WeakPolarHBondContact O-CB 3.43Å; K553-Q557 PolarHBondContact O-N 3.27Å; Q557-I559 VanDerWaalsContact C-N 3.27Å; Q557-I559 PolarHBondContact O-N 2.85Å; Q557-H560 PolarHBondContact O-N 3.17Å; Q557-D561 PolarHBondContact NE2-OD1 3.41Å; Q557-D561 WeakPolarHBondContact O-CB 3.49Å; Q557-D561 PolarHBondContact O-N 3.15Å
558	S	96.6	Very high	96.1	Very high	4 Å²	4	43.7 Å²	43.7	3%	0.028	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-33.2	179.8	-70.8	0	0	0	0	113.8	F523 K526 F554 M555 Q556	F523-S558 WeakPolarHBondContact CE1-O 3.24Å; K526-S558 WeakPolarHBondContact CE-OG 3.27Å; K526-S558 PolarHBondContact NZ-OG 3.25Å; K526-S558 VanDerWaalsContact NZ-OG 3.09Å; F554-S558 WeakPolarHBondContact O-CB 3.47Å; F554-S558 PolarHBondContact O-N 3.33Å; F554-S558 VanDerWaalsContact O-N 3.1Å; F554-S558 PolarHBondContact O-OG 3.46Å; F554-S558 VanDerWaalsContact O-OG 3.09Å; M555-S558 PolarHBondContact O-N 3.1Å; Q556-S558 VanDerWaalsContact C-N 3.32Å; Q556-S558 PolarHBondContact O-N 3.09Å
559	I	96.3	Very high	95.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-74.6	-49.2	174.6	-66.4	164.8	0	0	0	109.9	F523 M555 Q556 Q557 D561 R562 L563 V607 M638 L642	F523-I559 HydrophobicContact CB-CG1 4.45Å; F523-I559 HydrophobicContact CD1-CG1 4.16Å; F523-I559 HydrophobicContact CD2-CD1 4.39Å; F523-I559 HydrophobicContact CD2-CG1 3.61Å; F523-I559 HydrophobicContact CE1-CG1 4.32Å; F523-I559 HydrophobicContact CE2-CB 4.48Å; F523-I559 HydrophobicContact CE2-CG1 3.76Å; F523-I559 HydrophobicContact CG-CG1 3.83Å; F523-I559 HydrophobicContact CZ-CG1 4.13Å; M555-I559 HydrophobicContact CE-CD1 3.79Å; M555-I559 HydrophobicContact CG-CD1 3.84Å; M555-I559 HydrophobicContact CG-CG1 4.5Å; M555-I559 WeakPolarHBondContact O-CG1 3.5Å; M555-I559 PolarHBondContact O-N 2.81Å; Q556-I559 PolarHBondContact O-N 2.87Å; Q556-I559 VanDerWaalsContact O-N 3.15Å; Q557-I559 VanDerWaalsContact C-N 3.27Å; Q557-I559 PolarHBondContact O-N 2.85Å; I559-D561 VanDerWaalsContact C-N 3.31Å; I559-D561 PolarHBondContact O-N 2.95Å; I559-R562 PolarHBondContact O-N 2.7Å; I559-R562 VanDerWaalsContact O-N 3.13Å; I559-L563 HydrophobicContact CG2-CD1 3.7Å; I559-L563 HydrophobicContact CG2-CG 3.98Å; I559-L563 WeakPolarHBondContact O-CG 3.48Å; I559-L563 PolarHBondContact O-N 3.08Å; I559-V607 HydrophobicContact CB-CG1 4.11Å; I559-V607 HydrophobicContact CD1-CG1 4.11Å; I559-V607 HydrophobicContact CG2-CB 4.41Å; I559-V607 HydrophobicContact CG2-CG1 4.02Å; I559-V607 HydrophobicContact CG2-CG2 4.13Å; I559-M638 HydrophobicContact CD1-CB 4.13Å; I559-L642 HydrophobicContact CD1-CD1 3.9Å; I559-L642 HydrophobicContact CG1-CD1 4.15Å; I559-L642 HydrophobicContact CG2-CD2 4.03Å
560	H	97	Very high	95.5	Very high	50 Å²	50	44.8 Å²	44.8	23%	0.231	21%	0.208	C	C	.	.	H	α-helix	trans	-53.3	-47.9	178.6	174.9	-76.3	0	0	0	111.8	Q556 Q557 R562 S564 D608	Q556-H560 WeakPolarHBondContact O-CB 3.16Å; Q556-H560 PolarHBondContact O-N 3.43Å; Q557-H560 PolarHBondContact O-N 3.17Å; H560-R562 PolarHBondContact O-N 2.84Å; H560-S564 PolarHBondContact CE1-OG 3.5Å; H560-S564 VanDerWaalsContact O-CB 3.29Å; H560-S564 WeakPolarHBondContact O-CB 3.45Å; H560-S564 PolarHBondContact O-N 2.86Å; H560-S564 PolarHBondContact O-OG 3.38Å; H560-D608 IonicContact CD2-OD1 3.81Å; H560-D608 IonicContact CD2-OD2 3.33Å; H560-D608 PolarHBondContact CD2-OD2 2.97Å
561	D	96	Very high	95.1	Very high	74 Å²	74	39 Å²	39	40%	0.396	19%	0.19	S	C	.	.	H	α-helix	trans	-60	-43.9	178.8	-60.7	-18.3	0	0	0	111.5	Q557 I559 L565	Q557-D561 PolarHBondContact NE2-OD1 3.41Å; Q557-D561 WeakPolarHBondContact O-CB 3.49Å; Q557-D561 PolarHBondContact O-N 3.15Å; I559-D561 VanDerWaalsContact C-N 3.31Å; I559-D561 PolarHBondContact O-N 2.95Å; D561-L565 VanDerWaalsContact O-CB 3.26Å; D561-L565 WeakPolarHBondContact O-CB 3.17Å; D561-L565 PolarHBondContact O-N 2.67Å
562	R	95.1	Very high	94.7	Very high	56 Å²	56	43.6 Å²	43.6	21%	0.211	21%	0.21	C	C	.	.	H	α-helix	trans	-76.8	-37.1	-176.1	-173.5	55.3	172.5	167.3	3.4	112.8	T511 V512 L519 F523 I559 H560 I566	T511-R562 PolarHBondContact OG1-NH1 3.49Å; V512-R562 PolarHBondContact O-NH2 3.08Å; L519-R562 HydrophobicContact CD2-CG 4.32Å; F523-R562 HydrophobicContact CE1-CB 4.04Å; F523-R562 HydrophobicContact CZ-CB 3.78Å; F523-R562 HydrophobicContact CZ-CG 4.04Å; I559-R562 PolarHBondContact O-N 2.7Å; I559-R562 VanDerWaalsContact O-N 3.13Å; H560-R562 PolarHBondContact O-N 2.84Å; R562-I566 WeakPolarHBondContact O-CG1 3.38Å; R562-I566 PolarHBondContact O-N 3.12Å
563	L	95.3	Very high	94.2	Very high	2 Å²	2	44 Å²	44	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-71.7	-37.6	175.7	-62.2	-173.6	0	0	0	111.3	I559 I566 L567 I600 A603 R604 L642	I559-L563 HydrophobicContact CG2-CD1 3.7Å; I559-L563 HydrophobicContact CG2-CG 3.98Å; I559-L563 WeakPolarHBondContact O-CG 3.48Å; I559-L563 PolarHBondContact O-N 3.08Å; L563-I566 HydrophobicContact CD2-CD1 4.49Å; L563-I566 PolarHBondContact O-N 3.21Å; L563-L567 WeakPolarHBondContact O-CG 3.42Å; L563-L567 PolarHBondContact O-N 3.2Å; L563-L567 VanDerWaalsContact O-N 3.08Å; L563-I600 HydrophobicContact CB-CG2 4.08Å; L563-I600 HydrophobicContact CD2-CG2 4.15Å; L563-A603 HydrophobicContact CD1-CB 4.26Å; L563-R604 HydrophobicContact CB-CB 4.28Å; L563-R604 HydrophobicContact CD1-CB 4.16Å; L563-L642 HydrophobicContact CD1-CD2 4.5Å
564	S	96	Very high	93.6	Very high	13 Å²	13	43.3 Å²	43.3	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-44.4	174.2	-54.9	0	0	0	0	111.2	H560 I566 L567 D568 R604	H560-S564 PolarHBondContact CE1-OG 3.5Å; H560-S564 VanDerWaalsContact O-CB 3.29Å; H560-S564 WeakPolarHBondContact O-CB 3.45Å; H560-S564 PolarHBondContact O-N 2.86Å; H560-S564 PolarHBondContact O-OG 3.38Å; S564-I566 VanDerWaalsContact C-N 3.27Å; S564-I566 PolarHBondContact O-N 3.44Å; S564-L567 CarbonylContact O-C 3.56Å; S564-L567 WeakPolarHBondContact O-CA 3.43Å; S564-L567 WeakPolarHBondContact O-CB 3.48Å; S564-L567 PolarHBondContact O-N 3.44Å; S564-D568 PolarHBondContact O-N 3.22Å; S564-R604 WeakPolarHBondContact OG-CD 3.16Å; S564-R604 PolarHBondContact OG-NH1 3.01Å
565	L	94.3	Very high	93.1	Very high	57 Å²	57	47.4 Å²	47.4	30%	0.298	23%	0.234	S	C	.	.	H	α-helix	trans	-56.5	-38.9	174.9	177.3	159.5	0	0	0	112.7	T511 D561 D568 E569	T511-L565 VanDerWaalsContact OG1-CD2 3.28Å; T511-L565 WeakPolarHBondContact OG1-CD2 3.5Å; D561-L565 VanDerWaalsContact O-CB 3.26Å; D561-L565 WeakPolarHBondContact O-CB 3.17Å; D561-L565 PolarHBondContact O-N 2.67Å; L565-D568 PolarHBondContact O-N 3.03Å; L565-E569 HydrophobicContact CD2-CG 4.33Å; L565-E569 WeakPolarHBondContact CD2-OE1 3.49Å; L565-E569 WeakPolarHBondContact CD2-OE2 3.48Å; L565-E569 HydrophobicContact CG-CG 4.49Å; L565-E569 WeakPolarHBondContact CG-OE1 3.02Å; L565-E569 WeakPolarHBondContact O-CB 3.34Å; L565-E569 VanDerWaalsContact O-CG 3.28Å; L565-E569 WeakPolarHBondContact O-CG 3.3Å; L565-E569 PolarHBondContact O-N 2.91Å
566	I	94.2	Very high	92.5	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-44.3	173.3	-67.2	165	0	0	0	110.7	V513 R562 L563 S564 D568 F570 L649 L652	V513-I566 HydrophobicContact CG1-CD1 4.28Å; V513-I566 HydrophobicContact CG2-CG1 4.43Å; V513-I566 HydrophobicContact CG2-CG2 4.49Å; R562-I566 WeakPolarHBondContact O-CG1 3.38Å; R562-I566 PolarHBondContact O-N 3.12Å; L563-I566 HydrophobicContact CD2-CD1 4.49Å; L563-I566 PolarHBondContact O-N 3.21Å; S564-I566 VanDerWaalsContact C-N 3.27Å; S564-I566 PolarHBondContact O-N 3.44Å; I566-D568 VanDerWaalsContact C-N 3.3Å; I566-D568 PolarHBondContact O-N 3.41Å; I566-F570 HydrophobicContact CG2-CD2 4.05Å; I566-F570 HydrophobicContact CG2-CE2 4.1Å; I566-F570 VanDerWaalsContact O-CD2 3.29Å; I566-F570 WeakPolarHBondContact O-CD2 3.39Å; I566-F570 PolarHBondContact O-N 2.93Å; I566-L649 HydrophobicContact CD1-CD2 4.41Å; I566-L652 HydrophobicContact CG2-CD1 4.32Å
567	L	93.6	Very high	92.1	Very high	31 Å²	31	49.4 Å²	49.4	16%	0.162	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-30.1	178.5	-65.8	168.3	0	0	0	113.6	L563 S564 L597 I600	L563-L567 WeakPolarHBondContact O-CG 3.42Å; L563-L567 PolarHBondContact O-N 3.2Å; L563-L567 VanDerWaalsContact O-N 3.08Å; S564-L567 CarbonylContact O-C 3.56Å; S564-L567 WeakPolarHBondContact O-CA 3.43Å; S564-L567 WeakPolarHBondContact O-CB 3.48Å; S564-L567 PolarHBondContact O-N 3.44Å; L567-L597 HydrophobicContact CD2-CB 4.25Å; L567-L597 HydrophobicContact CD2-CD2 4.23Å; L567-L597 WeakPolarHBondContact CD2-O 3.22Å; L567-I600 HydrophobicContact CD1-CG2 4.33Å; L567-I600 HydrophobicContact CD2-CB 4.16Å; L567-I600 HydrophobicContact CD2-CG2 3.98Å; L567-I600 HydrophobicContact CG-CG2 3.97Å
568	D	90.7	Very high	91.8	Very high	129 Å²	129	48.2 Å²	48.2	69%	0.69	24%	0.244	S	C	*	.	H	α-helix	trans	-86	-28.4	-177.4	-61.4	-29.3	0	0	0	112.8	S564 L565 I566	S564-D568 PolarHBondContact O-N 3.22Å; L565-D568 PolarHBondContact O-N 3.03Å; I566-D568 VanDerWaalsContact C-N 3.3Å; I566-D568 PolarHBondContact O-N 3.41Å
569	E	89.8	Confident	91.6	Very high	59 Å²	59	48 Å²	48	28%	0.276	24%	0.243	S	C	.	.	H	α-helix	trans	-83.6	-30	179.7	-72.9	175.5	-179.3	0	0	113.2	I510 T511 L565	I510-E569 HydrophobicContact CG2-CB 4.08Å; T511-E569 WeakPolarHBondContact CA-OE2 3.23Å; T511-E569 VanDerWaalsContact CB-OE2 3.25Å; T511-E569 WeakPolarHBondContact CB-OE2 3.48Å; T511-E569 VanDerWaalsContact CG2-OE1 3.27Å; T511-E569 WeakPolarHBondContact CG2-OE1 3.4Å; T511-E569 WeakPolarHBondContact CG2-OE2 3.46Å; T511-E569 PolarHBondContact N-OE2 3.45Å; T511-E569 PolarHBondContact OG1-OE2 2.77Å; L565-E569 HydrophobicContact CD2-CG 4.33Å; L565-E569 WeakPolarHBondContact CD2-OE1 3.49Å; L565-E569 WeakPolarHBondContact CD2-OE2 3.48Å; L565-E569 HydrophobicContact CG-CG 4.49Å; L565-E569 WeakPolarHBondContact CG-OE1 3.02Å; L565-E569 WeakPolarHBondContact O-CB 3.34Å; L565-E569 VanDerWaalsContact O-CG 3.28Å; L565-E569 WeakPolarHBondContact O-CG 3.3Å; L565-E569 PolarHBondContact O-N 2.91Å
570	F	91.8	Very high	91.4	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.022	24%	0.243	C	C	.	.	S	Bend	trans	-77	131.9	176.8	-86.8	-97.9	0	0	0	111.2	I510 V513 I566 Y593 L597 L652 V655 R656	I510-F570 HydrophobicContact CG2-CD2 4.01Å; I510-F570 HydrophobicContact CG2-CE2 3.76Å; I510-F570 HydrophobicContact CG2-CZ 4.26Å; V513-F570 HydrophobicContact CG2-CE2 3.77Å; V513-F570 HydrophobicContact CG2-CZ 4.11Å; I566-F570 HydrophobicContact CG2-CD2 4.05Å; I566-F570 HydrophobicContact CG2-CE2 4.1Å; I566-F570 VanDerWaalsContact O-CD2 3.29Å; I566-F570 WeakPolarHBondContact O-CD2 3.39Å; I566-F570 PolarHBondContact O-N 2.93Å; F570-Y593 AromaticContact CD1-CE2 3.91Å; F570-Y593 HydrophobicContact CD1-CE2 3.91Å; F570-Y593 HydrophobicContact CE1-CE2 4.47Å; F570-L597 HydrophobicContact CB-CD1 4.32Å; F570-L597 HydrophobicContact CB-CD2 4.01Å; F570-L597 HydrophobicContact CG-CD2 4.24Å; F570-L652 HydrophobicContact CD1-CD2 4.05Å; F570-L652 HydrophobicContact CE1-CB 4.39Å; F570-L652 HydrophobicContact CE1-CD2 3.77Å; F570-L652 HydrophobicContact CZ-CB 3.94Å; F570-L652 HydrophobicContact CZ-CD2 4.07Å; F570-L652 WeakPolarHBondContact CZ-O 3.47Å; F570-V655 HydrophobicContact CE1-CG1 4.26Å; F570-R656 HydrophobicContact CE1-CB 4.46Å; F570-R656 HydrophobicContact CZ-CB 3.94Å; F570-R656 HydrophobicContact CZ-CG 4.44Å
571	P	89.3	Confident	91.1	Very high	26 Å²	26	46.5 Å²	46.5	17%	0.169	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-76.3	137.6	-173.4	35.5	-39.4	0	0	0	110.6	F507 I576 M584 Y593	F507-P571 HydrophobicContact CD1-CG 4.43Å; F507-P571 HydrophobicContact CE1-CG 4.22Å; P571-I576 HydrophobicContact CB-CD1 3.6Å; P571-I576 HydrophobicContact CB-CG1 4.24Å; P571-I576 HydrophobicContact CG-CD1 4.14Å; P571-M584 HydrophobicContact CG-CE 4.01Å; P571-M584 HydrophobicContact CG-SD 4.21Å; P571-Y593 WeakPolarHBondContact CD-OH 3.3Å; P571-Y593 PolarHBondContact O-OH 2.71Å
572	K	87.7	Confident	91	Very high	117 Å²	117	46 Å²	46	51%	0.509	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-83.8	117.3	-179.6	-63.2	166.1	-176.8	166.8	0	110.5	D574 E575 I576	K572-D574 PolarHBondContact O-N 2.99Å; K572-E575 HydrophobicContact CB-CB 4.33Å; K572-E575 HydrophobicContact CB-CG 4.5Å; K572-E575 HydrophobicContact CD-CG 4.21Å; K572-E575 WeakPolarHBondContact CD-OE1 3.36Å; K572-E575 VanDerWaalsContact CD-OE2 3.29Å; K572-E575 WeakPolarHBondContact CD-OE2 3.48Å; K572-E575 IonicContact NZ-OE1 2.81Å; K572-E575 PolarHBondContact NZ-OE1 3.2Å; K572-E575 IonicContact NZ-OE2 2.65Å; K572-E575 PolarHBondContact NZ-OE2 3.03Å; K572-E575 PolarHBondContact O-N 3.5Å; K572-I576 WeakPolarHBondContact O-CD1 3.36Å; K572-I576 VanDerWaalsContact O-CG1 3.23Å; K572-I576 WeakPolarHBondContact O-CG1 3.28Å; K572-I576 PolarHBondContact O-N 3.34Å
573	L	86.5	Confident	90.8	Very high	8 Å²	8	43.8 Å²	43.8	4%	0.042	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-32	-175	-56.9	-179.3	0	0	0	114.3	I576 A581 M584 R590 Y593	L573-I576 HydrophobicContact CD2-CD1 4.25Å; L573-A581 WeakPolarHBondContact O-CB 3.27Å; L573-M584 HydrophobicContact CD2-CB 3.6Å; L573-M584 HydrophobicContact CD2-CG 4.12Å; L573-M584 HydrophobicContact CD2-SD 3.44Å; L573-M584 WeakPolarHBondContact CD2-SD 3.36Å; L573-R590 HydrophobicContact CD1-CB 4.1Å; L573-R590 HydrophobicContact CD1-CG 3.8Å; L573-Y593 HydrophobicContact CD1-CD1 3.53Å; L573-Y593 HydrophobicContact CD1-CE1 4.06Å; L573-Y593 HydrophobicContact CD1-CG 4.22Å; L573-Y593 HydrophobicContact CD2-CD1 4.3Å; L573-Y593 HydrophobicContact CD2-CE1 4.05Å; L573-Y593 HydrophobicContact CG-CD1 3.76Å; L573-Y593 HydrophobicContact CG-CE1 3.75Å
574	D	86	Confident	90.6	Very high	104 Å²	104	43.8 Å²	43.8	56%	0.556	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.2	-177.9	-44.7	-54.5	0	0	0	114.1	K572 R590 K594	K572-D574 PolarHBondContact O-N 2.99Å; D574-R590 IonicContact OD1-CZ 3.58Å; D574-R590 IonicContact OD1-NE 3.33Å; D574-R590 IonicContact OD1-NH2 2.69Å; D574-R590 PolarHBondContact OD1-NH2 3.49Å; D574-K594 IonicContact OD1-NZ 3.75Å; D574-K594 PolarHBondContact OD1-NZ 3.45Å; D574-K594 WeakPolarHBondContact OD2-CE 3.37Å; D574-K594 IonicContact OD2-NZ 3.8Å; D574-K594 PolarHBondContact OD2-NZ 3.02Å
575	E	86.1	Confident	90.4	Very high	142 Å²	142	46.6 Å²	46.6	66%	0.664	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-2	177.7	-69.6	175	-158.5	0	0	112.8	K572	K572-E575 HydrophobicContact CB-CB 4.33Å; K572-E575 HydrophobicContact CB-CG 4.5Å; K572-E575 HydrophobicContact CD-CG 4.21Å; K572-E575 WeakPolarHBondContact CD-OE1 3.36Å; K572-E575 VanDerWaalsContact CD-OE2 3.29Å; K572-E575 WeakPolarHBondContact CD-OE2 3.48Å; K572-E575 IonicContact NZ-OE1 2.81Å; K572-E575 PolarHBondContact NZ-OE1 3.2Å; K572-E575 IonicContact NZ-OE2 2.65Å; K572-E575 PolarHBondContact NZ-OE2 3.03Å; K572-E575 PolarHBondContact O-N 3.5Å
576	I	86.6	Confident	90.3	Very high	21 Å²	21	45.5 Å²	45.5	11%	0.108	24%	0.236	C	C	.	.	S	Bend	trans	-92.9	156.7	-179.1	-61.7	160.8	0	0	0	110	Y505 P571 K572 L573 Y580 M584	Y505-I576 HydrophobicContact CE1-CG2 3.91Å; P571-I576 HydrophobicContact CB-CD1 3.6Å; P571-I576 HydrophobicContact CB-CG1 4.24Å; P571-I576 HydrophobicContact CG-CD1 4.14Å; K572-I576 WeakPolarHBondContact O-CD1 3.36Å; K572-I576 VanDerWaalsContact O-CG1 3.23Å; K572-I576 WeakPolarHBondContact O-CG1 3.28Å; K572-I576 PolarHBondContact O-N 3.34Å; L573-I576 HydrophobicContact CD2-CD1 4.25Å; I576-Y580 VanDerWaalsContact CG2-CB 3.41Å; I576-Y580 HydrophobicContact CG2-CG 4.38Å; I576-M584 HydrophobicContact CD1-CE 4.28Å; I576-M584 HydrophobicContact CD1-SD 4.19Å
577	H	88.8	Confident	90.1	Very high	47 Å²	47	47.5 Å²	47.5	22%	0.218	25%	0.246	C	C	.	.			trans	-55.3	135.5	170	-175.2	-79	0	0	0	111.8	Y505 F579 Y580 A581	Y505-H577 HydrophobicContact CE2-CB 4.09Å; Y505-H577 WeakPolarHBondContact OH-CB 3.09Å; Y505-H577 PolarHBondContact OH-N 2.83Å; H577-F579 VanDerWaalsContact C-N 3.33Å; H577-F579 WeakPolarHBondContact ND1-CB 3.43Å; H577-F579 PolarHBondContact ND1-N 2.86Å; H577-F579 PolarHBondContact O-N 3.02Å; H577-F579 VanDerWaalsContact O-N 3.1Å; H577-Y580 PolarHBondContact O-N 3.26Å; H577-A581 PolarHBondContact O-N 2.93Å
578	P	91	Very high	89.9	Confident	67 Å²	67	47.1 Å²	47.1	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-45.1	-47.2	-175.3	-33.9	37.2	0	0	0	115.5	Y580 A581 D582 H747	P578-Y580 VanDerWaalsContact C-N 3.29Å; P578-Y580 PolarHBondContact O-N 2.96Å; P578-Y580 VanDerWaalsContact O-N 3.15Å; P578-A581 WeakPolarHBondContact O-CB 3.21Å; P578-A581 PolarHBondContact O-N 3.37Å; P578-D582 PolarHBondContact O-N 3.38Å; P578-H747 VanDerWaalsContact CB-CE1 3.45Å; P578-H747 WeakPolarHBondContact CB-CE1 3.3Å
579	F	92.4	Very high	90	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-41	-51.2	172	174.6	-115.4	0	0	0	114.5	H577 L583 I665 P667 L706 A744 H747 I748	H577-F579 VanDerWaalsContact C-N 3.33Å; H577-F579 WeakPolarHBondContact ND1-CB 3.43Å; H577-F579 PolarHBondContact ND1-N 2.86Å; H577-F579 PolarHBondContact O-N 3.02Å; H577-F579 VanDerWaalsContact O-N 3.1Å; F579-L583 HydrophobicContact CE1-CD2 4.39Å; F579-L583 HydrophobicContact CZ-CD2 4.12Å; F579-L583 WeakPolarHBondContact O-CB 3.43Å; F579-L583 PolarHBondContact O-N 3.14Å; F579-L583 VanDerWaalsContact O-N 3.07Å; F579-I665 HydrophobicContact CE1-CB 4.02Å; F579-I665 HydrophobicContact CE1-CD1 3.99Å; F579-I665 HydrophobicContact CE1-CG2 3.95Å; F579-I665 HydrophobicContact CZ-CD1 3.76Å; F579-I665 HydrophobicContact CZ-CG2 4.38Å; F579-P667 HydrophobicContact CB-CB 4.49Å; F579-L706 HydrophobicContact CE2-CD1 4.28Å; F579-L706 HydrophobicContact CZ-CD1 3.99Å; F579-A744 HydrophobicContact CE2-CB 4.27Å; F579-H747 HydrophobicContact CB-CB 3.66Å; F579-H747 HydrophobicContact CD2-CB 4.15Å; F579-H747 HydrophobicContact CG-CB 4.36Å; F579-I748 HydrophobicContact CD2-CD1 4.18Å; F579-I748 HydrophobicContact CD2-CG1 3.98Å; F579-I748 HydrophobicContact CE2-CD1 3.8Å; F579-I748 HydrophobicContact CE2-CG1 4.13Å; F579-I748 HydrophobicContact CG-CG1 4.37Å; F579-I748 HydrophobicContact CZ-CD1 4.01Å
580	Y	91.5	Very high	90.1	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-81.4	-28	-178.2	-79.3	-73.9	0	0	0	112.5	Y505 F507 I576 H577 P578 L583 M584 I665	Y505-Y580 AromaticContact CD2-CD2 3.48Å; Y505-Y580 HydrophobicContact CD2-CD2 3.48Å; Y505-Y580 VanDerWaalsContact CD2-CD2 3.48Å; Y505-Y580 AromaticContact CD2-CE2 3.25Å; Y505-Y580 HydrophobicContact CD2-CE2 3.25Å; Y505-Y580 HydrophobicContact CD2-CG 4.46Å; Y505-Y580 AromaticContact CE2-CD2 3.58Å; Y505-Y580 HydrophobicContact CE2-CD2 3.58Å; Y505-Y580 AromaticContact CE2-CE2 3.75Å; Y505-Y580 HydrophobicContact CE2-CE2 3.75Å; Y505-Y580 HydrophobicContact CG-CD2 4.2Å; Y505-Y580 HydrophobicContact CG-CE2 4.05Å; F507-Y580 AromaticContact CE2-CD1 3.9Å; F507-Y580 HydrophobicContact CE2-CD1 3.9Å; F507-Y580 AromaticContact CE2-CE1 3.59Å; F507-Y580 HydrophobicContact CE2-CE1 3.59Å; F507-Y580 AromaticContact CZ-CD1 3.79Å; F507-Y580 HydrophobicContact CZ-CD1 3.79Å; F507-Y580 AromaticContact CZ-CE1 3.9Å; F507-Y580 HydrophobicContact CZ-CE1 3.9Å; F507-Y580 HydrophobicContact CZ-CG 4.35Å; I576-Y580 VanDerWaalsContact CG2-CB 3.41Å; I576-Y580 HydrophobicContact CG2-CG 4.38Å; H577-Y580 PolarHBondContact O-N 3.26Å; P578-Y580 VanDerWaalsContact C-N 3.29Å; P578-Y580 PolarHBondContact O-N 2.96Å; P578-Y580 VanDerWaalsContact O-N 3.15Å; Y580-L583 HydrophobicContact CD1-CD2 4.31Å; Y580-M584 VanDerWaalsContact O-CB 3.31Å; Y580-M584 WeakPolarHBondContact O-CB 3.35Å; Y580-M584 WeakPolarHBondContact O-CG 3.44Å; Y580-M584 PolarHBondContact O-N 3.18Å; Y580-I665 WeakPolarHBondContact CE2-O 2.82Å; Y580-I665 WeakPolarHBondContact OH-CA 2.5Å; Y580-I665 PolarHBondContact OH-N 3.22Å; Y580-I665 PolarHBondContact OH-O 3.12Å
581	A	91	Very high	90.1	Very high	16 Å²	16	51.3 Å²	51.3	13%	0.132	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-46.3	174.4	0	0	0	0	0	110.8	L573 H577 P578 M584 N585	L573-A581 WeakPolarHBondContact O-CB 3.27Å; H577-A581 PolarHBondContact O-N 2.93Å; P578-A581 WeakPolarHBondContact O-CB 3.21Å; P578-A581 PolarHBondContact O-N 3.37Å; A581-M584 PolarHBondContact O-N 3.17Å; A581-N585 PolarHBondContact O-N 2.87Å
582	D	92.7	Very high	90.4	Very high	64 Å²	64	54.5 Å²	54.5	34%	0.342	27%	0.272	S	S	.	.	H	α-helix	trans	-74	-37.9	179.4	-67.5	-7.4	0	0	0	112	P578 M584 N585 I586 T743 H747	P578-D582 PolarHBondContact O-N 3.38Å; D582-M584 VanDerWaalsContact C-N 3.3Å; D582-M584 PolarHBondContact O-N 2.75Å; D582-N585 WeakPolarHBondContact O-CB 3.43Å; D582-N585 PolarHBondContact O-N 3.45Å; D582-N585 VanDerWaalsContact O-N 3.15Å; D582-I586 WeakPolarHBondContact O-CG1 3.06Å; D582-I586 PolarHBondContact O-N 3.28Å; D582-T743 HydrophobicContact CB-CG2 3.79Å; D582-H747 IonicContact OD2-CD2 2.62Å; D582-H747 IonicContact OD2-CE1 2.75Å; D582-H747 PolarHBondContact OD2-CE1 3.13Å; D582-H747 IonicContact OD2-NE2 3.13Å; D582-H747 PolarHBondContact OD2-NE2 2.8Å
583	L	92	Very high	90.8	Very high	8 Å²	8	49.1 Å²	49.1	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-40	171.8	-177.8	63	0	0	0	111.7	F579 Y580 L587 Q740	F579-L583 HydrophobicContact CE1-CD2 4.39Å; F579-L583 HydrophobicContact CZ-CD2 4.12Å; F579-L583 WeakPolarHBondContact O-CB 3.43Å; F579-L583 PolarHBondContact O-N 3.14Å; F579-L583 VanDerWaalsContact O-N 3.07Å; Y580-L583 HydrophobicContact CD1-CD2 4.31Å; L583-L587 HydrophobicContact CD1-CD1 4.04Å; L583-L587 HydrophobicContact CD1-CG 4.39Å; L583-L587 HydrophobicContact CG-CD1 4.02Å; L583-L587 WeakPolarHBondContact O-CB 3.46Å; L583-L587 VanDerWaalsContact O-CG 3.25Å; L583-L587 WeakPolarHBondContact O-CG 3.48Å; L583-L587 PolarHBondContact O-N 3.22Å; L583-L587 VanDerWaalsContact O-N 3.11Å; L583-Q740 HydrophobicContact CD1-CB 4.33Å; L583-Q740 HydrophobicContact CD1-CG 3.79Å
584	M	90.7	Very high	91.2	Very high	3 Å²	3	52 Å²	52	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-71.8	-31.9	174.4	-72.4	-175.6	-159.8	0	0	112.7	F507 P571 L573 I576 Y580 A581 D582 Y588 L659	F507-M584 HydrophobicContact CD1-CE 4.35Å; F507-M584 HydrophobicContact CE1-CE 3.52Å; F507-M584 HydrophobicContact CE2-CE 4.41Å; F507-M584 HydrophobicContact CZ-CE 3.55Å; P571-M584 HydrophobicContact CG-CE 4.01Å; P571-M584 HydrophobicContact CG-SD 4.21Å; L573-M584 HydrophobicContact CD2-CB 3.6Å; L573-M584 HydrophobicContact CD2-CG 4.12Å; L573-M584 HydrophobicContact CD2-SD 3.44Å; L573-M584 WeakPolarHBondContact CD2-SD 3.36Å; I576-M584 HydrophobicContact CD1-CE 4.28Å; I576-M584 HydrophobicContact CD1-SD 4.19Å; Y580-M584 VanDerWaalsContact O-CB 3.31Å; Y580-M584 WeakPolarHBondContact O-CB 3.35Å; Y580-M584 WeakPolarHBondContact O-CG 3.44Å; Y580-M584 PolarHBondContact O-N 3.18Å; A581-M584 PolarHBondContact O-N 3.17Å; D582-M584 VanDerWaalsContact C-N 3.3Å; D582-M584 PolarHBondContact O-N 2.75Å; M584-Y588 HydrophobicContact CB-CD2 4.05Å; M584-Y588 HydrophobicContact CB-CE2 4.45Å; M584-Y588 HydrophobicContact CG-CD2 4.13Å; M584-Y588 HydrophobicContact CG-CE2 4.06Å; M584-Y588 WeakPolarHBondContact O-CB 3.35Å; M584-Y588 PolarHBondContact O-N 3.48Å; M584-L659 HydrophobicContact CE-CD2 3.76Å; M584-L659 HydrophobicContact CG-CD2 4.44Å; M584-L659 HydrophobicContact SD-CD2 4.26Å
585	N	92.1	Very high	91.6	Very high	71 Å²	71	51.8 Å²	51.8	38%	0.38	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-49.4	172.8	-172.4	37.7	0	0	0	111	A581 D582 L587 D589 R590	A581-N585 PolarHBondContact O-N 2.87Å; D582-N585 WeakPolarHBondContact O-CB 3.43Å; D582-N585 PolarHBondContact O-N 3.45Å; D582-N585 VanDerWaalsContact O-N 3.15Å; N585-L587 PolarHBondContact O-N 2.9Å; N585-D589 WeakPolarHBondContact O-CA 3.38Å; N585-D589 PolarHBondContact O-N 2.62Å; N585-R590 HydrophobicContact CB-CB 4.32Å; N585-R590 WeakPolarHBondContact OD1-CB 3.02Å; N585-R590 PolarHBondContact OD1-N 3.4Å
586	I	91.2	Very high	92.1	Very high	35 Å²	35	45 Å²	45	18%	0.179	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-40.7	178.5	-65.6	157.6	0	0	0	112.1	D582 T736 M739 T743	D582-I586 WeakPolarHBondContact O-CG1 3.06Å; D582-I586 PolarHBondContact O-N 3.28Å; I586-T736 HydrophobicContact CG2-CG2 4.4Å; I586-T736 WeakPolarHBondContact CG2-O 3.36Å; I586-M739 HydrophobicContact CD1-CB 3.76Å; I586-M739 WeakPolarHBondContact CD1-O 3.3Å; I586-M739 HydrophobicContact CG1-CB 4.13Å; I586-M739 HydrophobicContact CG2-CB 4.05Å; I586-T743 HydrophobicContact CD1-CG2 3.4Å
587	L	90.5	Very high	92.5	Very high	43 Å²	43	45.2 Å²	45.2	23%	0.225	23%	0.228	C	C	.	.	H	α-helix	trans	-81.7	-30.7	-173.3	-72.5	175.9	0	0	0	114.6	L583 N585 L662	L583-L587 HydrophobicContact CD1-CD1 4.04Å; L583-L587 HydrophobicContact CD1-CG 4.39Å; L583-L587 HydrophobicContact CG-CD1 4.02Å; L583-L587 WeakPolarHBondContact O-CB 3.46Å; L583-L587 VanDerWaalsContact O-CG 3.25Å; L583-L587 WeakPolarHBondContact O-CG 3.48Å; L583-L587 PolarHBondContact O-N 3.22Å; L583-L587 VanDerWaalsContact O-N 3.11Å; N585-L587 PolarHBondContact O-N 2.9Å; L587-L662 HydrophobicContact CD1-CD1 4.36Å; L587-L662 HydrophobicContact CD1-CD2 4.09Å
588	Y	89.9	Confident	92.8	Very high	22 Å²	22	44.5 Å²	44.5	9%	0.086	23%	0.233	C	C	.	.	H	α-helix	trans	-130.4	-6	-166.9	-51.4	-56.4	0	0	0	115.2	M584 Y651 V655 H658 L659	M584-Y588 HydrophobicContact CB-CD2 4.05Å; M584-Y588 HydrophobicContact CB-CE2 4.45Å; M584-Y588 HydrophobicContact CG-CD2 4.13Å; M584-Y588 HydrophobicContact CG-CE2 4.06Å; M584-Y588 WeakPolarHBondContact O-CB 3.35Å; M584-Y588 PolarHBondContact O-N 3.48Å; Y588-Y651 PolarHBondContact O-OH 2.93Å; Y588-V655 HydrophobicContact CD1-CB 4.31Å; Y588-V655 HydrophobicContact CD1-CG1 4.05Å; Y588-V655 HydrophobicContact CD1-CG2 3.79Å; Y588-V655 HydrophobicContact CD2-CG1 4.06Å; Y588-V655 HydrophobicContact CE1-CB 4.42Å; Y588-V655 HydrophobicContact CE1-CG1 4.1Å; Y588-V655 HydrophobicContact CE1-CG2 4.35Å; Y588-V655 HydrophobicContact CE2-CG1 4.12Å; Y588-V655 HydrophobicContact CG-CG1 4.03Å; Y588-V655 HydrophobicContact CG-CG2 4.11Å; Y588-H658 HydrophobicContact CE1-CB 3.9Å; Y588-H658 AromaticContact CE1-CG 3.99Å; Y588-H658 AromaticContact CE1-ND1 3.53Å; Y588-H658 AromaticContact CZ-ND1 3.53Å; Y588-H658 PolarHBondContact OH-ND1 3.12Å; Y588-L659 HydrophobicContact CE2-CD2 3.64Å; Y588-L659 HydrophobicContact CE2-CG 3.95Å; Y588-L659 PolarHBondContact OH-N 2.82Å
589	D	91.6	Very high	93.1	Very high	74 Å²	74	44.5 Å²	44.5	40%	0.396	23%	0.227	S	C	.	.			trans	59.5	117.6	-162.5	172.5	21.6	0	0	0	112.6	N585 D591 H592 Y593	N585-D589 WeakPolarHBondContact O-CA 3.38Å; N585-D589 PolarHBondContact O-N 2.62Å; D589-D591 PolarHBondContact O-N 2.85Å; D589-D591 PolarHBondContact OD1-N 2.82Å; D589-H592 HydrophobicContact CB-CB 4.11Å; D589-H592 WeakPolarHBondContact OD2-CB 3.37Å; D589-H592 PolarHBondContact OD2-N 3.44Å; D589-H592 VanDerWaalsContact OD2-N 3.11Å; D589-Y593 VanDerWaalsContact O-CB 3.24Å; D589-Y593 WeakPolarHBondContact O-CB 3.24Å; D589-Y593 PolarHBondContact O-N 2.88Å
590	R	91.8	Very high	93.3	Very high	107 Å²	107	44.5 Å²	44.5	40%	0.404	23%	0.227	S	C	.	.	H	α-helix	trans	-56.7	-38.3	177.3	177.1	-179.1	-166.6	-147.7	5.6	112	L573 D574 N585 K594	L573-R590 HydrophobicContact CD1-CB 4.1Å; L573-R590 HydrophobicContact CD1-CG 3.8Å; D574-R590 IonicContact OD1-CZ 3.58Å; D574-R590 IonicContact OD1-NE 3.33Å; D574-R590 IonicContact OD1-NH2 2.69Å; D574-R590 PolarHBondContact OD1-NH2 3.49Å; N585-R590 HydrophobicContact CB-CB 4.32Å; N585-R590 WeakPolarHBondContact OD1-CB 3.02Å; N585-R590 PolarHBondContact OD1-N 3.4Å; R590-K594 HydrophobicContact CG-CD 4.2Å; R590-K594 WeakPolarHBondContact O-CB 3.45Å; R590-K594 VanDerWaalsContact O-CG 3.29Å; R590-K594 WeakPolarHBondContact O-CG 3.46Å; R590-K594 PolarHBondContact O-N 3.33Å
591	D	93.5	Very high	93.5	Very high	100 Å²	100	46.2 Å²	46.2	54%	0.535	24%	0.239	S	C	.	.	H	α-helix	trans	-78.3	-46.2	-174.2	-72.2	-18.8	0	0	0	110.7	D589 Y593 K594 I595	D589-D591 PolarHBondContact O-N 2.85Å; D589-D591 PolarHBondContact OD1-N 2.82Å; D591-Y593 VanDerWaalsContact C-N 3.28Å; D591-Y593 PolarHBondContact O-N 3.34Å; D591-K594 PolarHBondContact O-N 3Å; D591-I595 VanDerWaalsContact O-CB 3.3Å; D591-I595 WeakPolarHBondContact O-CB 3.45Å; D591-I595 WeakPolarHBondContact O-CD1 3.37Å; D591-I595 WeakPolarHBondContact O-CG1 3.22Å; D591-I595 PolarHBondContact O-N 3.25Å
592	H	95.1	Very high	93.8	Very high	93 Å²	93	50.1 Å²	50.1	43%	0.431	26%	0.257	S	S	.	.	H	α-helix	trans	-56.3	-43.5	170.8	-156.2	110.7	0	0	0	112	D589 I595 A596 Y651	D589-H592 HydrophobicContact CB-CB 4.11Å; D589-H592 WeakPolarHBondContact OD2-CB 3.37Å; D589-H592 PolarHBondContact OD2-N 3.44Å; D589-H592 VanDerWaalsContact OD2-N 3.11Å; H592-I595 PolarHBondContact O-N 2.77Å; H592-A596 WeakPolarHBondContact O-CB 3.36Å; H592-A596 PolarHBondContact O-N 2.9Å; H592-Y651 HydrophobicContact CB-CE2 4.4Å; H592-Y651 AromaticContact CD2-CD1 3.82Å; H592-Y651 AromaticContact CD2-CD2 3.53Å; H592-Y651 AromaticContact CD2-CE1 3.74Å; H592-Y651 AromaticContact CD2-CE2 3.42Å; H592-Y651 VanDerWaalsContact CD2-CE2 3.42Å; H592-Y651 WeakPolarHBondContact CD2-CE2 3.32Å; H592-Y651 AromaticContact CD2-CG 3.72Å; H592-Y651 AromaticContact CD2-CZ 3.53Å; H592-Y651 AromaticContact CG-CE2 3.98Å; H592-Y651 AromaticContact NE2-CD2 3.72Å; H592-Y651 AromaticContact NE2-CG 3.82Å
593	Y	95	Very high	94	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-48.7	177.9	-176.5	-97.4	0	0	0	112.5	F570 P571 L573 D589 D591 A596 L597 Y651 V655	F570-Y593 AromaticContact CD1-CE2 3.91Å; F570-Y593 HydrophobicContact CD1-CE2 3.91Å; F570-Y593 HydrophobicContact CE1-CE2 4.47Å; P571-Y593 WeakPolarHBondContact CD-OH 3.3Å; P571-Y593 PolarHBondContact O-OH 2.71Å; L573-Y593 HydrophobicContact CD1-CD1 3.53Å; L573-Y593 HydrophobicContact CD1-CE1 4.06Å; L573-Y593 HydrophobicContact CD1-CG 4.22Å; L573-Y593 HydrophobicContact CD2-CD1 4.3Å; L573-Y593 HydrophobicContact CD2-CE1 4.05Å; L573-Y593 HydrophobicContact CG-CD1 3.76Å; L573-Y593 HydrophobicContact CG-CE1 3.75Å; D589-Y593 VanDerWaalsContact O-CB 3.24Å; D589-Y593 WeakPolarHBondContact O-CB 3.24Å; D589-Y593 PolarHBondContact O-N 2.88Å; D591-Y593 VanDerWaalsContact C-N 3.28Å; D591-Y593 PolarHBondContact O-N 3.34Å; Y593-A596 PolarHBondContact O-N 3.09Å; Y593-L597 HydrophobicContact CD1-CD1 4.01Å; Y593-L597 HydrophobicContact CE1-CD1 3.46Å; Y593-L597 VanDerWaalsContact CE1-CD1 3.46Å; Y593-L597 HydrophobicContact CE2-CD1 4.43Å; Y593-L597 PolarHBondContact O-N 3.33Å; Y593-L597 VanDerWaalsContact O-N 3.12Å; Y593-Y651 WeakPolarHBondContact CA-OH 3.38Å; Y593-Y651 WeakPolarHBondContact CB-OH 3.43Å; Y593-Y651 HydrophobicContact CD2-CE1 4.41Å; Y593-Y651 PolarHBondContact N-OH 3.2Å; Y593-V655 HydrophobicContact CD2-CG1 4.24Å; Y593-V655 HydrophobicContact CE2-CG1 4.02Å
594	K	94.9	Very high	94.2	Very high	70 Å²	70	49.5 Å²	49.5	30%	0.304	25%	0.25	S	C	.	.	H	α-helix	trans	-65.9	-39.9	177.7	-76.9	-176.1	176.8	-163.8	0	112.3	D574 R590 D591 G598	D574-K594 IonicContact OD1-NZ 3.75Å; D574-K594 PolarHBondContact OD1-NZ 3.45Å; D574-K594 WeakPolarHBondContact OD2-CE 3.37Å; D574-K594 IonicContact OD2-NZ 3.8Å; D574-K594 PolarHBondContact OD2-NZ 3.02Å; R590-K594 HydrophobicContact CG-CD 4.2Å; R590-K594 WeakPolarHBondContact O-CB 3.45Å; R590-K594 VanDerWaalsContact O-CG 3.29Å; R590-K594 WeakPolarHBondContact O-CG 3.46Å; R590-K594 PolarHBondContact O-N 3.33Å; D591-K594 PolarHBondContact O-N 3Å; K594-G598 PolarHBondContact O-N 3.12Å
595	I	95.2	Very high	94.5	Very high	98 Å²	98	52.9 Å²	52.9	50%	0.503	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-44.6	176.1	-70.5	164.9	0	0	0	110.2	D591 H592 G598 Q599	D591-I595 VanDerWaalsContact O-CB 3.3Å; D591-I595 WeakPolarHBondContact O-CB 3.45Å; D591-I595 WeakPolarHBondContact O-CD1 3.37Å; D591-I595 WeakPolarHBondContact O-CG1 3.22Å; D591-I595 PolarHBondContact O-N 3.25Å; H592-I595 PolarHBondContact O-N 2.77Å; I595-G598 PolarHBondContact O-N 2.7Å; I595-Q599 HydrophobicContact CG2-CG 4.38Å; I595-Q599 WeakPolarHBondContact O-CB 3.3Å; I595-Q599 VanDerWaalsContact O-CG 3.28Å; I595-Q599 WeakPolarHBondContact O-CG 3.1Å; I595-Q599 PolarHBondContact O-N 2.88Å
596	A	96	Very high	94.7	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-50.1	178.3	0	0	0	0	0	112.1	H592 Y593 G598 Q599 I600 Y651 L652	H592-A596 WeakPolarHBondContact O-CB 3.36Å; H592-A596 PolarHBondContact O-N 2.9Å; Y593-A596 PolarHBondContact O-N 3.09Å; A596-G598 VanDerWaalsContact C-N 3.35Å; A596-G598 PolarHBondContact O-N 2.72Å; A596-Q599 PolarHBondContact O-N 3.26Å; A596-I600 WeakPolarHBondContact O-CG1 3.3Å; A596-I600 PolarHBondContact O-N 3.22Å; A596-Y651 HydrophobicContact CB-CD1 3.78Å; A596-Y651 HydrophobicContact CB-CE1 3.97Å; A596-L652 HydrophobicContact CB-CD2 4.33Å; A596-L652 HydrophobicContact CB-CG 4.22Å
597	L	95.5	Very high	95	Very high	25 Å²	25	51.5 Å²	51.5	13%	0.131	26%	0.26	C	S	.	.	H	α-helix	trans	-64.2	-38.4	175.7	-67.1	176.2	0	0	0	112.1	L567 F570 Y593 Q599 I600 S601 L652	L567-L597 HydrophobicContact CD2-CB 4.25Å; L567-L597 HydrophobicContact CD2-CD2 4.23Å; L567-L597 WeakPolarHBondContact CD2-O 3.22Å; F570-L597 HydrophobicContact CB-CD1 4.32Å; F570-L597 HydrophobicContact CB-CD2 4.01Å; F570-L597 HydrophobicContact CG-CD2 4.24Å; Y593-L597 HydrophobicContact CD1-CD1 4.01Å; Y593-L597 HydrophobicContact CE1-CD1 3.46Å; Y593-L597 VanDerWaalsContact CE1-CD1 3.46Å; Y593-L597 HydrophobicContact CE2-CD1 4.43Å; Y593-L597 PolarHBondContact O-N 3.33Å; Y593-L597 VanDerWaalsContact O-N 3.12Å; L597-Q599 PolarHBondContact O-N 3.45Å; L597-I600 PolarHBondContact O-N 2.95Å; L597-S601 PolarHBondContact O-N 3.17Å; L597-L652 HydrophobicContact CD2-CD1 4.04Å; L597-L652 HydrophobicContact CD2-CD2 3.86Å; L597-L652 HydrophobicContact CG-CD2 4.23Å
598	G	95.6	Very high	95.3	Very high	31 Å²	31	50.6 Å²	50.6	32%	0.32	26%	0.256	S	S	.	.	H	α-helix	trans	-58.6	-46	173.9	0	0	0	0	0	112.6	K594 I595 A596 I600 S601 I602	K594-G598 PolarHBondContact O-N 3.12Å; I595-G598 PolarHBondContact O-N 2.7Å; A596-G598 VanDerWaalsContact C-N 3.35Å; A596-G598 PolarHBondContact O-N 2.72Å; G598-I600 VanDerWaalsContact C-N 3.32Å; G598-I600 PolarHBondContact O-N 2.83Å; G598-S601 WeakPolarHBondContact O-CB 3.4Å; G598-S601 PolarHBondContact O-N 2.97Å; G598-I602 VanDerWaalsContact O-CG1 3.29Å; G598-I602 WeakPolarHBondContact O-CG1 3.44Å; G598-I602 PolarHBondContact O-N 3.25Å
599	Q	96.2	Very high	95.7	Very high	67 Å²	67	53.1 Å²	53.1	31%	0.313	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-37.8	175.8	-74.1	174.8	9.7	0	0	112.7	I595 A596 L597 A603 Q645 S648	I595-Q599 HydrophobicContact CG2-CG 4.38Å; I595-Q599 WeakPolarHBondContact O-CB 3.3Å; I595-Q599 VanDerWaalsContact O-CG 3.28Å; I595-Q599 WeakPolarHBondContact O-CG 3.1Å; I595-Q599 PolarHBondContact O-N 2.88Å; A596-Q599 PolarHBondContact O-N 3.26Å; L597-Q599 PolarHBondContact O-N 3.45Å; Q599-A603 VanDerWaalsContact O-CB 3.3Å; Q599-A603 WeakPolarHBondContact O-CB 3.48Å; Q599-A603 PolarHBondContact O-N 3.11Å; Q599-Q645 PolarHBondContact O-NE2 3.08Å; Q599-S648 VanDerWaalsContact OE1-CB 3.26Å; Q599-S648 PolarHBondContact OE1-OG 3.44Å
600	I	96.1	Very high	96	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-41.8	174.1	-64	-58.1	0	0	0	111.4	L563 L567 A596 L597 G598 A603 R604 Q645 L649 L652	L563-I600 HydrophobicContact CB-CG2 4.08Å; L563-I600 HydrophobicContact CD2-CG2 4.15Å; L567-I600 HydrophobicContact CD1-CG2 4.33Å; L567-I600 HydrophobicContact CD2-CB 4.16Å; L567-I600 HydrophobicContact CD2-CG2 3.98Å; L567-I600 HydrophobicContact CG-CG2 3.97Å; A596-I600 WeakPolarHBondContact O-CG1 3.3Å; A596-I600 PolarHBondContact O-N 3.22Å; L597-I600 PolarHBondContact O-N 2.95Å; G598-I600 VanDerWaalsContact C-N 3.32Å; G598-I600 PolarHBondContact O-N 2.83Å; I600-A603 PolarHBondContact O-N 2.99Å; I600-R604 PolarHBondContact O-N 3.17Å; I600-Q645 HydrophobicContact CD1-CB 4.23Å; I600-L649 HydrophobicContact CD1-CD2 3.69Å; I600-L649 HydrophobicContact CD1-CG 4Å; I600-L652 HydrophobicContact CG1-CD1 4Å
601	S	96.3	Very high	96.3	Very high	37 Å²	37	45.2 Å²	45.2	26%	0.259	24%	0.237	S	C	.	.	H	α-helix	trans	-62.9	-45.2	175.2	-173.6	0	0	0	0	112.4	L597 G598 A603 R604 N605	L597-S601 PolarHBondContact O-N 3.17Å; G598-S601 WeakPolarHBondContact O-CB 3.4Å; G598-S601 PolarHBondContact O-N 2.97Å; S601-A603 VanDerWaalsContact C-N 3.35Å; S601-A603 PolarHBondContact O-N 3.18Å; S601-R604 WeakPolarHBondContact O-CB 3.26Å; S601-R604 PolarHBondContact O-N 3.32Å; S601-N605 VanDerWaalsContact O-CG 3.25Å; S601-N605 PolarHBondContact O-N 2.77Å; S601-N605 VanDerWaalsContact O-N 3.14Å; S601-N605 PolarHBondContact O-OD1 2.81Å
602	I	97.5	Very high	96.4	Very high	99 Å²	99	46.1 Å²	46.1	51%	0.508	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-44.8	173.6	-65.2	166.5	0	0	0	110.2	G598 R604 N605 L606	G598-I602 VanDerWaalsContact O-CG1 3.29Å; G598-I602 WeakPolarHBondContact O-CG1 3.44Å; G598-I602 PolarHBondContact O-N 3.25Å; I602-R604 PolarHBondContact O-N 2.89Å; I602-N605 PolarHBondContact O-N 3.21Å; I602-L606 HydrophobicContact CG2-CD1 3.88Å; I602-L606 HydrophobicContact CG2-CG 4.27Å; I602-L606 WeakPolarHBondContact O-CB 3.48Å; I602-L606 WeakPolarHBondContact O-CG 3.43Å; I602-L606 PolarHBondContact O-N 2.97Å
603	A	96.6	Very high	96.5	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-41.5	178.8	0	0	0	0	0	112.8	L563 Q599 I600 S601 L606 V607 I641 Q645	L563-A603 HydrophobicContact CD1-CB 4.26Å; Q599-A603 VanDerWaalsContact O-CB 3.3Å; Q599-A603 WeakPolarHBondContact O-CB 3.48Å; Q599-A603 PolarHBondContact O-N 3.11Å; I600-A603 PolarHBondContact O-N 2.99Å; S601-A603 VanDerWaalsContact C-N 3.35Å; S601-A603 PolarHBondContact O-N 3.18Å; A603-L606 PolarHBondContact O-N 3.34Å; A603-V607 WeakPolarHBondContact O-CG2 3.34Å; A603-V607 PolarHBondContact O-N 3.21Å; A603-I641 HydrophobicContact CB-CG2 3.85Å; A603-Q645 HydrophobicContact CB-CG 3.83Å
604	R	96.3	Very high	96.7	Very high	58 Å²	58	45.9 Å²	45.9	22%	0.219	24%	0.235	C	C	.	.	H	α-helix	trans	-56.7	-52.8	172.8	-179.3	-173.7	67.7	-176.7	-3.4	111	L563 S564 I600 S601 I602 L606 V607 D608	L563-R604 HydrophobicContact CB-CB 4.28Å; L563-R604 HydrophobicContact CD1-CB 4.16Å; S564-R604 WeakPolarHBondContact OG-CD 3.16Å; S564-R604 PolarHBondContact OG-NH1 3.01Å; I600-R604 PolarHBondContact O-N 3.17Å; S601-R604 WeakPolarHBondContact O-CB 3.26Å; S601-R604 PolarHBondContact O-N 3.32Å; I602-R604 PolarHBondContact O-N 2.89Å; R604-L606 VanDerWaalsContact C-N 3.33Å; R604-L606 PolarHBondContact O-N 2.98Å; R604-V607 PolarHBondContact O-N 3.11Å; R604-D608 PolarHBondContact O-N 3.31Å; R604-D608 VanDerWaalsContact O-N 3.16Å
605	N	97.2	Very high	96.7	Very high	74 Å²	74	43.7 Å²	43.7	40%	0.396	23%	0.228	S	C	.	.	H	α-helix	trans	-63.7	-38	-176.7	-61.2	-10.4	0	0	0	112	S601 I602 D608 N609	S601-N605 VanDerWaalsContact O-CG 3.25Å; S601-N605 PolarHBondContact O-N 2.77Å; S601-N605 VanDerWaalsContact O-N 3.14Å; S601-N605 PolarHBondContact O-OD1 2.81Å; I602-N605 PolarHBondContact O-N 3.21Å; N605-D608 PolarHBondContact O-N 3.4Å; N605-N609 PolarHBondContact O-N 3.15Å; N605-N609 VanDerWaalsContact O-N 3.1Å
606	L	97.3	Very high	96.8	Very high	76 Å²	76	46.6 Å²	46.6	40%	0.398	23%	0.232	S	C	.	.	H	α-helix	trans	-64.3	-41	174.6	-72.6	173.2	0	0	0	112.5	I602 A603 R604 D608 N609 V610 I641	I602-L606 HydrophobicContact CG2-CD1 3.88Å; I602-L606 HydrophobicContact CG2-CG 4.27Å; I602-L606 WeakPolarHBondContact O-CB 3.48Å; I602-L606 WeakPolarHBondContact O-CG 3.43Å; I602-L606 PolarHBondContact O-N 2.97Å; A603-L606 PolarHBondContact O-N 3.34Å; R604-L606 VanDerWaalsContact C-N 3.33Å; R604-L606 PolarHBondContact O-N 2.98Å; L606-D608 VanDerWaalsContact C-N 3.33Å; L606-D608 PolarHBondContact O-N 2.9Å; L606-N609 PolarHBondContact O-N 2.96Å; L606-V610 WeakPolarHBondContact O-CG2 3.46Å; L606-V610 PolarHBondContact O-N 2.96Å; L606-I641 HydrophobicContact CB-CD1 3.92Å
607	V	97.4	Very high	96.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-39.2	177.7	166	0	0	0	0	111.5	Q556 I559 A603 R604 S611 M638 I641	Q556-V607 HydrophobicContact CB-CG1 4.11Å; Q556-V607 HydrophobicContact CG-CG1 4.02Å; I559-V607 HydrophobicContact CB-CG1 4.11Å; I559-V607 HydrophobicContact CD1-CG1 4.11Å; I559-V607 HydrophobicContact CG2-CB 4.41Å; I559-V607 HydrophobicContact CG2-CG1 4.02Å; I559-V607 HydrophobicContact CG2-CG2 4.13Å; A603-V607 WeakPolarHBondContact O-CG2 3.34Å; A603-V607 PolarHBondContact O-N 3.21Å; R604-V607 PolarHBondContact O-N 3.11Å; V607-S611 PolarHBondContact O-N 2.85Å; V607-M638 HydrophobicContact CG1-CG 4.22Å; V607-M638 HydrophobicContact CG1-SD 4.43Å; V607-I641 HydrophobicContact CG2-CB 4.36Å; V607-I641 HydrophobicContact CG2-CD1 4.08Å; V607-I641 HydrophobicContact CG2-CG2 4.07Å
608	D	97.3	Very high	96.8	Very high	25 Å²	25	49.4 Å²	49.4	13%	0.134	25%	0.247	C	C	.	.	H	α-helix	trans	-65	-41.5	174.6	-71	-17.6	0	0	0	112.3	Q556 H560 R604 N605 L606 S611 K612	Q556-D608 VanDerWaalsContact CG-OD1 3.29Å; Q556-D608 WeakPolarHBondContact CG-OD1 3.36Å; Q556-D608 PolarHBondContact NE2-OD1 3.06Å; H560-D608 IonicContact CD2-OD1 3.81Å; H560-D608 IonicContact CD2-OD2 3.33Å; H560-D608 PolarHBondContact CD2-OD2 2.97Å; R604-D608 PolarHBondContact O-N 3.31Å; R604-D608 VanDerWaalsContact O-N 3.16Å; N605-D608 PolarHBondContact O-N 3.4Å; L606-D608 VanDerWaalsContact C-N 3.33Å; L606-D608 PolarHBondContact O-N 2.9Å; D608-S611 WeakPolarHBondContact O-CB 3.43Å; D608-S611 PolarHBondContact O-N 3.4Å; D608-K612 VanDerWaalsContact O-CG 3.28Å; D608-K612 WeakPolarHBondContact O-CG 3.44Å; D608-K612 PolarHBondContact O-N 2.94Å
609	N	97.7	Very high	96.7	Very high	74 Å²	74	54.6 Å²	54.6	40%	0.396	26%	0.261	S	S	.	.	H	α-helix	trans	-66.6	-43.3	178.2	-70.3	-13.7	0	0	0	111.9	N605 L606 S611 K612 E613	N605-N609 PolarHBondContact O-N 3.15Å; N605-N609 VanDerWaalsContact O-N 3.1Å; L606-N609 PolarHBondContact O-N 2.96Å; N609-S611 VanDerWaalsContact C-N 3.29Å; N609-S611 PolarHBondContact O-N 3.1Å; N609-K612 PolarHBondContact O-N 3.32Å; N609-K612 VanDerWaalsContact O-N 3.14Å; N609-K612 PolarHBondContact OD1-NZ 3.13Å; N609-E613 PolarHBondContact O-N 3Å
610	V	97.5	Very high	96.7	Very high	12 Å²	12	59.6 Å²	59.6	7%	0.073	28%	0.278	C	S	.	.	H	α-helix	trans	-57.2	-42	171.6	171.4	0	0	0	0	111.1	L606 Y614 R637 M638 I641	L606-V610 WeakPolarHBondContact O-CG2 3.46Å; L606-V610 PolarHBondContact O-N 2.96Å; V610-Y614 HydrophobicContact CG1-CD2 3.75Å; V610-Y614 HydrophobicContact CG1-CE2 4.01Å; V610-Y614 WeakPolarHBondContact O-CD2 3.42Å; V610-Y614 PolarHBondContact O-N 3.06Å; V610-R637 HydrophobicContact CG1-CB 3.89Å; V610-R637 HydrophobicContact CG2-CB 4.34Å; V610-M638 HydrophobicContact CB-CE 4.49Å; V610-M638 HydrophobicContact CG1-CE 4.06Å; V610-M638 HydrophobicContact CG1-CG 4.04Å; V610-I641 HydrophobicContact CG2-CD1 3.98Å
611	S	97.2	Very high	96.6	Very high	4 Å²	4	59.5 Å²	59.5	3%	0.028	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-45	175.6	-170.7	0	0	0	0	112.3	Q556 V607 D608 N609 T615	Q556-S611 PolarHBondContact OE1-OG 3.01Å; V607-S611 PolarHBondContact O-N 2.85Å; D608-S611 WeakPolarHBondContact O-CB 3.43Å; D608-S611 PolarHBondContact O-N 3.4Å; N609-S611 VanDerWaalsContact C-N 3.29Å; N609-S611 PolarHBondContact O-N 3.1Å; S611-T615 WeakPolarHBondContact O-CB 3.49Å; S611-T615 VanDerWaalsContact O-CG2 3.25Å; S611-T615 WeakPolarHBondContact O-CG2 3.5Å; S611-T615 PolarHBondContact O-N 3.26Å; S611-T615 PolarHBondContact O-OG1 2.96Å
612	K	96.8	Very high	96.4	Very high	118 Å²	118	61.9 Å²	61.9	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-61.9	-45.7	177.4	-68.5	164.3	-166.4	164.6	0	111.9	D608 N609 T615 R616	D608-K612 VanDerWaalsContact O-CG 3.28Å; D608-K612 WeakPolarHBondContact O-CG 3.44Å; D608-K612 PolarHBondContact O-N 2.94Å; N609-K612 PolarHBondContact O-N 3.32Å; N609-K612 VanDerWaalsContact O-N 3.14Å; N609-K612 PolarHBondContact OD1-NZ 3.13Å; K612-T615 PolarHBondContact O-OG1 3.1Å; K612-R616 WeakPolarHBondContact O-CB 3.3Å; K612-R616 PolarHBondContact O-N 3.41Å; K612-R616 VanDerWaalsContact O-N 3.08Å
613	E	97.5	Very high	96.3	Very high	81 Å²	81	59.2 Å²	59.2	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-59.4	-56.4	175.9	-75.9	172.3	-153.2	0	0	112	N609 T615 R616 L617 R637	N609-E613 PolarHBondContact O-N 3Å; E613-T615 PolarHBondContact O-N 3.37Å; E613-R616 WeakPolarHBondContact O-CA 3.27Å; E613-R616 WeakPolarHBondContact O-CB 3.46Å; E613-R616 PolarHBondContact O-N 2.96Å; E613-R616 VanDerWaalsContact O-N 3.1Å; E613-L617 WeakPolarHBondContact O-CG 3.46Å; E613-L617 PolarHBondContact O-N 3.19Å; E613-R637 IonicContact OE2-NH1 3.84Å; E613-R637 PolarHBondContact OE2-NH1 2.8Å
614	Y	97.8	Very high	96.2	Very high	12 Å²	12	61.3 Å²	61.3	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-68.2	-33.9	-175.1	-85.5	-77.1	0	0	0	113	V610 R616 L617 M618 L630 A633 A634 R637	V610-Y614 HydrophobicContact CG1-CD2 3.75Å; V610-Y614 HydrophobicContact CG1-CE2 4.01Å; V610-Y614 WeakPolarHBondContact O-CD2 3.42Å; V610-Y614 PolarHBondContact O-N 3.06Å; Y614-R616 VanDerWaalsContact C-N 3.3Å; Y614-L617 HydrophobicContact CD1-CD1 4.39Å; Y614-L617 PolarHBondContact O-N 2.99Å; Y614-M618 WeakPolarHBondContact O-CB 3.21Å; Y614-M618 VanDerWaalsContact O-CG 3.23Å; Y614-M618 WeakPolarHBondContact O-CG 3.42Å; Y614-M618 PolarHBondContact O-N 2.71Å; Y614-L630 HydrophobicContact CD1-CB 4.3Å; Y614-L630 HydrophobicContact CD1-CD2 4.04Å; Y614-L630 WeakPolarHBondContact CD1-O 3.44Å; Y614-L630 HydrophobicContact CE1-CD2 4.01Å; Y614-L630 WeakPolarHBondContact CE1-O 3.44Å; Y614-A633 HydrophobicContact CE1-CB 3.83Å; Y614-A633 WeakPolarHBondContact OH-CB 3.38Å; Y614-A634 HydrophobicContact CD1-CB 3.86Å; Y614-A634 HydrophobicContact CD2-CB 3.59Å; Y614-A634 HydrophobicContact CE1-CB 4.34Å; Y614-A634 HydrophobicContact CE2-CB 4.08Å; Y614-A634 HydrophobicContact CG-CB 3.45Å; Y614-A634 VanDerWaalsContact CG-CB 3.45Å; Y614-R637 HydrophobicContact CE2-CG 4.29Å; Y614-R637 VanDerWaalsContact OH-CZ 3.27Å; Y614-R637 PolarHBondContact OH-NE 2.67Å; Y614-R637 PolarHBondContact OH-NH2 3.11Å
615	T	96.1	Very high	96.2	Very high	24 Å²	24	66.3 Å²	66.3	15%	0.147	31%	0.308	C	S	.	.	H	α-helix	trans	-70.7	-26.7	173.5	56.1	0	0	0	0	112.6	V552 K553 S611 K612 E613	V552-T615 HydrophobicContact CG1-CG2 4.38Å; K553-T615 HydrophobicContact CD-CG2 4.49Å; K553-T615 HydrophobicContact CG-CG2 3.88Å; S611-T615 WeakPolarHBondContact O-CB 3.49Å; S611-T615 VanDerWaalsContact O-CG2 3.25Å; S611-T615 WeakPolarHBondContact O-CG2 3.5Å; S611-T615 PolarHBondContact O-N 3.26Å; S611-T615 PolarHBondContact O-OG1 2.96Å; K612-T615 PolarHBondContact O-OG1 3.1Å; E613-T615 PolarHBondContact O-N 3.37Å
616	R	96.4	Very high	96.2	Very high	159 Å²	159	69 Å²	69	60%	0.6	31%	0.313	S	S	*	.	H	α-helix	trans	-69	-49.6	168.4	-168.9	-173.5	-62.9	155.4	-1.4	111	K612 E613 Y614 M618 K619	K612-R616 WeakPolarHBondContact O-CB 3.3Å; K612-R616 PolarHBondContact O-N 3.41Å; K612-R616 VanDerWaalsContact O-N 3.08Å; E613-R616 WeakPolarHBondContact O-CA 3.27Å; E613-R616 WeakPolarHBondContact O-CB 3.46Å; E613-R616 PolarHBondContact O-N 2.96Å; E613-R616 VanDerWaalsContact O-N 3.1Å; Y614-R616 VanDerWaalsContact C-N 3.3Å; R616-M618 VanDerWaalsContact C-N 3.33Å; R616-M618 PolarHBondContact O-N 2.77Å; R616-K619 VanDerWaalsContact O-CB 3.32Å; R616-K619 WeakPolarHBondContact O-CB 3.28Å; R616-K619 PolarHBondContact O-N 3.44Å; R616-K619 VanDerWaalsContact O-N 3.17Å
617	L	96.4	Very high	96.1	Very high	84 Å²	84	65.4 Å²	65.4	44%	0.44	29%	0.294	S	S	.	.	H	α-helix	trans	-61.1	-38.4	177.8	-68.7	171.9	0	0	0	112.7	E613 Y614 K619 Y620 L630	E613-L617 WeakPolarHBondContact O-CG 3.46Å; E613-L617 PolarHBondContact O-N 3.19Å; Y614-L617 HydrophobicContact CD1-CD1 4.39Å; Y614-L617 PolarHBondContact O-N 2.99Å; L617-K619 PolarHBondContact O-N 3.36Å; L617-Y620 PolarHBondContact O-N 3.32Å; L617-Y620 VanDerWaalsContact O-N 3.09Å; L617-L630 HydrophobicContact CB-CD1 4.31Å; L617-L630 HydrophobicContact CB-CD2 4.15Å; L617-L630 HydrophobicContact CD1-CD2 4.34Å
618	M	94.9	Very high	96.1	Very high	1 Å²	1	70.1 Å²	70.1	1%	0.005	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-62.2	-21.5	177.5	-79.6	-178.2	-177.4	0	0	113.9	R545 V552 Y614 R616 Y620 G621 L630 K631	R545-M618 WeakPolarHBondContact CD-O 3.46Å; R545-M618 WeakPolarHBondContact CG-O 3.48Å; V552-M618 HydrophobicContact CG2-CE 3.61Å; V552-M618 HydrophobicContact CG2-SD 4.35Å; Y614-M618 WeakPolarHBondContact O-CB 3.21Å; Y614-M618 VanDerWaalsContact O-CG 3.23Å; Y614-M618 WeakPolarHBondContact O-CG 3.42Å; Y614-M618 PolarHBondContact O-N 2.71Å; R616-M618 VanDerWaalsContact C-N 3.33Å; R616-M618 PolarHBondContact O-N 2.77Å; M618-Y620 PolarHBondContact O-N 3.39Å; M618-G621 PolarHBondContact O-N 3.02Å; M618-L630 HydrophobicContact CE-CB 3.92Å; M618-L630 HydrophobicContact CG-CB 4.12Å; M618-L630 HydrophobicContact CG-CD1 4.01Å; M618-K631 HydrophobicContact CE-CB 3.69Å
619	K	95	Very high	96.1	Very high	140 Å²	140	71.7 Å²	71.7	61%	0.609	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-60.8	-30.1	173.8	-64.9	-176.7	177.3	-174.2	0	112.4	R545 R616 L617	R545-K619 PolarHBondContact NE-O 3.06Å; R545-K619 PolarHBondContact NH1-O 3.4Å; R616-K619 VanDerWaalsContact O-CB 3.32Å; R616-K619 WeakPolarHBondContact O-CB 3.28Å; R616-K619 PolarHBondContact O-N 3.44Å; R616-K619 VanDerWaalsContact O-N 3.17Å; L617-K619 PolarHBondContact O-N 3.36Å
620	Y	94.8	Very high	96.1	Very high	171 Å²	171	69.7 Å²	69.7	67%	0.671	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-99.1	8.8	-178.3	-51.7	-74.2	0	0	0	113.2	L617 M618 D622	L617-Y620 PolarHBondContact O-N 3.32Å; L617-Y620 VanDerWaalsContact O-N 3.09Å; M618-Y620 PolarHBondContact O-N 3.39Å; Y620-D622 PolarHBondContact O-N 3.16Å
621	G	93.8	Very high	96.1	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	32%	0.317	C	S	.	.			trans	-67.9	115	176.2	0	0	0	0	0	111.6	I541 R545 M618	I541-G621 WeakPolarHBondContact CD1-O 3.41Å; I541-G621 WeakPolarHBondContact CG1-O 3.44Å; R545-G621 PolarHBondContact NE-O 3.04Å; R545-G621 PolarHBondContact NH2-O 2.9Å; M618-G621 PolarHBondContact O-N 3.02Å
622	D	93.4	Very high	96.1	Very high	87 Å²	87	78.4 Å²	78.4	47%	0.465	34%	0.343	S	S	.	.			trans	-72.5	-34.5	177.3	42.4	41.2	0	0	0	114.1	I541 Y620 R626	I541-D622 WeakPolarHBondContact CD1-O 3.16Å; Y620-D622 PolarHBondContact O-N 3.16Å; D622-R626 VanDerWaalsContact CG-CD 3.47Å; D622-R626 VanDerWaalsContact OD1-CB 3.29Å; D622-R626 WeakPolarHBondContact OD1-CB 3.41Å; D622-R626 WeakPolarHBondContact OD1-CD 3.41Å; D622-R626 WeakPolarHBondContact OD2-CD 3.42Å; D622-R626 IonicContact OD2-CZ 3.71Å; D622-R626 IonicContact OD2-NE 2.92Å; D622-R626 IonicContact OD2-NH1 2.7Å; D622-R626 PolarHBondContact OD2-NH1 3.07Å
623	S	94	Very high	96.1	Very high	43 Å²	43	74.8 Å²	74.8	30%	0.301	34%	0.335	S	S	.	.	S	Bend	trans	-137.5	157.9	-162.1	61.4	0	0	0	0	112.7	Y625 R626 C627	S623-Y625 PolarHBondContact O-N 3.35Å; S623-R626 PolarHBondContact O-N 2.85Å; S623-R626 VanDerWaalsContact OG-CB 3.26Å; S623-R626 WeakPolarHBondContact OG-CB 3.25Å; S623-R626 PolarHBondContact OG-N 3.45Å; S623-R626 VanDerWaalsContact OG-N 3.12Å; S623-C627 PolarHBondContact O-N 3.07Å; S623-C627 PolarHBondContact O-SG 3.43Å
624	L	95.7	Very high	96.1	Very high	45 Å²	45	71 Å²	71	24%	0.236	32%	0.317	C	S	.	.	H	α-helix	trans	-53.9	-40.3	171.7	-172.7	77.9	0	0	0	111.4	I535 R537 I544 Y548 K628	I535-L624 HydrophobicContact CG1-CD1 4.17Å; I535-L624 HydrophobicContact CG2-CD1 4.04Å; R537-L624 HydrophobicContact CB-CD2 4.17Å; I544-L624 HydrophobicContact CD1-CB 4.3Å; I544-L624 HydrophobicContact CD1-CD1 4.07Å; I544-L624 HydrophobicContact CG1-CD1 4.12Å; I544-L624 HydrophobicContact CG2-CD1 4.02Å; Y548-L624 HydrophobicContact CE2-CD1 3.93Å; L624-K628 WeakPolarHBondContact O-CB 3.21Å; L624-K628 PolarHBondContact O-N 2.85Å
625	Y	96.6	Very high	96.1	Very high	162 Å²	162	71.5 Å²	71.5	64%	0.635	32%	0.321	S	S	*	.	H	α-helix	trans	-65.2	-52.1	-179.9	-176.4	-98.3	0	0	0	111.9	S623 C627 K628 M629	S623-Y625 PolarHBondContact O-N 3.35Å; Y625-C627 PolarHBondContact O-N 3.36Å; Y625-K628 WeakPolarHBondContact O-CB 3.35Å; Y625-K628 PolarHBondContact O-N 2.89Å; Y625-K628 VanDerWaalsContact O-N 3.12Å; Y625-M629 HydrophobicContact CD1-CG 4.42Å; Y625-M629 HydrophobicContact CD2-CE 4.11Å; Y625-M629 HydrophobicContact CE1-CE 4.45Å; Y625-M629 HydrophobicContact CE1-CG 4.09Å; Y625-M629 HydrophobicContact CE2-CE 3.33Å; Y625-M629 HydrophobicContact CE2-CG 4.41Å; Y625-M629 WeakPolarHBondContact O-CG 3.44Å; Y625-M629 PolarHBondContact O-N 3.4Å
626	R	96	Very high	96.1	Very high	132 Å²	132	72.2 Å²	72.2	50%	0.498	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-44.8	179	-167.2	171.1	-173.6	160	4.7	111.4	D622 S623 M629 L630	D622-R626 VanDerWaalsContact CG-CD 3.47Å; D622-R626 VanDerWaalsContact OD1-CB 3.29Å; D622-R626 WeakPolarHBondContact OD1-CB 3.41Å; D622-R626 WeakPolarHBondContact OD1-CD 3.41Å; D622-R626 WeakPolarHBondContact OD2-CD 3.42Å; D622-R626 IonicContact OD2-CZ 3.71Å; D622-R626 IonicContact OD2-NE 2.92Å; D622-R626 IonicContact OD2-NH1 2.7Å; D622-R626 PolarHBondContact OD2-NH1 3.07Å; S623-R626 PolarHBondContact O-N 2.85Å; S623-R626 VanDerWaalsContact OG-CB 3.26Å; S623-R626 WeakPolarHBondContact OG-CB 3.25Å; S623-R626 PolarHBondContact OG-N 3.45Å; S623-R626 VanDerWaalsContact OG-N 3.12Å; R626-M629 PolarHBondContact O-N 3.33Å; R626-L630 WeakPolarHBondContact O-CG 3.13Å; R626-L630 PolarHBondContact O-N 2.85Å
627	C	96.8	Very high	96.2	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-66.3	-37.7	175	-63.4	0	0	0	0	113.2	I544 Y548 S623 Y625 M629 K631	I544-C627 HydrophobicContact CG2-CB 3.99Å; Y548-C627 HydrophobicContact CD2-CB 3.39Å; Y548-C627 HydrophobicContact CE2-CB 3.9Å; Y548-C627 HydrophobicContact CG-CB 4.24Å; S623-C627 PolarHBondContact O-N 3.07Å; S623-C627 PolarHBondContact O-SG 3.43Å; Y625-C627 PolarHBondContact O-N 3.36Å; C627-M629 VanDerWaalsContact C-N 3.34Å; C627-M629 PolarHBondContact O-N 3.02Å; C627-K631 WeakPolarHBondContact O-CB 3.38Å; C627-K631 PolarHBondContact O-N 2.43Å
628	K	97	Very high	96.2	Very high	98 Å²	98	65.9 Å²	65.9	43%	0.426	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-40.5	175.1	-178.5	-179.4	177.2	-176.4	0	111.4	Y548 L624 Y625 K631 R632	Y548-K628 HydrophobicContact CE1-CB 4.5Å; Y548-K628 HydrophobicContact CE2-CB 4.35Å; L624-K628 WeakPolarHBondContact O-CB 3.21Å; L624-K628 PolarHBondContact O-N 2.85Å; Y625-K628 WeakPolarHBondContact O-CB 3.35Å; Y625-K628 PolarHBondContact O-N 2.89Å; Y625-K628 VanDerWaalsContact O-N 3.12Å; K628-K631 PolarHBondContact O-N 3.11Å; K628-R632 WeakPolarHBondContact O-CG 3.46Å; K628-R632 PolarHBondContact O-N 3.46Å
629	M	97.3	Very high	96.3	Very high	58 Å²	58	66.5 Å²	66.5	29%	0.286	31%	0.307	S	S	.	.	H	α-helix	trans	-72.9	-44.4	178.2	-66.2	-50.2	175.2	0	0	112.6	Y625 R626 C627 K631 R632 A633	Y625-M629 HydrophobicContact CD1-CG 4.42Å; Y625-M629 HydrophobicContact CD2-CE 4.11Å; Y625-M629 HydrophobicContact CE1-CE 4.45Å; Y625-M629 HydrophobicContact CE1-CG 4.09Å; Y625-M629 HydrophobicContact CE2-CE 3.33Å; Y625-M629 HydrophobicContact CE2-CG 4.41Å; Y625-M629 WeakPolarHBondContact O-CG 3.44Å; Y625-M629 PolarHBondContact O-N 3.4Å; R626-M629 PolarHBondContact O-N 3.33Å; C627-M629 VanDerWaalsContact C-N 3.34Å; C627-M629 PolarHBondContact O-N 3.02Å; M629-K631 PolarHBondContact O-N 3.44Å; M629-R632 PolarHBondContact O-N 3.4Å; M629-A633 PolarHBondContact O-N 3.33Å
630	L	97.3	Very high	96.4	Very high	33 Å²	33	67.2 Å²	67.2	17%	0.173	31%	0.31	C	S	.	.	H	α-helix	trans	-54.2	-41.6	170.7	-73.3	174	0	0	0	111.5	Y614 L617 M618 R626 A633 A634	Y614-L630 HydrophobicContact CD1-CB 4.3Å; Y614-L630 HydrophobicContact CD1-CD2 4.04Å; Y614-L630 WeakPolarHBondContact CD1-O 3.44Å; Y614-L630 HydrophobicContact CE1-CD2 4.01Å; Y614-L630 WeakPolarHBondContact CE1-O 3.44Å; L617-L630 HydrophobicContact CB-CD1 4.31Å; L617-L630 HydrophobicContact CB-CD2 4.15Å; L617-L630 HydrophobicContact CD1-CD2 4.34Å; M618-L630 HydrophobicContact CE-CB 3.92Å; M618-L630 HydrophobicContact CG-CB 4.12Å; M618-L630 HydrophobicContact CG-CD1 4.01Å; R626-L630 WeakPolarHBondContact O-CG 3.13Å; R626-L630 PolarHBondContact O-N 2.85Å; L630-A633 PolarHBondContact O-N 3.36Å; L630-A634 WeakPolarHBondContact O-CB 3.46Å; L630-A634 PolarHBondContact O-N 3.24Å
631	K	97.3	Very high	96.4	Very high	44 Å²	44	60.3 Å²	60.3	19%	0.191	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-43.9	175.1	-179.5	-93.8	-60.8	-176.3	0	112.5	Y548 K551 V552 M618 C627 K628 M629 A633 A634 L635	Y548-K631 HydrophobicContact CD1-CB 3.85Å; Y548-K631 HydrophobicContact CD1-CD 4.32Å; Y548-K631 HydrophobicContact CD1-CG 3.86Å; Y548-K631 HydrophobicContact CG-CB 4.24Å; K551-K631 HydrophobicContact CB-CG 4.49Å; V552-K631 HydrophobicContact CG2-CG 4.34Å; M618-K631 HydrophobicContact CE-CB 3.69Å; C627-K631 WeakPolarHBondContact O-CB 3.38Å; C627-K631 PolarHBondContact O-N 2.43Å; K628-K631 PolarHBondContact O-N 3.11Å; M629-K631 PolarHBondContact O-N 3.44Å; K631-A633 VanDerWaalsContact C-N 3.33Å; K631-A633 PolarHBondContact O-N 3.19Å; K631-A634 PolarHBondContact O-N 2.84Å; K631-L635 HydrophobicContact CD-CD1 3.65Å; K631-L635 HydrophobicContact CD-CG 4.38Å; K631-L635 HydrophobicContact CG-CD1 4.19Å; K631-L635 HydrophobicContact CG-CG 4.49Å; K631-L635 WeakPolarHBondContact O-CG 3.42Å; K631-L635 PolarHBondContact O-N 3.38Å; K631-L635 VanDerWaalsContact O-N 3.17Å
632	R	96.9	Very high	96.5	Very high	155 Å²	155	60.5 Å²	60.5	59%	0.585	29%	0.286	S	S	*	.	H	α-helix	trans	-59.6	-46	176.3	-76.6	178.6	76.7	-172.7	7	110.9	K628 M629 G636	K628-R632 WeakPolarHBondContact O-CG 3.46Å; K628-R632 PolarHBondContact O-N 3.46Å; M629-R632 PolarHBondContact O-N 3.4Å; R632-G636 PolarHBondContact O-N 3.44Å
633	A	97.6	Very high	96.5	Very high	42 Å²	42	58.9 Å²	58.9	35%	0.347	28%	0.279	S	S	.	.	H	α-helix	trans	-66.6	-41.7	-178.9	0	0	0	0	0	112.1	Y614 M629 L630 K631 G636 R637	Y614-A633 HydrophobicContact CE1-CB 3.83Å; Y614-A633 WeakPolarHBondContact OH-CB 3.38Å; M629-A633 PolarHBondContact O-N 3.33Å; L630-A633 PolarHBondContact O-N 3.36Å; K631-A633 VanDerWaalsContact C-N 3.33Å; K631-A633 PolarHBondContact O-N 3.19Å; A633-G636 PolarHBondContact O-N 3.38Å; A633-R637 WeakPolarHBondContact O-CG 3.31Å; A633-R637 PolarHBondContact O-N 2.91Å
634	A	97.9	Very high	96.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-54.6	175.7	0	0	0	0	0	113	V552 Y614 L630 K631 G636 R637 M638	V552-A634 HydrophobicContact CG1-CB 3.99Å; V552-A634 HydrophobicContact CG2-CB 3.69Å; Y614-A634 HydrophobicContact CD1-CB 3.86Å; Y614-A634 HydrophobicContact CD2-CB 3.59Å; Y614-A634 HydrophobicContact CE1-CB 4.34Å; Y614-A634 HydrophobicContact CE2-CB 4.08Å; Y614-A634 HydrophobicContact CG-CB 3.45Å; Y614-A634 VanDerWaalsContact CG-CB 3.45Å; L630-A634 WeakPolarHBondContact O-CB 3.46Å; L630-A634 PolarHBondContact O-N 3.24Å; K631-A634 PolarHBondContact O-N 2.84Å; A634-G636 VanDerWaalsContact C-N 3.26Å; A634-G636 PolarHBondContact O-N 2.85Å; A634-R637 PolarHBondContact O-N 3.48Å; A634-M638 WeakPolarHBondContact O-CG 3.31Å; A634-M638 PolarHBondContact O-N 3.4Å; A634-M638 VanDerWaalsContact O-N 3.08Å
635	L	97.5	Very high	96.5	Very high	23 Å²	23	65 Å²	65	12%	0.12	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-33.8	179.3	-52.6	177.7	0	0	0	110.8	V552 M555 K631 M638 C639	V552-L635 HydrophobicContact CG2-CD2 4.43Å; M555-L635 HydrophobicContact CB-CD2 3.79Å; M555-L635 HydrophobicContact CG-CD2 4.17Å; M555-L635 HydrophobicContact SD-CB 4.01Å; M555-L635 HydrophobicContact SD-CD2 3.47Å; M555-L635 WeakPolarHBondContact SD-CD2 3.46Å; M555-L635 HydrophobicContact SD-CG 4.17Å; K631-L635 HydrophobicContact CD-CD1 3.65Å; K631-L635 HydrophobicContact CD-CG 4.38Å; K631-L635 HydrophobicContact CG-CD1 4.19Å; K631-L635 HydrophobicContact CG-CG 4.49Å; K631-L635 WeakPolarHBondContact O-CG 3.42Å; K631-L635 PolarHBondContact O-N 3.38Å; K631-L635 VanDerWaalsContact O-N 3.17Å; L635-M638 PolarHBondContact O-N 2.83Å; L635-C639 WeakPolarHBondContact O-CB 3.45Å; L635-C639 PolarHBondContact O-N 3.16Å; L635-C639 PolarHBondContact O-SG 3.21Å; L635-C639 VanDerWaalsContact O-SG 3.36Å
636	G	96.5	Very high	96.5	Very high	39 Å²	39	62.8 Å²	62.8	40%	0.402	29%	0.287	S	S	.	.	H	α-helix	trans	-61.3	-48.4	173.6	0	0	0	0	0	113.2	R632 A633 A634 C639 K640	R632-G636 PolarHBondContact O-N 3.44Å; A633-G636 PolarHBondContact O-N 3.38Å; A634-G636 VanDerWaalsContact C-N 3.26Å; A634-G636 PolarHBondContact O-N 2.85Å; G636-C639 PolarHBondContact O-N 3.18Å; G636-K640 WeakPolarHBondContact O-CB 3.14Å; G636-K640 PolarHBondContact O-N 3.48Å
637	R	97.2	Very high	96.4	Very high	110 Å²	110	61.1 Å²	61.1	42%	0.415	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-44.6	174.7	-69.3	-159.2	-157.6	162.8	2.5	111.4	V610 E613 Y614 A633 A634 C639 K640 I641	V610-R637 HydrophobicContact CG1-CB 3.89Å; V610-R637 HydrophobicContact CG2-CB 4.34Å; E613-R637 IonicContact OE2-NH1 3.84Å; E613-R637 PolarHBondContact OE2-NH1 2.8Å; Y614-R637 HydrophobicContact CE2-CG 4.29Å; Y614-R637 VanDerWaalsContact OH-CZ 3.27Å; Y614-R637 PolarHBondContact OH-NE 2.67Å; Y614-R637 PolarHBondContact OH-NH2 3.11Å; A633-R637 WeakPolarHBondContact O-CG 3.31Å; A633-R637 PolarHBondContact O-N 2.91Å; A634-R637 PolarHBondContact O-N 3.48Å; R637-C639 PolarHBondContact O-N 3.4Å; R637-K640 PolarHBondContact O-N 3.12Å; R637-K640 VanDerWaalsContact O-N 3.16Å; R637-I641 WeakPolarHBondContact O-CG1 3.31Å; R637-I641 PolarHBondContact O-N 2.89Å
638	M	97.5	Very high	96.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-45.2	176.3	-67.1	174.3	-179	0	0	112.1	V552 M555 Q556 I559 V607 V610 A634 L635 K640 I641 L642	V552-M638 HydrophobicContact CG1-CE 3.79Å; M555-M638 HydrophobicContact CB-SD 4.43Å; M555-M638 HydrophobicContact CE-CB 3.84Å; M555-M638 HydrophobicContact CG-SD 4.22Å; Q556-M638 HydrophobicContact CB-CE 3.79Å; Q556-M638 HydrophobicContact CB-SD 4.34Å; I559-M638 HydrophobicContact CD1-CB 4.13Å; V607-M638 HydrophobicContact CG1-CG 4.22Å; V607-M638 HydrophobicContact CG1-SD 4.43Å; V610-M638 HydrophobicContact CB-CE 4.49Å; V610-M638 HydrophobicContact CG1-CE 4.06Å; V610-M638 HydrophobicContact CG1-CG 4.04Å; A634-M638 WeakPolarHBondContact O-CG 3.31Å; A634-M638 PolarHBondContact O-N 3.4Å; A634-M638 VanDerWaalsContact O-N 3.08Å; L635-M638 PolarHBondContact O-N 2.83Å; M638-K640 VanDerWaalsContact C-N 3.35Å; M638-K640 PolarHBondContact O-N 3.26Å; M638-I641 PolarHBondContact O-N 3.44Å; M638-L642 PolarHBondContact O-N 3.08Å; M638-L642 VanDerWaalsContact O-N 3.16Å
639	C	96.4	Very high	96.3	Very high	14 Å²	14	56.8 Å²	56.8	10%	0.095	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-40.9	172.9	-75.5	0	0	0	0	112.4	K520 L635 G636 R637 L642 T643	K520-C639 HydrophobicContact CG-CB 4.5Å; L635-C639 WeakPolarHBondContact O-CB 3.45Å; L635-C639 PolarHBondContact O-N 3.16Å; L635-C639 PolarHBondContact O-SG 3.21Å; L635-C639 VanDerWaalsContact O-SG 3.36Å; G636-C639 PolarHBondContact O-N 3.18Å; R637-C639 PolarHBondContact O-N 3.4Å; C639-L642 PolarHBondContact O-N 2.73Å; C639-T643 WeakPolarHBondContact O-CG2 3.38Å; C639-T643 PolarHBondContact O-N 2.9Å; C639-T643 PolarHBondContact O-OG1 3.31Å
640	K	96.2	Very high	96.2	Very high	155 Å²	155	56.9 Å²	56.9	67%	0.674	27%	0.274	S	S	*	.	H	α-helix	trans	-64.7	-39.5	-180	-173.2	63.5	176.5	179.1	0	111.7	G636 R637 M638 T643 R644	G636-K640 WeakPolarHBondContact O-CB 3.14Å; G636-K640 PolarHBondContact O-N 3.48Å; R637-K640 PolarHBondContact O-N 3.12Å; R637-K640 VanDerWaalsContact O-N 3.16Å; M638-K640 VanDerWaalsContact C-N 3.35Å; M638-K640 PolarHBondContact O-N 3.26Å; K640-T643 WeakPolarHBondContact CA-OG1 3.41Å; K640-T643 PolarHBondContact O-N 2.88Å; K640-T643 PolarHBondContact O-OG1 3Å; K640-R644 PolarHBondContact O-N 3.14Å
641	I	96.4	Very high	96.2	Very high	26 Å²	26	56.7 Å²	56.7	13%	0.133	27%	0.271	C	S	.	.	H	α-helix	trans	-59	-48.4	172.5	-66	160.5	0	0	0	110.5	A603 L606 V607 V610 R637 M638 T643 R644	A603-I641 HydrophobicContact CB-CG2 3.85Å; L606-I641 HydrophobicContact CB-CD1 3.92Å; V607-I641 HydrophobicContact CG2-CB 4.36Å; V607-I641 HydrophobicContact CG2-CD1 4.08Å; V607-I641 HydrophobicContact CG2-CG2 4.07Å; V610-I641 HydrophobicContact CG2-CD1 3.98Å; R637-I641 WeakPolarHBondContact O-CG1 3.31Å; R637-I641 PolarHBondContact O-N 2.89Å; M638-I641 PolarHBondContact O-N 3.44Å; I641-T643 PolarHBondContact O-N 3.43Å; I641-R644 WeakPolarHBondContact O-CB 3.44Å; I641-R644 PolarHBondContact O-N 3.25Å; I641-R644 VanDerWaalsContact O-N 3.17Å
642	L	94.7	Very high	96.1	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-41.1	177	-68.6	173.6	0	0	0	112.9	S516 F523 I559 L563 M638 C639 R644 Q645	S516-L642 WeakPolarHBondContact CB-O 3.29Å; F523-L642 HydrophobicContact CD2-CD1 3.56Å; F523-L642 HydrophobicContact CE2-CD1 3.85Å; F523-L642 HydrophobicContact CE2-CD2 4.37Å; I559-L642 HydrophobicContact CD1-CD1 3.9Å; I559-L642 HydrophobicContact CG1-CD1 4.15Å; I559-L642 HydrophobicContact CG2-CD2 4.03Å; L563-L642 HydrophobicContact CD1-CD2 4.5Å; M638-L642 PolarHBondContact O-N 3.08Å; M638-L642 VanDerWaalsContact O-N 3.16Å; C639-L642 PolarHBondContact O-N 2.73Å; L642-R644 PolarHBondContact O-N 2.75Å; L642-Q645 PolarHBondContact O-N 2.97Å
643	T	94	Very high	96	Very high	53 Å²	53	48.4 Å²	48.4	33%	0.325	24%	0.24	S	C	.	.	H	α-helix	trans	-70.2	-19.1	177.6	53.6	0	0	0	0	113.7	K520 C639 K640 I641	K520-T643 HydrophobicContact CD-CG2 4.43Å; C639-T643 WeakPolarHBondContact O-CG2 3.38Å; C639-T643 PolarHBondContact O-N 2.9Å; C639-T643 PolarHBondContact O-OG1 3.31Å; K640-T643 WeakPolarHBondContact CA-OG1 3.41Å; K640-T643 PolarHBondContact O-N 2.88Å; K640-T643 PolarHBondContact O-OG1 3Å; I641-T643 PolarHBondContact O-N 3.43Å
644	R	95.2	Very high	95.9	Very high	198 Å²	198	52.6 Å²	52.6	75%	0.747	25%	0.252	S	S	*	.	H	α-helix	trans	-72.7	-34.7	175.1	-172.9	177.7	179.6	179.1	0	111.5	K640 I641 L642 K646	K640-R644 PolarHBondContact O-N 3.14Å; I641-R644 WeakPolarHBondContact O-CB 3.44Å; I641-R644 PolarHBondContact O-N 3.25Å; I641-R644 VanDerWaalsContact O-N 3.17Å; L642-R644 PolarHBondContact O-N 2.75Å; R644-K646 PolarHBondContact O-N 3.38Å; R644-K646 VanDerWaalsContact O-N 3.1Å
645	Q	94.6	Very high	95.7	Very high	20 Å²	20	52.7 Å²	52.7	9%	0.093	25%	0.253	C	S	.	.	S	Bend	trans	-86.3	43.1	177.4	-45.6	-51.4	20.3	0	0	112.1	Q599 I600 A603 L642 L649	Q599-Q645 PolarHBondContact O-NE2 3.08Å; I600-Q645 HydrophobicContact CD1-CB 4.23Å; A603-Q645 HydrophobicContact CB-CG 3.83Å; L642-Q645 PolarHBondContact O-N 2.97Å; Q645-L649 WeakPolarHBondContact O-CB 3.39Å; Q645-L649 VanDerWaalsContact O-CD1 3.29Å; Q645-L649 WeakPolarHBondContact O-CD1 3.41Å; Q645-L649 WeakPolarHBondContact O-CG 3.49Å
646	K	95.4	Very high	95.6	Very high	114 Å²	114	53.3 Å²	53.3	50%	0.496	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-53.3	177.9	179.1	-165.8	163.2	-136.7	0	110.1	R644 L649 T650	R644-K646 PolarHBondContact O-N 3.38Å; R644-K646 VanDerWaalsContact O-N 3.1Å; K646-L649 PolarHBondContact O-N 3.35Å; K646-T650 PolarHBondContact O-N 3.5Å; K646-T650 VanDerWaalsContact O-N 3.13Å; K646-T650 PolarHBondContact O-OG1 3.38Å
647	D	95	Very high	95.4	Very high	98 Å²	98	55.7 Å²	55.7	52%	0.524	25%	0.254	S	S	.	.	H	α-helix	trans	-78.1	-37.9	-162.7	-46.3	-56.1	0	0	0	111.4	L649 T650 Y651	D647-L649 PolarHBondContact O-N 3.21Å; D647-T650 WeakPolarHBondContact CA-OG1 3.24Å; D647-T650 PolarHBondContact O-N 3.02Å; D647-T650 PolarHBondContact O-OG1 3.49Å; D647-Y651 WeakPolarHBondContact O-CB 3.45Å; D647-Y651 PolarHBondContact O-N 3.01Å
648	S	96.1	Very high	95.1	Very high	5 Å²	5	54 Å²	54	4%	0.035	25%	0.251	C	S	.	.	H	α-helix	trans	-66.2	-32.7	172	30.5	0	0	0	0	113.5	Q599 L652	Q599-S648 VanDerWaalsContact OE1-CB 3.26Å; Q599-S648 PolarHBondContact OE1-OG 3.44Å; S648-L652 WeakPolarHBondContact O-CB 3.48Å; S648-L652 VanDerWaalsContact O-CG 3.25Å; S648-L652 WeakPolarHBondContact O-CG 3.12Å; S648-L652 PolarHBondContact O-N 3.24Å
649	L	95.8	Very high	94.8	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-70.7	-37.8	172.2	-74.9	173.4	0	0	0	112.5	V513 L519 I566 I600 Q645 K646 D647 E653	V513-L649 HydrophobicContact CG1-CB 4.41Å; V513-L649 HydrophobicContact CG1-CD2 3.61Å; L519-L649 HydrophobicContact CD1-CD1 3.57Å; L519-L649 HydrophobicContact CD1-CD2 4.3Å; I566-L649 HydrophobicContact CD1-CD2 4.41Å; I600-L649 HydrophobicContact CD1-CD2 3.69Å; I600-L649 HydrophobicContact CD1-CG 4Å; Q645-L649 WeakPolarHBondContact O-CB 3.39Å; Q645-L649 VanDerWaalsContact O-CD1 3.29Å; Q645-L649 WeakPolarHBondContact O-CD1 3.41Å; Q645-L649 WeakPolarHBondContact O-CG 3.49Å; K646-L649 PolarHBondContact O-N 3.35Å; D647-L649 PolarHBondContact O-N 3.21Å; L649-E653 PolarHBondContact O-N 2.98Å
650	T	95.4	Very high	94.4	Very high	59 Å²	59	55.2 Å²	55.2	36%	0.362	26%	0.259	S	S	.	.	H	α-helix	trans	-68.4	-40.7	175.6	42.2	0	0	0	0	112.2	K646 D647 E653 Q654	K646-T650 PolarHBondContact O-N 3.5Å; K646-T650 VanDerWaalsContact O-N 3.13Å; K646-T650 PolarHBondContact O-OG1 3.38Å; D647-T650 WeakPolarHBondContact CA-OG1 3.24Å; D647-T650 PolarHBondContact O-N 3.02Å; D647-T650 PolarHBondContact O-OG1 3.49Å; T650-E653 PolarHBondContact O-N 3.1Å; T650-Q654 WeakPolarHBondContact O-CG 3.45Å; T650-Q654 PolarHBondContact O-N 3.29Å; T650-Q654 VanDerWaalsContact O-N 3.16Å
651	Y	96.6	Very high	94	Very high	30 Å²	30	57.1 Å²	57.1	12%	0.118	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-48.2	174	166	-90.5	0	0	0	111.5	Y588 H592 Y593 A596 D647 E653 Q654 V655	Y588-Y651 PolarHBondContact O-OH 2.93Å; H592-Y651 HydrophobicContact CB-CE2 4.4Å; H592-Y651 AromaticContact CD2-CD1 3.82Å; H592-Y651 AromaticContact CD2-CD2 3.53Å; H592-Y651 AromaticContact CD2-CE1 3.74Å; H592-Y651 AromaticContact CD2-CE2 3.42Å; H592-Y651 VanDerWaalsContact CD2-CE2 3.42Å; H592-Y651 WeakPolarHBondContact CD2-CE2 3.32Å; H592-Y651 AromaticContact CD2-CG 3.72Å; H592-Y651 AromaticContact CD2-CZ 3.53Å; H592-Y651 AromaticContact CG-CE2 3.98Å; H592-Y651 AromaticContact NE2-CD2 3.72Å; H592-Y651 AromaticContact NE2-CG 3.82Å; Y593-Y651 WeakPolarHBondContact CA-OH 3.38Å; Y593-Y651 WeakPolarHBondContact CB-OH 3.43Å; Y593-Y651 HydrophobicContact CD2-CE1 4.41Å; Y593-Y651 PolarHBondContact N-OH 3.2Å; A596-Y651 HydrophobicContact CB-CD1 3.78Å; A596-Y651 HydrophobicContact CB-CE1 3.97Å; D647-Y651 WeakPolarHBondContact O-CB 3.45Å; D647-Y651 PolarHBondContact O-N 3.01Å; Y651-E653 VanDerWaalsContact C-N 3.29Å; Y651-E653 PolarHBondContact O-N 2.89Å; Y651-Q654 WeakPolarHBondContact O-CB 3.29Å; Y651-Q654 PolarHBondContact O-N 2.88Å; Y651-Q654 VanDerWaalsContact O-N 3.07Å; Y651-V655 HydrophobicContact CD1-CG2 4.15Å; Y651-V655 HydrophobicContact CD2-CG2 4.27Å; Y651-V655 HydrophobicContact CE1-CG2 3.69Å; Y651-V655 HydrophobicContact CE2-CG2 3.86Å; Y651-V655 HydrophobicContact CG-CG2 4.42Å; Y651-V655 WeakPolarHBondContact O-CG2 3.26Å; Y651-V655 PolarHBondContact O-N 2.97Å
652	L	95.6	Very high	93.5	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-35.7	179	-73.9	172.1	0	0	0	112.5	I566 F570 A596 L597 I600 S648 V655 R656	I566-L652 HydrophobicContact CG2-CD1 4.32Å; F570-L652 HydrophobicContact CD1-CD2 4.05Å; F570-L652 HydrophobicContact CE1-CB 4.39Å; F570-L652 HydrophobicContact CE1-CD2 3.77Å; F570-L652 HydrophobicContact CZ-CB 3.94Å; F570-L652 HydrophobicContact CZ-CD2 4.07Å; F570-L652 WeakPolarHBondContact CZ-O 3.47Å; A596-L652 HydrophobicContact CB-CD2 4.33Å; A596-L652 HydrophobicContact CB-CG 4.22Å; L597-L652 HydrophobicContact CD2-CD1 4.04Å; L597-L652 HydrophobicContact CD2-CD2 3.86Å; L597-L652 HydrophobicContact CG-CD2 4.23Å; I600-L652 HydrophobicContact CG1-CD1 4Å; S648-L652 WeakPolarHBondContact O-CB 3.48Å; S648-L652 VanDerWaalsContact O-CG 3.25Å; S648-L652 WeakPolarHBondContact O-CG 3.12Å; S648-L652 PolarHBondContact O-N 3.24Å; L652-V655 PolarHBondContact O-N 3.38Å; L652-R656 WeakPolarHBondContact O-CB 3.5Å; L652-R656 PolarHBondContact O-N 3.02Å
653	E	94.7	Very high	93.2	Very high	25 Å²	25	58.8 Å²	58.8	12%	0.117	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-37.7	174.4	-178.5	51.1	-155.3	0	0	112.5	V513 L649 T650 Y651 R656 Q657	V513-E653 HydrophobicContact CB-CB 4.07Å; V513-E653 PolarHBondContact N-OE2 2.96Å; L649-E653 PolarHBondContact O-N 2.98Å; T650-E653 PolarHBondContact O-N 3.1Å; Y651-E653 VanDerWaalsContact C-N 3.29Å; Y651-E653 PolarHBondContact O-N 2.89Å; E653-R656 PolarHBondContact O-N 2.89Å; E653-R656 IonicContact OE1-CZ 3.51Å; E653-R656 IonicContact OE1-NE 3.1Å; E653-R656 PolarHBondContact OE1-NE 3.47Å; E653-R656 IonicContact OE1-NH2 3.44Å; E653-R656 PolarHBondContact OE1-NH2 3.42Å; E653-R656 IonicContact OE2-CZ 2.76Å; E653-R656 IonicContact OE2-NE 2.72Å; E653-R656 PolarHBondContact OE2-NE 3.29Å; E653-R656 IonicContact OE2-NH2 2.73Å; E653-Q657 VanDerWaalsContact O-CG 3.31Å; E653-Q657 WeakPolarHBondContact O-CG 3.44Å; E653-Q657 PolarHBondContact O-N 2.95Å; E653-Q657 WeakPolarHBondContact OE1-CG 3.43Å; E653-Q657 PolarHBondContact OE1-NE2 2.85Å
654	Q	95	Very high	92.9	Very high	129 Å²	129	58.8 Å²	58.8	60%	0.603	28%	0.276	S	S	*	.	H	α-helix	trans	-62.8	-49.2	172.8	-69.7	169.8	-19.3	0	0	111.3	T650 Y651 R656 Q657 H658	T650-Q654 WeakPolarHBondContact O-CG 3.45Å; T650-Q654 PolarHBondContact O-N 3.29Å; T650-Q654 VanDerWaalsContact O-N 3.16Å; Y651-Q654 WeakPolarHBondContact O-CB 3.29Å; Y651-Q654 PolarHBondContact O-N 2.88Å; Y651-Q654 VanDerWaalsContact O-N 3.07Å; Q654-R656 VanDerWaalsContact C-N 3.31Å; Q654-R656 PolarHBondContact O-N 3.45Å; Q654-Q657 PolarHBondContact O-N 3.47Å; Q654-H658 PolarHBondContact O-N 2.96Å
655	V	94.5	Very high	92.5	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-57.1	-44.7	176.1	174.4	0	0	0	0	110.7	F570 Y588 Y593 Y651 L652 Q657 H658 L659	F570-V655 HydrophobicContact CE1-CG1 4.26Å; Y588-V655 HydrophobicContact CD1-CB 4.31Å; Y588-V655 HydrophobicContact CD1-CG1 4.05Å; Y588-V655 HydrophobicContact CD1-CG2 3.79Å; Y588-V655 HydrophobicContact CD2-CG1 4.06Å; Y588-V655 HydrophobicContact CE1-CB 4.42Å; Y588-V655 HydrophobicContact CE1-CG1 4.1Å; Y588-V655 HydrophobicContact CE1-CG2 4.35Å; Y588-V655 HydrophobicContact CE2-CG1 4.12Å; Y588-V655 HydrophobicContact CG-CG1 4.03Å; Y588-V655 HydrophobicContact CG-CG2 4.11Å; Y593-V655 HydrophobicContact CD2-CG1 4.24Å; Y593-V655 HydrophobicContact CE2-CG1 4.02Å; Y651-V655 HydrophobicContact CD1-CG2 4.15Å; Y651-V655 HydrophobicContact CD2-CG2 4.27Å; Y651-V655 HydrophobicContact CE1-CG2 3.69Å; Y651-V655 HydrophobicContact CE2-CG2 3.86Å; Y651-V655 HydrophobicContact CG-CG2 4.42Å; Y651-V655 WeakPolarHBondContact O-CG2 3.26Å; Y651-V655 PolarHBondContact O-N 2.97Å; L652-V655 PolarHBondContact O-N 3.38Å; V655-Q657 PolarHBondContact O-N 2.91Å; V655-H658 PolarHBondContact O-N 3.24Å; V655-L659 HydrophobicContact CG1-CD1 3.77Å; V655-L659 HydrophobicContact CG1-CG 4.07Å; V655-L659 WeakPolarHBondContact O-CB 3.48Å; V655-L659 VanDerWaalsContact O-CG 3.3Å; V655-L659 WeakPolarHBondContact O-CG 3.24Å; V655-L659 PolarHBondContact O-N 2.81Å
656	R	94.6	Very high	92.2	Very high	35 Å²	35	50 Å²	50	13%	0.132	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-45.3	177	-168.6	-161.9	67.5	75.1	6.3	112.8	I510 T511 F570 L652 E653 Q654 H658 S660	I510-R656 HydrophobicContact CB-CG 3.88Å; I510-R656 HydrophobicContact CG2-CG 3.67Å; T511-R656 WeakPolarHBondContact O-CD 3.37Å; F570-R656 HydrophobicContact CE1-CB 4.46Å; F570-R656 HydrophobicContact CZ-CB 3.94Å; F570-R656 HydrophobicContact CZ-CG 4.44Å; L652-R656 WeakPolarHBondContact O-CB 3.5Å; L652-R656 PolarHBondContact O-N 3.02Å; E653-R656 PolarHBondContact O-N 2.89Å; E653-R656 IonicContact OE1-CZ 3.51Å; E653-R656 IonicContact OE1-NE 3.1Å; E653-R656 PolarHBondContact OE1-NE 3.47Å; E653-R656 IonicContact OE1-NH2 3.44Å; E653-R656 PolarHBondContact OE1-NH2 3.42Å; E653-R656 IonicContact OE2-CZ 2.76Å; E653-R656 IonicContact OE2-NE 2.72Å; E653-R656 PolarHBondContact OE2-NE 3.29Å; E653-R656 IonicContact OE2-NH2 2.73Å; Q654-R656 VanDerWaalsContact C-N 3.31Å; Q654-R656 PolarHBondContact O-N 3.45Å; R656-H658 VanDerWaalsContact C-N 3.31Å; R656-H658 PolarHBondContact O-N 3.38Å; R656-S660 WeakPolarHBondContact O-CB 3.38Å; R656-S660 PolarHBondContact O-N 2.75Å
657	Q	92.5	Very high	91.9	Very high	90 Å²	90	44.7 Å²	44.7	42%	0.421	22%	0.221	S	C	.	.	H	α-helix	trans	-63.8	-38.4	179.4	-72.9	176.8	21.8	0	0	111.8	E653 Q654 V655	E653-Q657 VanDerWaalsContact O-CG 3.31Å; E653-Q657 WeakPolarHBondContact O-CG 3.44Å; E653-Q657 PolarHBondContact O-N 2.95Å; E653-Q657 WeakPolarHBondContact OE1-CG 3.43Å; E653-Q657 PolarHBondContact OE1-NE2 2.85Å; Q654-Q657 PolarHBondContact O-N 3.47Å; V655-Q657 PolarHBondContact O-N 2.91Å
658	H	91.6	Very high	91.6	Very high	75 Å²	75	44.1 Å²	44.1	35%	0.347	22%	0.218	S	C	.	.	H	α-helix	trans	-72.6	-46.6	176.7	-163.4	-102.9	0	0	0	112.2	Y588 Q654 V655 R656 S660 R661 L662	Y588-H658 HydrophobicContact CE1-CB 3.9Å; Y588-H658 AromaticContact CE1-CG 3.99Å; Y588-H658 AromaticContact CE1-ND1 3.53Å; Y588-H658 AromaticContact CZ-ND1 3.53Å; Y588-H658 PolarHBondContact OH-ND1 3.12Å; Q654-H658 PolarHBondContact O-N 2.96Å; V655-H658 PolarHBondContact O-N 3.24Å; R656-H658 VanDerWaalsContact C-N 3.31Å; R656-H658 PolarHBondContact O-N 3.38Å; H658-S660 PolarHBondContact O-N 3.03Å; H658-R661 WeakPolarHBondContact O-CB 3.4Å; H658-R661 PolarHBondContact O-N 3.26Å; H658-L662 PolarHBondContact O-N 2.68Å
659	L	90.1	Very high	91.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-53.2	-38.8	174.1	-79.4	177	0	0	0	112.4	F507 I510 M584 Y588 V655 R661 L662	F507-L659 HydrophobicContact CB-CB 4.14Å; F507-L659 WeakPolarHBondContact CB-O 3.49Å; F507-L659 HydrophobicContact CG-CD2 4.46Å; I510-L659 HydrophobicContact CD1-CD1 4.07Å; M584-L659 HydrophobicContact CE-CD2 3.76Å; M584-L659 HydrophobicContact CG-CD2 4.44Å; M584-L659 HydrophobicContact SD-CD2 4.26Å; Y588-L659 HydrophobicContact CE2-CD2 3.64Å; Y588-L659 HydrophobicContact CE2-CG 3.95Å; Y588-L659 PolarHBondContact OH-N 2.82Å; V655-L659 HydrophobicContact CG1-CD1 3.77Å; V655-L659 HydrophobicContact CG1-CG 4.07Å; V655-L659 WeakPolarHBondContact O-CB 3.48Å; V655-L659 VanDerWaalsContact O-CG 3.3Å; V655-L659 WeakPolarHBondContact O-CG 3.24Å; V655-L659 PolarHBondContact O-N 2.81Å; L659-R661 PolarHBondContact O-N 2.87Å; L659-L662 HydrophobicContact CD2-CD1 3.87Å; L659-L662 PolarHBondContact O-N 3.27Å
660	S	88.5	Confident	91.2	Very high	37 Å²	37	48.9 Å²	48.9	26%	0.259	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.4	178	-173.4	0	0	0	0	114.6	K508 R656 H658	K508-S660 WeakPolarHBondContact CE-O 3.29Å; R656-S660 WeakPolarHBondContact O-CB 3.38Å; R656-S660 PolarHBondContact O-N 2.75Å; H658-S660 PolarHBondContact O-N 3.03Å
661	R	88.4	Confident	91.2	Very high	196 Å²	196	46.1 Å²	46.1	74%	0.74	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-18.5	178.1	-64	176.7	-176.9	173.7	0.8	113.1	H658 L659	H658-R661 WeakPolarHBondContact O-CB 3.4Å; H658-R661 PolarHBondContact O-N 3.26Å; L659-R661 PolarHBondContact O-N 2.87Å
662	L	86.4	Confident	91.1	Very high	24 Å²	24	44.7 Å²	44.7	13%	0.126	22%	0.217	C	C	.	.	S	Bend	trans	-61.9	141.2	-179	-66.5	179.4	0	0	0	111.6	L587 H658 L659	L587-L662 HydrophobicContact CD1-CD1 4.36Å; L587-L662 HydrophobicContact CD1-CD2 4.09Å; H658-L662 PolarHBondContact O-N 2.68Å; L659-L662 HydrophobicContact CD2-CD1 3.87Å; L659-L662 PolarHBondContact O-N 3.27Å
663	P	87.4	Confident	91	Very high	41 Å²	41	44.7 Å²	44.7	27%	0.266	22%	0.217	S	C	.	.			trans	-70.8	150.8	174.5	32	-36.7	0	0	0	111.3	I665 V708	P663-I665 HydrophobicContact CG-CD1 4.18Å; P663-I665 HydrophobicContact CG-CG1 4.34Å; P663-I665 PolarHBondContact O-N 3.13Å; P663-V708 HydrophobicContact CB-CB 4.29Å; P663-V708 HydrophobicContact CB-CG2 3.69Å; P663-V708 HydrophobicContact CG-CG2 3.96Å
664	S	86.7	Confident	91	Very high	53 Å²	53	43.5 Å²	43.5	37%	0.371	21%	0.212	S	C	.	.			trans	-86.1	84	177.8	56.9	0	0	0	0	111.2
665	I	88.7	Confident	90.7	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.015	18%	0.184	C	C	.	.			trans	-82.3	138.8	175.3	-62.7	163.7	0	0	0	109.8	F579 Y580 P663 L706 V708 I721 I748	F579-I665 HydrophobicContact CE1-CB 4.02Å; F579-I665 HydrophobicContact CE1-CD1 3.99Å; F579-I665 HydrophobicContact CE1-CG2 3.95Å; F579-I665 HydrophobicContact CZ-CD1 3.76Å; F579-I665 HydrophobicContact CZ-CG2 4.38Å; Y580-I665 WeakPolarHBondContact CE2-O 2.82Å; Y580-I665 WeakPolarHBondContact OH-CA 2.5Å; Y580-I665 PolarHBondContact OH-N 3.22Å; Y580-I665 PolarHBondContact OH-O 3.12Å; P663-I665 HydrophobicContact CG-CD1 4.18Å; P663-I665 HydrophobicContact CG-CG1 4.34Å; P663-I665 PolarHBondContact O-N 3.13Å; I665-L706 HydrophobicContact CD1-CB 4.42Å; I665-L706 HydrophobicContact CD1-CD1 4.07Å; I665-V708 HydrophobicContact CD1-CG2 4.05Å; I665-V708 HydrophobicContact CG1-CG2 3.49Å; I665-V708 VanDerWaalsContact CG1-CG2 3.49Å; I665-I721 HydrophobicContact CD1-CD1 4.46Å; I665-I721 HydrophobicContact CG1-CD1 4.47Å; I665-I721 HydrophobicContact CG2-CD1 3.98Å; I665-I748 HydrophobicContact CG2-CD1 4.03Å
666	D	88.2	Confident	90.4	Very high	30 Å²	30	37.3 Å²	37.3	16%	0.16	18%	0.183	C	C	.	.			trans	-111	107.6	168.9	-177.6	-20.9	0	0	0	109.7	N668 T669	D666-N668 PolarHBondContact O-N 2.92Å; D666-N668 VanDerWaalsContact O-N 3.13Å; D666-N668 PolarHBondContact OD1-N 3.28Å; D666-T669 HydrophobicContact CB-CG2 3.68Å; D666-T669 PolarHBondContact O-N 3.31Å; D666-T669 VanDerWaalsContact O-N 3.17Å; D666-T669 PolarHBondContact O-OG1 3.28Å; D666-T669 VanDerWaalsContact OD2-CG2 3.27Å; D666-T669 WeakPolarHBondContact OD2-CG2 3.34Å
667	P	88.8	Confident	90.1	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.013	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.4	-171.9	28.1	-35.8	0	0	0	113.8	F579	F579-P667 HydrophobicContact CB-CB 4.49Å
668	N	87.5	Confident	89.9	Confident	86 Å²	86	34.1 Å²	34.1	46%	0.46	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-18.7	-179	-66	-55.6	0	0	0	112.8	D666 R832	D666-N668 PolarHBondContact O-N 2.92Å; D666-N668 VanDerWaalsContact O-N 3.13Å; D666-N668 PolarHBondContact OD1-N 3.28Å; N668-R832 PolarHBondContact O-NH1 2.91Å; N668-R832 PolarHBondContact O-NH2 2.91Å; N668-R832 VanDerWaalsContact O-NH2 3.11Å
669	T	90.5	Very high	89.6	Confident	43 Å²	43	34 Å²	34	26%	0.264	17%	0.173	S	C	.	.	S	Bend	trans	-74.5	169.6	-177.3	61	0	0	0	0	113.4	D666 T671 Q719 R832	D666-T669 HydrophobicContact CB-CG2 3.68Å; D666-T669 PolarHBondContact O-N 3.31Å; D666-T669 VanDerWaalsContact O-N 3.17Å; D666-T669 PolarHBondContact O-OG1 3.28Å; D666-T669 VanDerWaalsContact OD2-CG2 3.27Å; D666-T669 WeakPolarHBondContact OD2-CG2 3.34Å; T669-T671 PolarHBondContact O-N 3.32Å; T669-T671 PolarHBondContact O-OG1 3.34Å; T669-Q719 PolarHBondContact OG1-NE2 3.29Å; T669-Q719 VanDerWaalsContact OG1-NE2 3.13Å; T669-R832 PolarHBondContact O-NH2 2.89Å; T669-R832 VanDerWaalsContact O-NH2 3.09Å
670	R	93.4	Very high	89.5	Confident	65 Å²	65	35 Å²	35	25%	0.245	18%	0.179	C	C	.	.			trans	-68.9	112.5	174.2	-60.1	-179.9	-156.6	81	-1.5	108.8	W718 Q719 L828	R670-W718 HydrophobicContact CB-CD2 3.9Å; R670-W718 HydrophobicContact CB-CE3 3.68Å; R670-W718 HydrophobicContact CB-CH2 4.14Å; R670-W718 HydrophobicContact CB-CZ2 4.37Å; R670-W718 HydrophobicContact CB-CZ3 3.84Å; R670-W718 HydrophobicContact CG-CH2 4.4Å; R670-Q719 PolarHBondContact O-N 3Å; R670-L828 HydrophobicContact CB-CD2 4.35Å
671	T	94.8	Very high	89.5	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.8	-170.8	33.3	0	0	0	0	108.5	T669 Q719 I721 I748 R749 A750 A751 L828	T669-T671 PolarHBondContact O-N 3.32Å; T669-T671 PolarHBondContact O-OG1 3.34Å; T671-Q719 CarbonylContact C-O 3.54Å; T671-Q719 VanDerWaalsContact CA-O 3.3Å; T671-Q719 WeakPolarHBondContact CA-O 3.43Å; T671-Q719 HydrophobicContact CG2-CB 3.87Å; T671-Q719 HydrophobicContact CG2-CG 4.46Å; T671-I721 HydrophobicContact CG2-CD1 4.08Å; T671-I748 HydrophobicContact CG2-CG2 3.81Å; T671-I748 VanDerWaalsContact OG1-CG2 3.25Å; T671-I748 WeakPolarHBondContact OG1-CG2 3.43Å; T671-R749 PolarHBondContact OG1-O 3.22Å; T671-A750 CarbonylContact O-C 3.59Å; T671-A750 WeakPolarHBondContact O-CA 3.49Å; T671-A750 VanDerWaalsContact O-CB 3.28Å; T671-A750 WeakPolarHBondContact O-CB 3.41Å; T671-A750 WeakPolarHBondContact OG1-CA 3.16Å; T671-A750 WeakPolarHBondContact OG1-CB 3.35Å; T671-A751 PolarHBondContact O-N 2.95Å; T671-L828 WeakPolarHBondContact O-CD2 3.42Å
672	L	94.9	Very high	89.6	Confident	1 Å²	1	25 Å²	25	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	116.3	170	178	66.2	0	0	0	106.4	M711 Q719 V720 I721 A751 L753 A824	L672-M711 HydrophobicContact CD2-CE 4.05Å; L672-Q719 PolarHBondContact N-O 3.34Å; L672-V720 HydrophobicContact CB-CG2 4.47Å; L672-V720 HydrophobicContact CD2-CG2 4.44Å; L672-V720 CarbonylContact O-C 3.59Å; L672-V720 WeakPolarHBondContact O-CA 3.23Å; L672-I721 PolarHBondContact O-N 3.15Å; L672-A751 WeakPolarHBondContact CA-O 3.27Å; L672-A751 HydrophobicContact CD1-CB 3.9Å; L672-L753 HydrophobicContact CD1-CB 4.29Å; L672-A824 HydrophobicContact CD1-CB 3.87Å
673	I	94.8	Very high	89.8	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	129.5	179.4	-62.4	174.2	0	0	0	108.2	C675 I721 T723 L745 I748 A750 A751 L753	I673-C675 WeakPolarHBondContact CG2-SG 3.33Å; I673-I721 HydrophobicContact CG1-CB 4.31Å; I673-I721 HydrophobicContact CG1-CD1 4.47Å; I673-T723 HydrophobicContact CG2-CG2 3.51Å; I673-L745 HydrophobicContact CG2-CD2 4.26Å; I673-I748 HydrophobicContact CD1-CB 4.02Å; I673-I748 HydrophobicContact CD1-CD1 4.45Å; I673-I748 HydrophobicContact CD1-CG2 4.22Å; I673-A750 HydrophobicContact CB-CB 4.36Å; I673-A750 HydrophobicContact CD1-CB 3.51Å; I673-A750 HydrophobicContact CG1-CB 3.54Å; I673-A751 PolarHBondContact N-O 2.89Å; I673-L753 PolarHBondContact O-N 3.19Å
674	I	93.1	Very high	90	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	112.9	175.2	-51.3	177.1	0	0	0	108.1	K682 L685 I686 L689 V720 I721 T723 L753 I755	I674-K682 HydrophobicContact CG2-CB 3.71Å; I674-K682 HydrophobicContact CG2-CD 4.2Å; I674-K682 HydrophobicContact CG2-CG 3.89Å; I674-L685 HydrophobicContact CD1-CD2 4.28Å; I674-L685 HydrophobicContact CD1-CG 4.46Å; I674-I686 HydrophobicContact CD1-CB 4.18Å; I674-L689 HydrophobicContact CD1-CD1 4.36Å; I674-V720 HydrophobicContact CD1-CG1 3.68Å; I674-V720 HydrophobicContact CG1-CG1 4.09Å; I674-I721 PolarHBondContact N-O 2.86Å; I674-T723 PolarHBondContact O-N 3.35Å; I674-T723 PolarHBondContact O-OG1 3.27Å; I674-L753 HydrophobicContact CG1-CD2 4.39Å; I674-L753 HydrophobicContact CG2-CD2 4.44Å; I674-I755 HydrophobicContact CG2-CD1 3.74Å; I674-I755 HydrophobicContact CG2-CG1 4.06Å
675	C	90.5	Very high	90.2	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.007	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	169.8	-178.8	-77	0	0	0	0	111.9	I673 T723 V752 L753 I755	I673-C675 WeakPolarHBondContact CG2-SG 3.33Å; C675-T723 PolarHBondContact SG-OG1 3.02Å; C675-T723 VanDerWaalsContact SG-OG1 3.4Å; C675-V752 HydrophobicContact CB-CG1 4.37Å; C675-L753 PolarHBondContact N-O 3.27Å; C675-I755 PolarHBondContact O-N 2.86Å
676	G	88	Confident	90.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.9	178.4	-176	0	0	0	0	0	112.4	K682 I726 I755	G676-K682 PolarHBondContact O-NZ 3.41Å; G676-I726 PolarHBondContact O-N 3.39Å; G676-I755 WeakPolarHBondContact CA-O 3.41Å
677	F	87.2	Confident	90.7	Very high	35 Å²	35	22 Å²	22	15%	0.154	12%	0.121	C	C	.	.	S	Bend	trans	-59.3	164.2	-179.8	-78.2	-87.3	0	0	0	113.6	V680 L727 D757 L760	F677-V680 HydrophobicContact CB-CG1 3.73Å; F677-V680 WeakPolarHBondContact O-CG2 3.36Å; F677-L727 HydrophobicContact CD1-CD2 4.29Å; F677-D757 HydrophobicContact CD2-CB 3.71Å; F677-D757 HydrophobicContact CE2-CB 3.57Å; F677-D757 HydrophobicContact CZ-CB 4.47Å; F677-L760 HydrophobicContact CD1-CD2 4.17Å; F677-L760 HydrophobicContact CD2-CB 4.31Å; F677-L760 HydrophobicContact CD2-CD2 3.68Å; F677-L760 HydrophobicContact CE1-CB 4.31Å; F677-L760 HydrophobicContact CE1-CD2 4.07Å; F677-L760 HydrophobicContact CE2-CB 3.35Å; F677-L760 HydrophobicContact CE2-CD2 3.55Å; F677-L760 HydrophobicContact CE2-CG 4.09Å; F677-L760 HydrophobicContact CG-CD2 4Å; F677-L760 HydrophobicContact CZ-CB 3.37Å; F677-L760 HydrophobicContact CZ-CD2 3.78Å; F677-L760 HydrophobicContact CZ-CG 4.13Å
678	P	87.9	Confident	90.8	Very high	23 Å²	23	27.6 Å²	27.6	15%	0.149	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	154.2	161.7	-20.3	31.3	0	0	0	112	V680 A700 F701 L727	P678-V680 PolarHBondContact O-N 3.49Å; P678-A700 HydrophobicContact CB-CB 3.66Å; P678-A700 HydrophobicContact CG-CB 4.23Å; P678-F701 HydrophobicContact CG-CE2 4.42Å; P678-F701 HydrophobicContact CG-CZ 4.35Å; P678-L727 HydrophobicContact CG-CD2 4.03Å
679	N	87	Confident	91	Very high	73 Å²	73	24.4 Å²	24.4	39%	0.39	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	5.1	171.7	-62.8	-3.7	0	0	0	118.3	G681 P698 Y699 A700 K779	N679-G681 PolarHBondContact O-N 2.83Å; N679-P698 PolarHBondContact ND2-O 3.37Å; N679-Y699 PolarHBondContact OD1-O 3.43Å; N679-A700 PolarHBondContact OD1-N 3.23Å; N679-K779 PolarHBondContact O-NZ 2.94Å
680	V	87.5	Confident	91.2	Very high	23 Å²	23	23 Å²	23	14%	0.139	12%	0.12	C	C	.	.	S	Bend	trans	-74.3	-9.9	175.2	-55.1	0	0	0	0	113.9	F677 P678 K682 I755 N778	F677-V680 HydrophobicContact CB-CG1 3.73Å; F677-V680 WeakPolarHBondContact O-CG2 3.36Å; P678-V680 PolarHBondContact O-N 3.49Å; V680-K682 HydrophobicContact CG2-CD 4.08Å; V680-K682 HydrophobicContact CG2-CG 3.51Å; V680-I755 HydrophobicContact CB-CB 4.43Å; V680-I755 HydrophobicContact CB-CG2 3.79Å; V680-I755 HydrophobicContact CG2-CB 3.73Å; V680-I755 HydrophobicContact CG2-CG2 3.6Å; V680-N778 PolarHBondContact O-ND2 3.32Å
681	G	87.6	Confident	91.1	Very high	14 Å²	14	31.9 Å²	31.9	14%	0.144	15%	0.153	C	C	.	.	S	Bend	trans	98.6	21.3	175.9	0	0	0	0	0	115.9	N679 S683 S684 L685	N679-G681 PolarHBondContact O-N 2.83Å; G681-S683 PolarHBondContact O-N 2.61Å; G681-S684 WeakPolarHBondContact O-CB 3.41Å; G681-S684 PolarHBondContact O-N 3.39Å; G681-L685 PolarHBondContact O-N 2.99Å
682	K	90.3	Very high	90.9	Very high	9 Å²	9	33 Å²	33	4%	0.039	16%	0.162	C	C	.	.	H	α-helix	trans	-55.1	-49.3	177.9	-52.1	-171.3	-65.2	179.7	0	112.6	I674 G676 V680 S684 L685 I686 D722 T723 P724 I755	I674-K682 HydrophobicContact CG2-CB 3.71Å; I674-K682 HydrophobicContact CG2-CD 4.2Å; I674-K682 HydrophobicContact CG2-CG 3.89Å; G676-K682 PolarHBondContact O-NZ 3.41Å; V680-K682 HydrophobicContact CG2-CD 4.08Å; V680-K682 HydrophobicContact CG2-CG 3.51Å; K682-S684 VanDerWaalsContact C-N 3.34Å; K682-S684 PolarHBondContact O-N 2.89Å; K682-L685 WeakPolarHBondContact O-CB 3.41Å; K682-L685 PolarHBondContact O-N 3.38Å; K682-L685 VanDerWaalsContact O-N 3.08Å; K682-I686 PolarHBondContact O-N 3.05Å; K682-I686 VanDerWaalsContact O-N 3.07Å; K682-D722 VanDerWaalsContact CB-OD1 3.22Å; K682-D722 WeakPolarHBondContact CB-OD1 3.38Å; K682-T723 WeakPolarHBondContact CE-O 3.36Å; K682-T723 PolarHBondContact NZ-O 2.88Å; K682-T723 PolarHBondContact NZ-OG1 3.48Å; K682-P724 VanDerWaalsContact NZ-C 3.31Å; K682-P724 PolarHBondContact NZ-O 2.99Å; K682-I755 HydrophobicContact CG-CD1 4.08Å
683	S	91.4	Very high	90.7	Very high	9 Å²	9	40.3 Å²	40.3	6%	0.063	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-31.8	178.3	-46.6	0	0	0	0	112.9	G681 I686 N687 T703 D722	G681-S683 PolarHBondContact O-N 2.61Å; S683-I686 WeakPolarHBondContact O-CG2 3.2Å; S683-N687 VanDerWaalsContact O-CG 3.25Å; S683-N687 PolarHBondContact O-N 3.39Å; S683-N687 PolarHBondContact O-OD1 3.35Å; S683-T703 WeakPolarHBondContact OG-CG2 3.35Å; S683-D722 WeakPolarHBondContact CA-OD2 3.24Å; S683-D722 WeakPolarHBondContact CB-OD2 3.46Å; S683-D722 PolarHBondContact OG-OD2 2.85Å
684	S	90.5	Very high	90.5	Very high	30 Å²	30	40.5 Å²	40.5	21%	0.21	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-39.3	169.9	-47.7	0	0	0	0	111.7	G681 K682 N687 K688 V696	G681-S684 WeakPolarHBondContact O-CB 3.41Å; G681-S684 PolarHBondContact O-N 3.39Å; K682-S684 VanDerWaalsContact C-N 3.34Å; K682-S684 PolarHBondContact O-N 2.89Å; S684-N687 PolarHBondContact O-N 3.37Å; S684-K688 WeakPolarHBondContact O-CG 3.36Å; S684-K688 PolarHBondContact O-N 2.87Å; S684-V696 WeakPolarHBondContact OG-CG1 3.28Å
685	L	91.9	Very high	90.4	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-68.4	-42.3	-178.7	-175.5	64.7	0	0	0	112.2	I674 G681 K682 N687 K688 L689 L753 I755 I809 T811 I817 M820	I674-L685 HydrophobicContact CD1-CD2 4.28Å; I674-L685 HydrophobicContact CD1-CG 4.46Å; G681-L685 PolarHBondContact O-N 2.99Å; K682-L685 WeakPolarHBondContact O-CB 3.41Å; K682-L685 PolarHBondContact O-N 3.38Å; K682-L685 VanDerWaalsContact O-N 3.08Å; L685-N687 VanDerWaalsContact C-N 3.32Å; L685-N687 PolarHBondContact O-N 3.21Å; L685-K688 PolarHBondContact O-N 3.3Å; L685-K688 VanDerWaalsContact O-N 3.14Å; L685-L689 HydrophobicContact CD1-CD1 4.22Å; L685-L689 HydrophobicContact CD1-CG 4.24Å; L685-L689 HydrophobicContact CD2-CD1 4.31Å; L685-L689 HydrophobicContact CG-CD1 3.81Å; L685-L689 HydrophobicContact CG-CG 4.27Å; L685-L689 WeakPolarHBondContact O-CB 3.28Å; L685-L689 WeakPolarHBondContact O-CG 3.49Å; L685-L689 PolarHBondContact O-N 3.5Å; L685-L753 HydrophobicContact CD2-CD2 3.51Å; L685-I755 HydrophobicContact CD2-CD1 3.69Å; L685-I809 HydrophobicContact CD1-CG2 4.31Å; L685-T811 HydrophobicContact CB-CG2 4.17Å; L685-T811 HydrophobicContact CD1-CG2 4.2Å; L685-I817 HydrophobicContact CD1-CD1 4.2Å; L685-I817 HydrophobicContact CD1-CG1 4.07Å; L685-I817 HydrophobicContact CD1-CG2 4.13Å; L685-M820 HydrophobicContact CD1-CE 4.32Å; L685-M820 HydrophobicContact CD2-CE 4.03Å
686	I	93.3	Very high	90.4	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-35.6	176.6	-171.2	169.5	0	0	0	112.4	I674 K682 S683 K688 L689 T690 A692 V694 V720 D722	I674-I686 HydrophobicContact CD1-CB 4.18Å; K682-I686 PolarHBondContact O-N 3.05Å; K682-I686 VanDerWaalsContact O-N 3.07Å; S683-I686 WeakPolarHBondContact O-CG2 3.2Å; I686-K688 VanDerWaalsContact C-N 3.29Å; I686-K688 PolarHBondContact O-N 3.21Å; I686-L689 PolarHBondContact O-N 3.17Å; I686-T690 HydrophobicContact CG1-CG2 4.23Å; I686-T690 WeakPolarHBondContact O-CB 3.46Å; I686-T690 PolarHBondContact O-N 2.67Å; I686-T690 PolarHBondContact O-OG1 2.93Å; I686-A692 HydrophobicContact CD1-CB 4.48Å; I686-A692 HydrophobicContact CG1-CB 4.28Å; I686-V694 HydrophobicContact CG2-CB 4.29Å; I686-V694 HydrophobicContact CG2-CG2 3.82Å; I686-V720 HydrophobicContact CD1-CB 4.38Å; I686-V720 HydrophobicContact CD1-CG1 4.09Å; I686-V720 HydrophobicContact CG1-CB 4.45Å; I686-V720 HydrophobicContact CG1-CG1 4.03Å; I686-D722 HydrophobicContact CD1-CB 3.87Å; I686-D722 HydrophobicContact CG2-CB 4.13Å
687	N	93.2	Very high	90.5	Very high	46 Å²	46	52.9 Å²	52.9	25%	0.246	27%	0.265	C	S	.	.	H	α-helix	trans	-69.8	-22.6	175.1	-65.6	-0.6	0	0	0	113	S683 S684 L685 A692 V694	S683-N687 VanDerWaalsContact O-CG 3.25Å; S683-N687 PolarHBondContact O-N 3.39Å; S683-N687 PolarHBondContact O-OD1 3.35Å; S684-N687 PolarHBondContact O-N 3.37Å; L685-N687 VanDerWaalsContact C-N 3.32Å; L685-N687 PolarHBondContact O-N 3.21Å; N687-A692 PolarHBondContact OD1-O 3.3Å; N687-V694 PolarHBondContact ND2-O 3.2Å; N687-V694 WeakPolarHBondContact OD1-CB 3.38Å; N687-V694 PolarHBondContact OD1-N 3.04Å
688	K	92.1	Very high	90.6	Very high	121 Å²	121	56.4 Å²	56.4	53%	0.526	29%	0.291	S	S	.	.	H	α-helix	trans	-89.4	-32.2	173	-64.3	-58.3	-169.8	176.6	0	112.9	S684 L685 I686 T811 L814 I817	S684-K688 WeakPolarHBondContact O-CG 3.36Å; S684-K688 PolarHBondContact O-N 2.87Å; L685-K688 PolarHBondContact O-N 3.3Å; L685-K688 VanDerWaalsContact O-N 3.14Å; I686-K688 VanDerWaalsContact C-N 3.29Å; I686-K688 PolarHBondContact O-N 3.21Å; K688-T811 WeakPolarHBondContact CE-O 3.34Å; K688-L814 HydrophobicContact CB-CD2 4.4Å; K688-L814 HydrophobicContact CD-CD2 3.84Å; K688-L814 HydrophobicContact CG-CD2 4.07Å; K688-I817 HydrophobicContact CB-CD1 4.23Å
689	L	92	Very high	90.6	Very high	18 Å²	18	61.3 Å²	61.3	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-78.6	-31.5	178	-76.5	173.2	0	0	0	113.6	I674 L685 I686 I817 M820 R821	I674-L689 HydrophobicContact CD1-CD1 4.36Å; L685-L689 HydrophobicContact CD1-CD1 4.22Å; L685-L689 HydrophobicContact CD1-CG 4.24Å; L685-L689 HydrophobicContact CD2-CD1 4.31Å; L685-L689 HydrophobicContact CG-CD1 3.81Å; L685-L689 HydrophobicContact CG-CG 4.27Å; L685-L689 WeakPolarHBondContact O-CB 3.28Å; L685-L689 WeakPolarHBondContact O-CG 3.49Å; L685-L689 PolarHBondContact O-N 3.5Å; I686-L689 PolarHBondContact O-N 3.17Å; L689-I817 HydrophobicContact CD2-CG2 3.45Å; L689-I817 VanDerWaalsContact CD2-CG2 3.45Å; L689-I817 HydrophobicContact CG-CG2 4.06Å; L689-M820 HydrophobicContact CD1-CE 4.36Å; L689-R821 HydrophobicContact CD2-CB 3.96Å; L689-R821 HydrophobicContact CD2-CG 4.02Å
690	T	93.4	Very high	90.6	Very high	15 Å²	15	60.2 Å²	60.2	9%	0.092	31%	0.308	C	S	.	.	S	Bend	trans	-134.5	175.8	-169.6	76.9	0	0	0	0	111.4	I686 A692 H710 M711 V720	I686-T690 HydrophobicContact CG1-CG2 4.23Å; I686-T690 WeakPolarHBondContact O-CB 3.46Å; I686-T690 PolarHBondContact O-N 2.67Å; I686-T690 PolarHBondContact O-OG1 2.93Å; T690-A692 VanDerWaalsContact C-N 3.27Å; T690-A692 WeakPolarHBondContact OG1-CB 3.3Å; T690-A692 PolarHBondContact OG1-N 3.25Å; T690-A692 VanDerWaalsContact OG1-N 3.12Å; T690-H710 WeakPolarHBondContact CB-O 3.2Å; T690-M711 HydrophobicContact CG2-CB 4.32Å; T690-V720 HydrophobicContact CG2-CB 3.86Å; T690-V720 HydrophobicContact CG2-CG1 4.47Å; T690-V720 HydrophobicContact CG2-CG2 3.64Å
691	R	91.6	Very high	90.5	Very high	251 Å²	251	61.5 Å²	61.5	95%	0.947	31%	0.312	S	S	*	.	S	Bend	trans	-88.2	15.3	170.8	-58.7	-175.7	-177.5	-176.2	0.5	113.6
692	A	90	Very high	90.5	Very high	23 Å²	23	62.5 Å²	62.5	19%	0.19	32%	0.315	C	S	.	.			trans	-70.1	147.5	171.5	0	0	0	0	0	109.9	I686 N687 T690 V694	I686-A692 HydrophobicContact CD1-CB 4.48Å; I686-A692 HydrophobicContact CG1-CB 4.28Å; N687-A692 PolarHBondContact OD1-O 3.3Å; T690-A692 VanDerWaalsContact C-N 3.27Å; T690-A692 WeakPolarHBondContact OG1-CB 3.3Å; T690-A692 PolarHBondContact OG1-N 3.25Å; T690-A692 VanDerWaalsContact OG1-N 3.12Å; A692-V694 HydrophobicContact CB-CG2 4.32Å
693	D	91.1	Very high	90.5	Very high	155 Å²	155	62.3 Å²	62.3	83%	0.829	32%	0.315	S	S	*	.			trans	-118.6	92.9	174.7	-171.1	20.2	0	0	0	107.6
694	V	92	Very high	90.4	Very high	3 Å²	3	68.4 Å²	68.4	2%	0.018	34%	0.34	C	S	.	.			trans	-104.2	132.7	179.1	-173.5	0	0	0	0	108.7	I686 N687 A692 V696 T703 Y707	I686-V694 HydrophobicContact CG2-CB 4.29Å; I686-V694 HydrophobicContact CG2-CG2 3.82Å; N687-V694 PolarHBondContact ND2-O 3.2Å; N687-V694 WeakPolarHBondContact OD1-CB 3.38Å; N687-V694 PolarHBondContact OD1-N 3.04Å; A692-V694 HydrophobicContact CB-CG2 4.32Å; V694-V696 PolarHBondContact O-N 3.25Å; V694-T703 HydrophobicContact CG1-CG2 3.44Å; V694-T703 VanDerWaalsContact CG1-CG2 3.44Å; V694-Y707 HydrophobicContact CG1-CD2 4Å; V694-Y707 HydrophobicContact CG1-CE2 4.27Å; V694-Y707 HydrophobicContact CG1-CG 4.15Å; V694-Y707 HydrophobicContact CG2-CD1 4.17Å; V694-Y707 HydrophobicContact CG2-CG 4.01Å
695	E	90.7	Very high	90.4	Very high	112 Å²	112	69 Å²	69	52%	0.523	34%	0.344	S	S	.	.			trans	-63.7	128.1	-179.4	-163.8	-173.9	166.9	0	0	111.5	Q697	E695-Q697 HydrophobicContact CG-CG 4.11Å; E695-Q697 WeakPolarHBondContact OE1-CG 3.47Å; E695-Q697 PolarHBondContact OE1-NE2 2.91Å
696	V	90.5	Very high	90.4	Very high	69 Å²	69	69.3 Å²	69.3	42%	0.418	35%	0.346	S	S	.	.			trans	-113.2	119	178.1	-178.8	0	0	0	0	108.9	S684 V694	S684-V696 WeakPolarHBondContact OG-CG1 3.28Å; V694-V696 PolarHBondContact O-N 3.25Å
697	Q	90.3	Very high	90.4	Very high	81 Å²	81	73.6 Å²	73.6	38%	0.379	36%	0.363	S	S	.	.			trans	-135	159.5	177.6	-60.7	-69.7	-2.4	0	0	109.6	E695 Y699 T702	E695-Q697 HydrophobicContact CG-CG 4.11Å; E695-Q697 WeakPolarHBondContact OE1-CG 3.47Å; E695-Q697 PolarHBondContact OE1-NE2 2.91Å; Q697-Y699 VanDerWaalsContact C-N 3.34Å; Q697-Y699 HydrophobicContact CB-CD1 3.81Å; Q697-Y699 HydrophobicContact CB-CE1 3.38Å; Q697-Y699 HydrophobicContact CB-CE2 4.33Å; Q697-Y699 HydrophobicContact CB-CG 4.46Å; Q697-Y699 HydrophobicContact CG-CE1 3.76Å; Q697-Y699 PolarHBondContact O-N 3.47Å; Q697-T702 HydrophobicContact CB-CG2 3.72Å; Q697-T702 WeakPolarHBondContact O-CG2 3.17Å
698	P	88.2	Confident	90.4	Very high	109 Å²	109	73 Å²	73	71%	0.708	36%	0.361	S	S	*	.	S	Bend	trans	-82.9	-0.6	-175.4	32.5	-36.3	0	0	0	115	N679	N679-P698 PolarHBondContact ND2-O 3.37Å
699	Y	89.1	Confident	90.4	Very high	126 Å²	126	67.3 Å²	67.3	49%	0.494	34%	0.337	S	S	.	.	S	Bend	trans	-101.3	151.4	-179.5	57.8	-102.6	0	0	0	112.4	N679 Q697 T702	N679-Y699 PolarHBondContact OD1-O 3.43Å; Q697-Y699 VanDerWaalsContact C-N 3.34Å; Q697-Y699 HydrophobicContact CB-CD1 3.81Å; Q697-Y699 HydrophobicContact CB-CE1 3.38Å; Q697-Y699 HydrophobicContact CB-CE2 4.33Å; Q697-Y699 HydrophobicContact CB-CG 4.46Å; Q697-Y699 HydrophobicContact CG-CE1 3.76Å; Q697-Y699 PolarHBondContact O-N 3.47Å; Y699-T702 HydrophobicContact CD2-CG2 4.24Å; Y699-T702 HydrophobicContact CE2-CG2 4.13Å; Y699-T702 WeakPolarHBondContact O-CG2 3.39Å
700	A	85.6	Confident	90.5	Very high	49 Å²	49	70.9 Å²	70.9	41%	0.405	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	151.1	-177.3	0	0	0	0	0	113.2	P678 N679	P678-A700 HydrophobicContact CB-CB 3.66Å; P678-A700 HydrophobicContact CG-CB 4.23Å; N679-A700 PolarHBondContact OD1-N 3.23Å
701	F	85.7	Confident	90.5	Very high	51 Å²	51	70.8 Å²	70.8	22%	0.224	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	41.5	-179.7	-55.6	-80.6	0	0	0	115	P678 T703 G725 L727 I737 E738	P678-F701 HydrophobicContact CG-CE2 4.42Å; P678-F701 HydrophobicContact CG-CZ 4.35Å; F701-T703 VanDerWaalsContact C-N 3.32Å; F701-G725 WeakPolarHBondContact CE1-O 3.45Å; F701-L727 HydrophobicContact CE2-CD1 4.18Å; F701-L727 HydrophobicContact CZ-CD1 3.86Å; F701-L727 HydrophobicContact CZ-CG 4.14Å; F701-I737 HydrophobicContact CD1-CG2 4.08Å; F701-E738 HydrophobicContact CE1-CG 4.08Å
702	T	88.6	Confident	90.7	Very high	34 Å²	34	64.4 Å²	64.4	21%	0.209	34%	0.336	C	S	.	.	S	Bend	trans	-53.4	-50.2	167.3	64.5	0	0	0	0	111.1	Q697 Y699	Q697-T702 HydrophobicContact CB-CG2 3.72Å; Q697-T702 WeakPolarHBondContact O-CG2 3.17Å; Y699-T702 HydrophobicContact CD2-CG2 4.24Å; Y699-T702 HydrophobicContact CE2-CG2 4.13Å; Y699-T702 WeakPolarHBondContact O-CG2 3.39Å
703	T	90.3	Very high	90.9	Very high	6 Å²	6	64.7 Å²	64.7	4%	0.037	33%	0.332	C	S	.	.			trans	-89.6	118.7	173.2	51.8	0	0	0	0	109.9	S683 V694 F701 Y707 P724	S683-T703 WeakPolarHBondContact OG-CG2 3.35Å; V694-T703 HydrophobicContact CG1-CG2 3.44Å; V694-T703 VanDerWaalsContact CG1-CG2 3.44Å; F701-T703 VanDerWaalsContact C-N 3.32Å; T703-Y707 HydrophobicContact CG2-CD2 3.75Å; T703-Y707 HydrophobicContact CG2-CE2 3.68Å; T703-P724 WeakPolarHBondContact O-CB 3.37Å
704	K	89.4	Confident	91	Very high	137 Å²	137	62.6 Å²	62.6	60%	0.596	32%	0.316	S	S	*	.			trans	-102.9	-0.9	177.7	-61.7	-175.9	178.8	178.8	0	113.6	I737 Q740	K704-I737 HydrophobicContact CB-CD1 4.21Å; K704-I737 HydrophobicContact CD-CD1 4.41Å; K704-I737 HydrophobicContact CG-CD1 4.1Å; K704-Q740 PolarHBondContact O-NE2 2.88Å
705	S	90.5	Very high	91.1	Very high	41 Å²	41	73.9 Å²	73.9	29%	0.287	36%	0.36	S	S	.	.	S	Bend	trans	-147.3	158.5	-176.1	56.9	0	0	0	0	109.9	Y707	S705-Y707 VanDerWaalsContact O-CD2 3.23Å; S705-Y707 WeakPolarHBondContact O-CD2 3.36Å; S705-Y707 PolarHBondContact O-N 3.03Å
706	L	91.2	Very high	91.1	Very high	8 Å²	8	71 Å²	71	4%	0.042	35%	0.348	C	S	.	.			trans	-62.5	130.7	171.6	-57	175.5	0	0	0	110.7	F579 I665 I721 D722 T723 A744	F579-L706 HydrophobicContact CE2-CD1 4.28Å; F579-L706 HydrophobicContact CZ-CD1 3.99Å; I665-L706 HydrophobicContact CD1-CB 4.42Å; I665-L706 HydrophobicContact CD1-CD1 4.07Å; L706-I721 HydrophobicContact CB-CG2 4.38Å; L706-I721 HydrophobicContact CD2-CG2 4.29Å; L706-D722 WeakPolarHBondContact CA-O 3.21Å; L706-T723 HydrophobicContact CD2-CG2 4.02Å; L706-A744 HydrophobicContact CD1-CB 3.99Å; L706-A744 HydrophobicContact CD2-CB 4.07Å
707	Y	93.4	Very high	91.3	Very high	91 Å²	91	76.3 Å²	76.3	36%	0.357	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	149.8	170.7	-74	-89.6	0	0	0	110.5	V694 T703 S705 I721 D722	V694-Y707 HydrophobicContact CG1-CD2 4Å; V694-Y707 HydrophobicContact CG1-CE2 4.27Å; V694-Y707 HydrophobicContact CG1-CG 4.15Å; V694-Y707 HydrophobicContact CG2-CD1 4.17Å; V694-Y707 HydrophobicContact CG2-CG 4.01Å; T703-Y707 HydrophobicContact CG2-CD2 3.75Å; T703-Y707 HydrophobicContact CG2-CE2 3.68Å; S705-Y707 VanDerWaalsContact O-CD2 3.23Å; S705-Y707 WeakPolarHBondContact O-CD2 3.36Å; S705-Y707 PolarHBondContact O-N 3.03Å; Y707-I721 VanDerWaalsContact O-CA 3.31Å; Y707-I721 WeakPolarHBondContact O-CA 3.25Å; Y707-D722 PolarHBondContact N-O 2.75Å; Y707-D722 VanDerWaalsContact N-O 3.17Å; Y707-D722 PolarHBondContact O-N 2.96Å
708	V	92.5	Very high	91.5	Very high	33 Å²	33	72.5 Å²	72.5	20%	0.2	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	121.3	-177.8	-175.2	0	0	0	0	110.6	P663 I665 Q719 V720 I721	P663-V708 HydrophobicContact CB-CB 4.29Å; P663-V708 HydrophobicContact CB-CG2 3.69Å; P663-V708 HydrophobicContact CG-CG2 3.96Å; I665-V708 HydrophobicContact CD1-CG2 4.05Å; I665-V708 HydrophobicContact CG1-CG2 3.49Å; I665-V708 VanDerWaalsContact CG1-CG2 3.49Å; V708-Q719 HydrophobicContact CG1-CB 4.42Å; V708-V720 CarbonylContact C-O 3.59Å; V708-V720 WeakPolarHBondContact CA-O 3.01Å; V708-I721 HydrophobicContact CG2-CG1 4.48Å
709	G	92.6	Very high	91.7	Very high	2 Å²	2	68.2 Å²	68.2	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	161	166.1	0	0	0	0	0	111.5	V720	G709-V720 PolarHBondContact N-O 2.17Å; G709-V720 PolarHBondContact O-N 2.78Å
710	H	94.1	Very high	92	Very high	93 Å²	93	62.2 Å²	62.2	43%	0.431	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140	172.5	-66.3	-51.8	0	0	0	110.5	T690 W718	T690-H710 WeakPolarHBondContact CB-O 3.2Å; H710-W718 WeakPolarHBondContact CA-O 3.49Å; H710-W718 PolarHBondContact ND1-O 3.09Å
711	M	93.8	Very high	92.5	Very high	13 Å²	13	59.9 Å²	59.9	6%	0.064	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	155.9	172.2	65.7	-177.9	-175.9	0	0	109.8	L672 T690 W718 V720 R821	L672-M711 HydrophobicContact CD2-CE 4.05Å; T690-M711 HydrophobicContact CG2-CB 4.32Å; M711-W718 HydrophobicContact CE-CB 3.84Å; M711-W718 HydrophobicContact CE-CD2 4.41Å; M711-W718 HydrophobicContact CE-CE3 4.48Å; M711-W718 HydrophobicContact CE-CG 4.12Å; M711-W718 HydrophobicContact CG-CB 3.76Å; M711-W718 HydrophobicContact CG-CG 4.5Å; M711-W718 PolarHBondContact N-O 2.88Å; M711-W718 PolarHBondContact O-N 2.85Å; M711-V720 HydrophobicContact CE-CG2 3.83Å; M711-V720 HydrophobicContact CG-CG2 3.96Å; M711-V720 HydrophobicContact SD-CG2 3.69Å; M711-R821 HydrophobicContact CE-CG 4.02Å; M711-R821 HydrophobicContact SD-CG 3.84Å
712	D	95	Very high	92.8	Very high	116 Å²	116	57.5 Å²	57.5	62%	0.62	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	130	175.5	-64.6	-46.4	0	0	0	109.6	L716	D712-L716 WeakPolarHBondContact CA-O 3.48Å
713	Y	94.7	Very high	92.9	Very high	29 Å²	29	55.9 Å²	55.9	11%	0.114	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	135.9	179.3	177.3	-101.6	0	0	0	110.2	Y715 L716 W718 N822 C825 D826	Y713-Y715 PolarHBondContact O-N 3.39Å; Y713-L716 PolarHBondContact N-O 2.96Å; Y713-L716 WeakPolarHBondContact O-CB 3.32Å; Y713-L716 PolarHBondContact O-N 3.13Å; Y713-W718 HydrophobicContact CD1-CZ2 4.47Å; Y713-W718 PolarHBondContact O-NE1 3.4Å; Y713-N822 HydrophobicContact CE2-CB 4.11Å; Y713-N822 WeakPolarHBondContact CE2-OD1 3.41Å; Y713-C825 HydrophobicContact CD1-CB 3.31Å; Y713-C825 HydrophobicContact CE1-CB 3.38Å; Y713-C825 HydrophobicContact CG-CB 4.2Å; Y713-D826 WeakPolarHBondContact CE1-OD1 3.48Å; Y713-D826 PolarHBondContact OH-OD1 3.47Å; Y713-D826 PolarHBondContact OH-OD2 3.03Å
714	K	93.4	Very high	92.9	Very high	111 Å²	111	55.6 Å²	55.6	48%	0.483	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	41.3	-170.7	-72.1	-179.4	176.3	170.8	0	113.5	L716 D826 L829	K714-L716 PolarHBondContact O-N 2.95Å; K714-D826 WeakPolarHBondContact CE-OD1 3.2Å; K714-D826 IonicContact NZ-OD1 3.42Å; K714-D826 PolarHBondContact NZ-OD1 2.96Å; K714-D826 IonicContact NZ-OD2 2.69Å; K714-D826 PolarHBondContact NZ-OD2 2.88Å; K714-L829 HydrophobicContact CD-CD1 4.04Å
715	Y	92.4	Very high	92.7	Very high	240 Å²	240	49.2 Å²	49.2	94%	0.941	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	17.1	-175.6	-48	-78.3	0	0	0	115.3	Y713	Y713-Y715 PolarHBondContact O-N 3.39Å
716	L	92.6	Very high	92.5	Very high	53 Å²	53	47.2 Å²	47.2	28%	0.277	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.5	177.2	-59.9	169.3	0	0	0	109.1	D712 Y713 K714 L829	D712-L716 WeakPolarHBondContact CA-O 3.48Å; Y713-L716 PolarHBondContact N-O 2.96Å; Y713-L716 WeakPolarHBondContact O-CB 3.32Å; Y713-L716 PolarHBondContact O-N 3.13Å; K714-L716 PolarHBondContact O-N 2.95Å; L716-L829 HydrophobicContact CD1-CD2 3.77Å
717	R	92.8	Very high	92.1	Very high	179 Å²	179	49.4 Å²	49.4	68%	0.675	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	135.4	171.3	-170.8	178.7	-61.9	159	3.4	110.3
718	W	94.6	Very high	91.4	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	151.3	177.3	-65.7	75.4	0	0	0	110.7	R670 H710 M711 Y713 C825 L828 L829	R670-W718 HydrophobicContact CB-CD2 3.9Å; R670-W718 HydrophobicContact CB-CE3 3.68Å; R670-W718 HydrophobicContact CB-CH2 4.14Å; R670-W718 HydrophobicContact CB-CZ2 4.37Å; R670-W718 HydrophobicContact CB-CZ3 3.84Å; R670-W718 HydrophobicContact CG-CH2 4.4Å; H710-W718 WeakPolarHBondContact CA-O 3.49Å; H710-W718 PolarHBondContact ND1-O 3.09Å; M711-W718 HydrophobicContact CE-CB 3.84Å; M711-W718 HydrophobicContact CE-CD2 4.41Å; M711-W718 HydrophobicContact CE-CE3 4.48Å; M711-W718 HydrophobicContact CE-CG 4.12Å; M711-W718 HydrophobicContact CG-CB 3.76Å; M711-W718 HydrophobicContact CG-CG 4.5Å; M711-W718 PolarHBondContact N-O 2.88Å; M711-W718 PolarHBondContact O-N 2.85Å; Y713-W718 HydrophobicContact CD1-CZ2 4.47Å; Y713-W718 PolarHBondContact O-NE1 3.4Å; W718-C825 VanDerWaalsContact CH2-CA 3.47Å; W718-C825 HydrophobicContact CH2-CB 3.66Å; W718-C825 WeakPolarHBondContact CH2-O 3.45Å; W718-C825 HydrophobicContact CZ2-CB 3.68Å; W718-C825 HydrophobicContact CZ3-CB 4.06Å; W718-L828 HydrophobicContact CE3-CD2 4.49Å; W718-L828 HydrophobicContact CH2-CB 4.09Å; W718-L828 HydrophobicContact CH2-CD2 4.16Å; W718-L828 HydrophobicContact CZ3-CB 4.11Å; W718-L828 HydrophobicContact CZ3-CD2 3.57Å; W718-L828 HydrophobicContact CZ3-CG 4.35Å; W718-L829 HydrophobicContact CH2-CD2 4.39Å; W718-L829 HydrophobicContact CH2-CG 4.02Å; W718-L829 HydrophobicContact CZ2-CD1 4.05Å; W718-L829 HydrophobicContact CZ2-CD2 4.02Å; W718-L829 HydrophobicContact CZ2-CG 3.82Å
719	Q	94	Very high	90.9	Very high	20 Å²	20	49.8 Å²	49.8	9%	0.093	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.7	168.1	-52.3	-168.6	-1.4	0	0	108	T669 R670 T671 L672 V708	T669-Q719 PolarHBondContact OG1-NE2 3.29Å; T669-Q719 VanDerWaalsContact OG1-NE2 3.13Å; R670-Q719 PolarHBondContact O-N 3Å; T671-Q719 CarbonylContact C-O 3.54Å; T671-Q719 VanDerWaalsContact CA-O 3.3Å; T671-Q719 WeakPolarHBondContact CA-O 3.43Å; T671-Q719 HydrophobicContact CG2-CB 3.87Å; T671-Q719 HydrophobicContact CG2-CG 4.46Å; L672-Q719 PolarHBondContact N-O 3.34Å; V708-Q719 HydrophobicContact CG1-CB 4.42Å
720	V	95	Very high	90.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	124.3	171.6	-175.6	0	0	0	0	106.8	L672 I674 I686 T690 V708 G709 M711	L672-V720 HydrophobicContact CB-CG2 4.47Å; L672-V720 HydrophobicContact CD2-CG2 4.44Å; L672-V720 CarbonylContact O-C 3.59Å; L672-V720 WeakPolarHBondContact O-CA 3.23Å; I674-V720 HydrophobicContact CD1-CG1 3.68Å; I674-V720 HydrophobicContact CG1-CG1 4.09Å; I686-V720 HydrophobicContact CD1-CB 4.38Å; I686-V720 HydrophobicContact CD1-CG1 4.09Å; I686-V720 HydrophobicContact CG1-CB 4.45Å; I686-V720 HydrophobicContact CG1-CG1 4.03Å; T690-V720 HydrophobicContact CG2-CB 3.86Å; T690-V720 HydrophobicContact CG2-CG1 4.47Å; T690-V720 HydrophobicContact CG2-CG2 3.64Å; V708-V720 CarbonylContact C-O 3.59Å; V708-V720 WeakPolarHBondContact CA-O 3.01Å; G709-V720 PolarHBondContact N-O 2.17Å; G709-V720 PolarHBondContact O-N 2.78Å; M711-V720 HydrophobicContact CE-CG2 3.83Å; M711-V720 HydrophobicContact CG-CG2 3.96Å; M711-V720 HydrophobicContact SD-CG2 3.69Å
721	I	94.7	Very high	89.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117	-176.6	-56.1	179.7	0	0	0	108.3	I665 T671 L672 I673 I674 L706 Y707 V708 I748	I665-I721 HydrophobicContact CD1-CD1 4.46Å; I665-I721 HydrophobicContact CG1-CD1 4.47Å; I665-I721 HydrophobicContact CG2-CD1 3.98Å; T671-I721 HydrophobicContact CG2-CD1 4.08Å; L672-I721 PolarHBondContact O-N 3.15Å; I673-I721 HydrophobicContact CG1-CB 4.31Å; I673-I721 HydrophobicContact CG1-CD1 4.47Å; I674-I721 PolarHBondContact N-O 2.86Å; L706-I721 HydrophobicContact CB-CG2 4.38Å; L706-I721 HydrophobicContact CD2-CG2 4.29Å; Y707-I721 VanDerWaalsContact O-CA 3.31Å; Y707-I721 WeakPolarHBondContact O-CA 3.25Å; V708-I721 HydrophobicContact CG2-CG1 4.48Å; I721-I748 HydrophobicContact CD1-CD1 3.62Å
722	D	92.9	Very high	88.7	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.5	168.8	-171.8	28.3	0	0	0	108.9	K682 S683 I686 L706 Y707	K682-D722 VanDerWaalsContact CB-OD1 3.22Å; K682-D722 WeakPolarHBondContact CB-OD1 3.38Å; S683-D722 WeakPolarHBondContact CA-OD2 3.24Å; S683-D722 WeakPolarHBondContact CB-OD2 3.46Å; S683-D722 PolarHBondContact OG-OD2 2.85Å; I686-D722 HydrophobicContact CD1-CB 3.87Å; I686-D722 HydrophobicContact CG2-CB 4.13Å; L706-D722 WeakPolarHBondContact CA-O 3.21Å; Y707-D722 PolarHBondContact N-O 2.75Å; Y707-D722 VanDerWaalsContact N-O 3.17Å; Y707-D722 PolarHBondContact O-N 2.96Å
723	T	91.5	Very high	88.3	Confident	0 Å²	0	64 Å²	64	0%	0	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-103	148.1	178.5	64.3	0	0	0	0	110.6	I673 I674 C675 K682 L706 A741	I673-T723 HydrophobicContact CG2-CG2 3.51Å; I674-T723 PolarHBondContact O-N 3.35Å; I674-T723 PolarHBondContact O-OG1 3.27Å; C675-T723 PolarHBondContact SG-OG1 3.02Å; C675-T723 VanDerWaalsContact SG-OG1 3.4Å; K682-T723 WeakPolarHBondContact CE-O 3.36Å; K682-T723 PolarHBondContact NZ-O 2.88Å; K682-T723 PolarHBondContact NZ-OG1 3.48Å; L706-T723 HydrophobicContact CD2-CG2 4.02Å; T723-A741 HydrophobicContact CG2-CB 4.35Å
724	P	89.9	Confident	87.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-55.6	158.5	167.2	21.8	-29.3	0	0	0	111.1	K682 T703 I737 A741	K682-P724 VanDerWaalsContact NZ-C 3.31Å; K682-P724 PolarHBondContact NZ-O 2.99Å; T703-P724 WeakPolarHBondContact O-CB 3.37Å; P724-I737 HydrophobicContact CB-CG2 3.46Å; P724-I737 VanDerWaalsContact CB-CG2 3.46Å; P724-I737 HydrophobicContact CG-CG2 3.87Å; P724-I737 WeakPolarHBondContact CG-O 3.48Å; P724-A741 HydrophobicContact CG-CB 4.03Å
725	G	84.7	Confident	87.6	Confident	3 Å²	3	62.6 Å²	62.6	3%	0.031	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-56.3	142.1	171.9	0	0	0	0	0	111	F701	F701-G725 WeakPolarHBondContact CE1-O 3.45Å
726	I	86.1	Confident	87.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.275	C	S	.	.			trans	-110.8	138.8	171.5	-52.4	170.1	0	0	0	106.9	G676 A741 I742 L745 L760 I764	G676-I726 PolarHBondContact O-N 3.39Å; I726-A741 HydrophobicContact CD1-CB 3.81Å; I726-A741 HydrophobicContact CG1-CB 3.73Å; I726-I742 HydrophobicContact CD1-CD1 4.02Å; I726-I742 HydrophobicContact CG2-CD1 4.37Å; I726-L745 HydrophobicContact CD1-CD1 3.86Å; I726-L760 HydrophobicContact CB-CD2 4.43Å; I726-L760 HydrophobicContact CG2-CD1 4.22Å; I726-L760 WeakPolarHBondContact O-CD2 3.28Å; I726-I764 HydrophobicContact CB-CD1 4.31Å; I726-I764 HydrophobicContact CD1-CD1 3.87Å; I726-I764 HydrophobicContact CG2-CD1 3.94Å
727	L	84.2	Confident	87.4	Confident	53 Å²	53	54.8 Å²	54.8	28%	0.277	27%	0.271	S	S	.	.			trans	-107.8	161.4	172.1	-60.7	175	0	0	0	112	F677 P678 F701 Q729 E738	F677-L727 HydrophobicContact CD1-CD2 4.29Å; P678-L727 HydrophobicContact CG-CD2 4.03Å; F701-L727 HydrophobicContact CE2-CD1 4.18Å; F701-L727 HydrophobicContact CZ-CD1 3.86Å; F701-L727 HydrophobicContact CZ-CG 4.14Å; L727-Q729 HydrophobicContact CB-CG 4.41Å; L727-Q729 PolarHBondContact O-N 3.07Å; L727-E738 WeakPolarHBondContact CB-OE1 3.47Å; L727-E738 WeakPolarHBondContact CG-OE1 3.39Å; L727-E738 PolarHBondContact N-OE1 2.91Å; L727-E738 VanDerWaalsContact N-OE1 3.08Å
728	D	78.7	Confident	87.3	Confident	73 Å²	73	46.2 Å²	46.2	39%	0.39	24%	0.239	S	C	.	.	S	Bend	trans	-73.9	73.5	174.4	-82.4	-46.5	0	0	0	111.2	T759 L760 S763	D728-T759 PolarHBondContact OD2-OG1 2.57Å; D728-L760 HydrophobicContact CB-CD1 4.49Å; D728-L760 VanDerWaalsContact OD1-CA 3.25Å; D728-L760 WeakPolarHBondContact OD1-CA 3.4Å; D728-L760 WeakPolarHBondContact OD1-CD1 3.41Å; D728-L760 PolarHBondContact OD2-N 2.95Å; D728-S763 PolarHBondContact OD1-OG 3.32Å
729	Q	81.5	Confident	87.1	Confident	60 Å²	60	48.8 Å²	48.8	28%	0.28	25%	0.252	S	S	.	.			trans	-120.9	148.2	175.2	-68.6	-176.6	-16.8	0	0	111.5	L727 R734	L727-Q729 HydrophobicContact CB-CG 4.41Å; L727-Q729 PolarHBondContact O-N 3.07Å; Q729-R734 HydrophobicContact CB-CG 4.03Å; Q729-R734 VanDerWaalsContact O-CZ 3.25Å; Q729-R734 PolarHBondContact O-NE 3.39Å; Q729-R734 PolarHBondContact O-NH2 3.42Å
730	P	80	Confident	87	Confident	79 Å²	79	48.3 Å²	48.3	51%	0.513	25%	0.25	S	C	.	.			trans	-54.5	149.6	167.8	-23.5	34	0	0	0	112	E732 E733 R734	P730-E732 PolarHBondContact O-N 3.17Å; P730-E732 VanDerWaalsContact O-N 3.08Å; P730-E733 WeakPolarHBondContact CD-OE2 3.16Å; P730-E733 PolarHBondContact O-N 3.35Å; P730-E733 VanDerWaalsContact O-N 3.09Å; P730-R734 WeakPolarHBondContact O-CG 3.43Å; P730-R734 PolarHBondContact O-N 3.48Å
731	L	75.9	Confident	86.9	Confident	114 Å²	114	48.3 Å²	48.3	60%	0.597	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-27.4	-175.6	-72.7	171.6	0	0	0	114.1
732	E	78.1	Confident	86.7	Confident	196 Å²	196	49 Å²	49	92%	0.916	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-25.1	-178.7	-60.4	-178.5	179.1	0	0	113.3	P730	P730-E732 PolarHBondContact O-N 3.17Å; P730-E732 VanDerWaalsContact O-N 3.08Å
733	E	85.5	Confident	86.6	Confident	133 Å²	133	49.6 Å²	49.6	62%	0.621	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-10.3	-176.2	-61.6	-175.3	158.8	0	0	113.2	P730	P730-E733 WeakPolarHBondContact CD-OE2 3.16Å; P730-E733 PolarHBondContact O-N 3.35Å; P730-E733 VanDerWaalsContact O-N 3.09Å
734	R	85.8	Confident	86.7	Confident	27 Å²	27	49.6 Å²	49.6	10%	0.102	26%	0.256	C	S	.	.			trans	-64.5	139.1	-175.1	-77.6	176	-168.2	-165.6	-3.3	113	Q729 P730 E738 M739 I742	Q729-R734 HydrophobicContact CB-CG 4.03Å; Q729-R734 VanDerWaalsContact O-CZ 3.25Å; Q729-R734 PolarHBondContact O-NE 3.39Å; Q729-R734 PolarHBondContact O-NH2 3.42Å; P730-R734 WeakPolarHBondContact O-CG 3.43Å; P730-R734 PolarHBondContact O-N 3.48Å; R734-E738 HydrophobicContact CB-CB 4.38Å; R734-M739 HydrophobicContact CB-CG 4.16Å; R734-M739 HydrophobicContact CB-SD 4.04Å; R734-I742 VanDerWaalsContact NH1-CD1 3.25Å
735	N	88.9	Confident	86.8	Confident	84 Å²	84	49.6 Å²	49.6	45%	0.449	26%	0.256	S	S	.	.			trans	-68.3	155.3	179.8	-67	-78.5	0	0	0	112.2	I737 E738 M739	N735-I737 PolarHBondContact O-N 2.98Å; N735-E738 HydrophobicContact CB-CG 4.34Å; N735-E738 WeakPolarHBondContact CB-OE2 3.27Å; N735-E738 PolarHBondContact N-OE2 2.81Å; N735-E738 PolarHBondContact ND2-OE2 3.07Å; N735-E738 PolarHBondContact O-N 3.08Å; N735-M739 WeakPolarHBondContact O-CG 3.46Å; N735-M739 PolarHBondContact O-N 2.82Å
736	T	89.9	Confident	87	Confident	89 Å²	89	51.6 Å²	51.6	55%	0.546	27%	0.273	S	S	.	.	H	α-helix	trans	-58.2	-23.3	174.7	57.9	0	0	0	0	113.5	I586 Q740	I586-T736 HydrophobicContact CG2-CG2 4.4Å; I586-T736 WeakPolarHBondContact CG2-O 3.36Å; T736-Q740 WeakPolarHBondContact O-CG 3.16Å; T736-Q740 PolarHBondContact O-NE2 3.4Å
737	I	90.5	Very high	87.3	Confident	39 Å²	39	54.3 Å²	54.3	20%	0.2	29%	0.286	C	S	.	.	H	α-helix	trans	-71	-47.2	172.3	-64.5	170.8	0	0	0	110.4	F701 K704 P724 N735 Q740	F701-I737 HydrophobicContact CD1-CG2 4.08Å; K704-I737 HydrophobicContact CB-CD1 4.21Å; K704-I737 HydrophobicContact CD-CD1 4.41Å; K704-I737 HydrophobicContact CG-CD1 4.1Å; P724-I737 HydrophobicContact CB-CG2 3.46Å; P724-I737 VanDerWaalsContact CB-CG2 3.46Å; P724-I737 HydrophobicContact CG-CG2 3.87Å; P724-I737 WeakPolarHBondContact CG-O 3.48Å; N735-I737 PolarHBondContact O-N 2.98Å; I737-Q740 WeakPolarHBondContact O-CB 3.39Å; I737-Q740 PolarHBondContact O-N 3.15Å
738	E	90.2	Very high	87.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69.3	-37.8	-179.1	-62.8	171.8	125.3	0	0	111.1	F701 L727 R734 N735 Q740 A741 I742	F701-E738 HydrophobicContact CE1-CG 4.08Å; L727-E738 WeakPolarHBondContact CB-OE1 3.47Å; L727-E738 WeakPolarHBondContact CG-OE1 3.39Å; L727-E738 PolarHBondContact N-OE1 2.91Å; L727-E738 VanDerWaalsContact N-OE1 3.08Å; R734-E738 HydrophobicContact CB-CB 4.38Å; N735-E738 HydrophobicContact CB-CG 4.34Å; N735-E738 WeakPolarHBondContact CB-OE2 3.27Å; N735-E738 PolarHBondContact N-OE2 2.81Å; N735-E738 PolarHBondContact ND2-OE2 3.07Å; N735-E738 PolarHBondContact O-N 3.08Å; E738-Q740 PolarHBondContact O-N 3.34Å; E738-A741 WeakPolarHBondContact O-CA 3.41Å; E738-A741 WeakPolarHBondContact O-CB 3.27Å; E738-A741 PolarHBondContact O-N 3.23Å; E738-I742 PolarHBondContact O-N 3.16Å
739	M	91.1	Very high	88.1	Confident	54 Å²	54	54.7 Å²	54.7	27%	0.266	28%	0.278	S	S	.	.	H	α-helix	trans	-60.8	-23.9	174.6	-68.8	-61.8	-75	0	0	113.3	I586 R734 N735 T743	I586-M739 HydrophobicContact CD1-CB 3.76Å; I586-M739 WeakPolarHBondContact CD1-O 3.3Å; I586-M739 HydrophobicContact CG1-CB 4.13Å; I586-M739 HydrophobicContact CG2-CB 4.05Å; R734-M739 HydrophobicContact CB-CG 4.16Å; R734-M739 HydrophobicContact CB-SD 4.04Å; N735-M739 WeakPolarHBondContact O-CG 3.46Å; N735-M739 PolarHBondContact O-N 2.82Å; M739-T743 PolarHBondContact O-N 3.16Å; M739-T743 PolarHBondContact O-OG1 2.83Å
740	Q	92.1	Very high	88.6	Confident	11 Å²	11	51.9 Å²	51.9	5%	0.051	27%	0.265	C	S	.	.	H	α-helix	trans	-69.8	-37	169.8	-67.3	169.9	56.3	0	0	112.3	L583 K704 T736 I737 E738 T743 A744	L583-Q740 HydrophobicContact CD1-CB 4.33Å; L583-Q740 HydrophobicContact CD1-CG 3.79Å; K704-Q740 PolarHBondContact O-NE2 2.88Å; T736-Q740 WeakPolarHBondContact O-CG 3.16Å; T736-Q740 PolarHBondContact O-NE2 3.4Å; I737-Q740 WeakPolarHBondContact O-CB 3.39Å; I737-Q740 PolarHBondContact O-N 3.15Å; E738-Q740 PolarHBondContact O-N 3.34Å; Q740-T743 WeakPolarHBondContact CA-OG1 3.3Å; Q740-T743 PolarHBondContact O-OG1 2.81Å; Q740-A744 PolarHBondContact O-N 2.85Å; Q740-A744 VanDerWaalsContact O-N 3.16Å
741	A	91.6	Very high	89.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.9	-41.6	173	0	0	0	0	0	111	T723 P724 I726 E738 A744 L745	T723-A741 HydrophobicContact CG2-CB 4.35Å; P724-A741 HydrophobicContact CG-CB 4.03Å; I726-A741 HydrophobicContact CD1-CB 3.81Å; I726-A741 HydrophobicContact CG1-CB 3.73Å; E738-A741 WeakPolarHBondContact O-CA 3.41Å; E738-A741 WeakPolarHBondContact O-CB 3.27Å; E738-A741 PolarHBondContact O-N 3.23Å; A741-A744 PolarHBondContact O-N 3.2Å; A741-L745 WeakPolarHBondContact O-CB 3.37Å; A741-L745 PolarHBondContact O-N 3.01Å
742	I	91.3	Very high	90.1	Very high	14 Å²	14	42.7 Å²	42.7	7%	0.072	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-40.6	177.6	-58.5	-53.2	0	0	0	112.1	I726 R734 E738 L745 A746 L767	I726-I742 HydrophobicContact CD1-CD1 4.02Å; I726-I742 HydrophobicContact CG2-CD1 4.37Å; R734-I742 VanDerWaalsContact NH1-CD1 3.25Å; E738-I742 PolarHBondContact O-N 3.16Å; I742-L745 CarbonylContact O-C 3.59Å; I742-L745 PolarHBondContact O-N 2.78Å; I742-A746 WeakPolarHBondContact O-CB 3.43Å; I742-A746 PolarHBondContact O-N 2.67Å; I742-L767 HydrophobicContact CD1-CD1 3.99Å; I742-L767 HydrophobicContact CG2-CD1 4.03Å
743	T	91.9	Very high	90.7	Very high	12 Å²	12	33.3 Å²	33.3	7%	0.074	17%	0.168	C	C	.	.	H	α-helix	trans	-69.1	-34.3	175.8	41.5	0	0	0	0	113.6	D582 I586 M739 Q740 H747	D582-T743 HydrophobicContact CB-CG2 3.79Å; I586-T743 HydrophobicContact CD1-CG2 3.4Å; M739-T743 PolarHBondContact O-N 3.16Å; M739-T743 PolarHBondContact O-OG1 2.83Å; Q740-T743 WeakPolarHBondContact CA-OG1 3.3Å; Q740-T743 PolarHBondContact O-OG1 2.81Å; T743-H747 PolarHBondContact O-CD2 3.13Å; T743-H747 PolarHBondContact O-N 2.95Å; T743-H747 VanDerWaalsContact O-N 3.15Å
744	A	92.7	Very high	91	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.6	-47.6	169	0	0	0	0	0	111.4	F579 L706 Q740 A741 A746 I748	F579-A744 HydrophobicContact CE2-CB 4.27Å; L706-A744 HydrophobicContact CD1-CB 3.99Å; L706-A744 HydrophobicContact CD2-CB 4.07Å; Q740-A744 PolarHBondContact O-N 2.85Å; Q740-A744 VanDerWaalsContact O-N 3.16Å; A741-A744 PolarHBondContact O-N 3.2Å; A744-A746 VanDerWaalsContact C-N 3.33Å; A744-A746 PolarHBondContact O-N 2.98Å; A744-I748 HydrophobicContact CB-CD1 4.04Å; A744-I748 WeakPolarHBondContact O-CB 3.41Å; A744-I748 WeakPolarHBondContact O-CG1 3.15Å; A744-I748 PolarHBondContact O-N 3.46Å
745	L	91	Very high	91	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.7	-30.9	178	-84.2	178	0	0	0	113.7	I673 I726 A741 I742 V752 I764 F768 K771	I673-L745 HydrophobicContact CG2-CD2 4.26Å; I726-L745 HydrophobicContact CD1-CD1 3.86Å; A741-L745 WeakPolarHBondContact O-CB 3.37Å; A741-L745 PolarHBondContact O-N 3.01Å; I742-L745 CarbonylContact O-C 3.59Å; I742-L745 PolarHBondContact O-N 2.78Å; L745-V752 HydrophobicContact CD2-CG1 3.97Å; L745-V752 HydrophobicContact CD2-CG2 3.9Å; L745-I764 HydrophobicContact CD1-CG2 4.02Å; L745-F768 HydrophobicContact CD1-CE1 4.39Å; L745-F768 HydrophobicContact CD2-CE1 4Å; L745-K771 PolarHBondContact O-NZ 3.17Å
746	A	91	Very high	90.2	Very high	45 Å²	45	23.3 Å²	23.3	37%	0.372	12%	0.12	S	C	.	.	H	α-helix	trans	-74.6	-60	176.1	0	0	0	0	0	111.3	I742 A744 K771	I742-A746 WeakPolarHBondContact O-CB 3.43Å; I742-A746 PolarHBondContact O-N 2.67Å; A744-A746 VanDerWaalsContact C-N 3.33Å; A744-A746 PolarHBondContact O-N 2.98Å; A746-K771 PolarHBondContact O-NZ 3.03Å
747	H	91.1	Very high	88.8	Confident	58 Å²	58	22.7 Å²	22.7	27%	0.269	11%	0.114	S	C	.	.	H	α-helix	trans	-86.1	-25.7	-163.3	-69.9	-71.4	0	0	0	116.1	P578 F579 D582 T743	P578-H747 VanDerWaalsContact CB-CE1 3.45Å; P578-H747 WeakPolarHBondContact CB-CE1 3.3Å; F579-H747 HydrophobicContact CB-CB 3.66Å; F579-H747 HydrophobicContact CD2-CB 4.15Å; F579-H747 HydrophobicContact CG-CB 4.36Å; D582-H747 IonicContact OD2-CD2 2.62Å; D582-H747 IonicContact OD2-CE1 2.75Å; D582-H747 PolarHBondContact OD2-CE1 3.13Å; D582-H747 IonicContact OD2-NE2 3.13Å; D582-H747 PolarHBondContact OD2-NE2 2.8Å; T743-H747 PolarHBondContact O-CD2 3.13Å; T743-H747 PolarHBondContact O-N 2.95Å; T743-H747 VanDerWaalsContact O-N 3.15Å
748	I	91.7	Very high	87.3	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.			trans	-86.2	132.3	-172.1	-56	179.2	0	0	0	110.2	F579 I665 T671 I673 I721 A744 A750 K771	F579-I748 HydrophobicContact CD2-CD1 4.18Å; F579-I748 HydrophobicContact CD2-CG1 3.98Å; F579-I748 HydrophobicContact CE2-CD1 3.8Å; F579-I748 HydrophobicContact CE2-CG1 4.13Å; F579-I748 HydrophobicContact CG-CG1 4.37Å; F579-I748 HydrophobicContact CZ-CD1 4.01Å; I665-I748 HydrophobicContact CG2-CD1 4.03Å; T671-I748 HydrophobicContact CG2-CG2 3.81Å; T671-I748 VanDerWaalsContact OG1-CG2 3.25Å; T671-I748 WeakPolarHBondContact OG1-CG2 3.43Å; I673-I748 HydrophobicContact CD1-CB 4.02Å; I673-I748 HydrophobicContact CD1-CD1 4.45Å; I673-I748 HydrophobicContact CD1-CG2 4.22Å; I721-I748 HydrophobicContact CD1-CD1 3.62Å; A744-I748 HydrophobicContact CB-CD1 4.04Å; A744-I748 WeakPolarHBondContact O-CB 3.41Å; A744-I748 WeakPolarHBondContact O-CG1 3.15Å; A744-I748 PolarHBondContact O-N 3.46Å; I748-A750 VanDerWaalsContact C-N 3.33Å; I748-A750 HydrophobicContact CG2-CB 4.11Å; I748-A750 PolarHBondContact O-N 3.09Å; I748-A750 VanDerWaalsContact O-N 3.08Å; I748-K771 PolarHBondContact O-NZ 3.11Å
749	R	88.3	Confident	85.9	Confident	133 Å²	133	26.2 Å²	26.2	50%	0.502	14%	0.136	S	C	.	.			trans	-83.1	74.9	175.4	-68.6	-167	-173.1	-163	3.9	111.5	T671 R832 E835	T671-R749 PolarHBondContact OG1-O 3.22Å; R749-R832 PolarHBondContact O-NH2 2.75Å; R749-E835 IonicContact CZ-OE1 2.7Å; R749-E835 IonicContact NH1-OE1 2.65Å; R749-E835 PolarHBondContact NH1-OE1 3.15Å; R749-E835 IonicContact NH1-OE2 2.78Å
750	A	92.2	Very high	84.9	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.008	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	164.2	-174.2	0	0	0	0	0	113.6	T671 I673 I748	T671-A750 CarbonylContact O-C 3.59Å; T671-A750 WeakPolarHBondContact O-CA 3.49Å; T671-A750 VanDerWaalsContact O-CB 3.28Å; T671-A750 WeakPolarHBondContact O-CB 3.41Å; T671-A750 WeakPolarHBondContact OG1-CA 3.16Å; T671-A750 WeakPolarHBondContact OG1-CB 3.35Å; I673-A750 HydrophobicContact CB-CB 4.36Å; I673-A750 HydrophobicContact CD1-CB 3.51Å; I673-A750 HydrophobicContact CG1-CB 3.54Å; I748-A750 VanDerWaalsContact C-N 3.33Å; I748-A750 HydrophobicContact CG2-CB 4.11Å; I748-A750 PolarHBondContact O-N 3.09Å; I748-A750 VanDerWaalsContact O-N 3.08Å
751	A	93.5	Very high	84.2	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	140.4	149.4	0	0	0	0	0	109.2	T671 L672 I673 P772 L774 L828	T671-A751 PolarHBondContact O-N 2.95Å; L672-A751 WeakPolarHBondContact CA-O 3.27Å; L672-A751 HydrophobicContact CD1-CB 3.9Å; I673-A751 PolarHBondContact N-O 2.89Å; A751-P772 WeakPolarHBondContact CA-O 3.32Å; A751-P772 HydrophobicContact CB-CG 4.02Å; A751-L774 HydrophobicContact CB-CD1 4.46Å; A751-L828 HydrophobicContact CB-CB 4.21Å; A751-L828 HydrophobicContact CB-CD2 4.44Å
752	V	93	Very high	83.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.4	178.4	-176.8	0	0	0	0	109.1	C675 L745 F768 K771 P772 V773 L774	C675-V752 HydrophobicContact CB-CG1 4.37Å; L745-V752 HydrophobicContact CD2-CG1 3.97Å; L745-V752 HydrophobicContact CD2-CG2 3.9Å; V752-F768 HydrophobicContact CG1-CD1 4.27Å; V752-F768 HydrophobicContact CG1-CE1 3.79Å; V752-F768 HydrophobicContact CG1-CZ 4.38Å; V752-F768 HydrophobicContact CG2-CD1 4.27Å; V752-K771 HydrophobicContact CG2-CB 4.41Å; V752-K771 HydrophobicContact CG2-CD 4.4Å; V752-P772 PolarHBondContact N-O 3.44Å; V752-V773 WeakPolarHBondContact O-CA 3.49Å; V752-L774 PolarHBondContact O-N 3.23Å
753	L	92	Very high	82.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	110.6	167.5	179.8	67.3	0	0	0	108.5	L672 I673 I674 C675 L685 I755 L774 M820	L672-L753 HydrophobicContact CD1-CB 4.29Å; I673-L753 PolarHBondContact O-N 3.19Å; I674-L753 HydrophobicContact CG1-CD2 4.39Å; I674-L753 HydrophobicContact CG2-CD2 4.44Å; C675-L753 PolarHBondContact N-O 3.27Å; L685-L753 HydrophobicContact CD2-CD2 3.51Å; L753-I755 HydrophobicContact CG-CG1 4.42Å; L753-L774 WeakPolarHBondContact CA-O 3.42Å; L753-L774 HydrophobicContact CD1-CB 4.21Å; L753-M820 HydrophobicContact CD1-CG 3.76Å; L753-M820 HydrophobicContact CD1-SD 3.73Å; L753-M820 HydrophobicContact CD2-CE 3.69Å; L753-M820 HydrophobicContact CD2-SD 3.59Å; L753-M820 VanDerWaalsContact CD2-SD 3.59Å; L753-M820 HydrophobicContact CG-SD 4.25Å
754	Y	90.3	Very high	82.4	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	110.8	176.8	-174.7	-99.4	0	0	0	109.9	M756 D757 L760 F761 F768 L774 G776	Y754-M756 HydrophobicContact CD1-CB 4.21Å; Y754-M756 HydrophobicContact CD1-CG 4.31Å; Y754-M756 HydrophobicContact CE1-CB 4.11Å; Y754-M756 HydrophobicContact CE1-CG 3.92Å; Y754-D757 WeakPolarHBondContact CE1-O 3.32Å; Y754-D757 PolarHBondContact OH-O 3.46Å; Y754-L760 HydrophobicContact CE2-CD2 4.46Å; Y754-L760 WeakPolarHBondContact OH-CB 3.4Å; Y754-F761 AromaticContact CD1-CD2 3.82Å; Y754-F761 HydrophobicContact CD1-CD2 3.82Å; Y754-F761 HydrophobicContact CD2-CD2 4.44Å; Y754-F761 HydrophobicContact CE1-CB 4.15Å; Y754-F761 AromaticContact CE1-CD2 3.98Å; Y754-F761 HydrophobicContact CE1-CD2 3.98Å; Y754-F761 HydrophobicContact CG-CD2 4.06Å; Y754-F761 PolarHBondContact OH-N 3.32Å; Y754-F768 HydrophobicContact CD2-CZ 4.43Å; Y754-L774 PolarHBondContact N-O 2.86Å; Y754-G776 PolarHBondContact O-N 3.03Å
755	I	87	Confident	81.9	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119	173.7	-50.5	-169	0	0	0	108.6	I674 C675 G676 V680 K682 L685 L753 G776 N778	I674-I755 HydrophobicContact CG2-CD1 3.74Å; I674-I755 HydrophobicContact CG2-CG1 4.06Å; C675-I755 PolarHBondContact O-N 2.86Å; G676-I755 WeakPolarHBondContact CA-O 3.41Å; V680-I755 HydrophobicContact CB-CB 4.43Å; V680-I755 HydrophobicContact CB-CG2 3.79Å; V680-I755 HydrophobicContact CG2-CB 3.73Å; V680-I755 HydrophobicContact CG2-CG2 3.6Å; K682-I755 HydrophobicContact CG-CD1 4.08Å; L685-I755 HydrophobicContact CD2-CD1 3.69Å; L753-I755 HydrophobicContact CG-CG1 4.42Å; I755-G776 WeakPolarHBondContact CA-O 3.46Å; I755-N778 HydrophobicContact CG2-CB 3.76Å
756	M	72.1	Confident	81.6	Confident	31 Å²	31	42.1 Å²	42.1	15%	0.153	22%	0.224	C	C	.	.			trans	-91.4	135.5	-148.1	-167.4	-153.7	-111.5	0	0	115.3	Y754 I758 V775 G776 L777 L796 F799	Y754-M756 HydrophobicContact CD1-CB 4.21Å; Y754-M756 HydrophobicContact CD1-CG 4.31Å; Y754-M756 HydrophobicContact CE1-CB 4.11Å; Y754-M756 HydrophobicContact CE1-CG 3.92Å; M756-I758 HydrophobicContact CE-CD1 4.42Å; M756-I758 HydrophobicContact CE-CG1 3.96Å; M756-I758 HydrophobicContact CG-CG1 4.05Å; M756-I758 HydrophobicContact SD-CD1 4.04Å; M756-I758 HydrophobicContact SD-CG1 3.44Å; M756-I758 WeakPolarHBondContact SD-CG1 3.42Å; M756-V775 HydrophobicContact CB-CG1 4.29Å; M756-V775 HydrophobicContact CE-CG1 3.44Å; M756-V775 VanDerWaalsContact CE-CG1 3.44Å; M756-V775 HydrophobicContact CG-CG1 4.44Å; M756-V775 HydrophobicContact SD-CG1 4.33Å; M756-G776 PolarHBondContact N-O 3Å; M756-L777 HydrophobicContact CB-CD2 4.16Å; M756-L777 HydrophobicContact CE-CD2 4.37Å; M756-L777 HydrophobicContact SD-CD2 3.59Å; M756-L777 VanDerWaalsContact SD-CD2 3.59Å; M756-L796 HydrophobicContact CE-CD2 3.51Å; M756-L796 HydrophobicContact SD-CD2 3.78Å; M756-F799 HydrophobicContact CE-CD2 3.65Å; M756-F799 HydrophobicContact CE-CE2 3.6Å; M756-F799 HydrophobicContact CE-CG 4.22Å; M756-F799 HydrophobicContact CE-CZ 4.11Å
757	D	60	Low	81.2	Confident	77 Å²	77	42.5 Å²	42.5	41%	0.412	22%	0.219	S	C	.	.				-124.9	156.2	122.6	-161.7	-5.5	0	0	0	107.1	F677 Y754	F677-D757 HydrophobicContact CD2-CB 3.71Å; F677-D757 HydrophobicContact CE2-CB 3.57Å; F677-D757 HydrophobicContact CZ-CB 4.47Å; Y754-D757 WeakPolarHBondContact CE1-O 3.32Å; Y754-D757 PolarHBondContact OH-O 3.46Å
758	I	58.9	Low	80.9	Confident	23 Å²	23	40.4 Å²	40.4	12%	0.118	21%	0.209	C	C	.	.	S	Bend	trans	-79.5	-38.3	-154.1	-66.1	178.4	0	0	0	113.4	M756 L760 F761 L795 L796 F799	M756-I758 HydrophobicContact CE-CD1 4.42Å; M756-I758 HydrophobicContact CE-CG1 3.96Å; M756-I758 HydrophobicContact CG-CG1 4.05Å; M756-I758 HydrophobicContact SD-CD1 4.04Å; M756-I758 HydrophobicContact SD-CG1 3.44Å; M756-I758 WeakPolarHBondContact SD-CG1 3.42Å; I758-L760 PolarHBondContact O-N 3.06Å; I758-F761 WeakPolarHBondContact O-CB 3.43Å; I758-F761 PolarHBondContact O-N 3.36Å; I758-F761 VanDerWaalsContact O-N 3.16Å; I758-L795 HydrophobicContact CD1-CB 3.48Å; I758-L795 VanDerWaalsContact CD1-CB 3.48Å; I758-L795 HydrophobicContact CD1-CD1 4.16Å; I758-L795 HydrophobicContact CD1-CG 4.47Å; I758-L795 HydrophobicContact CG2-CB 4.37Å; I758-L796 HydrophobicContact CD1-CD2 4.31Å; I758-F799 HydrophobicContact CG1-CE2 4.28Å; I758-F799 HydrophobicContact CG2-CE2 3.89Å; I758-F799 HydrophobicContact CG2-CZ 4.19Å
759	T	60.2	Low	80.3	Confident	89 Å²	89	43.3 Å²	43.3	55%	0.546	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-41.2	-171.2	59.1	0	0	0	0	113.7	D728 F761	D728-T759 PolarHBondContact OD2-OG1 2.57Å; T759-F761 PolarHBondContact O-N 3.03Å
760	L	70.3	Confident	80.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-72	-13	-177.4	176.8	75	0	0	0	113.7	F677 I726 D728 Y754 I758 S763 I764	F677-L760 HydrophobicContact CD1-CD2 4.17Å; F677-L760 HydrophobicContact CD2-CB 4.31Å; F677-L760 HydrophobicContact CD2-CD2 3.68Å; F677-L760 HydrophobicContact CE1-CB 4.31Å; F677-L760 HydrophobicContact CE1-CD2 4.07Å; F677-L760 HydrophobicContact CE2-CB 3.35Å; F677-L760 HydrophobicContact CE2-CD2 3.55Å; F677-L760 HydrophobicContact CE2-CG 4.09Å; F677-L760 HydrophobicContact CG-CD2 4Å; F677-L760 HydrophobicContact CZ-CB 3.37Å; F677-L760 HydrophobicContact CZ-CD2 3.78Å; F677-L760 HydrophobicContact CZ-CG 4.13Å; I726-L760 HydrophobicContact CB-CD2 4.43Å; I726-L760 HydrophobicContact CG2-CD1 4.22Å; I726-L760 WeakPolarHBondContact O-CD2 3.28Å; D728-L760 HydrophobicContact CB-CD1 4.49Å; D728-L760 VanDerWaalsContact OD1-CA 3.25Å; D728-L760 WeakPolarHBondContact OD1-CA 3.4Å; D728-L760 WeakPolarHBondContact OD1-CD1 3.41Å; D728-L760 PolarHBondContact OD2-N 2.95Å; Y754-L760 HydrophobicContact CE2-CD2 4.46Å; Y754-L760 WeakPolarHBondContact OH-CB 3.4Å; I758-L760 PolarHBondContact O-N 3.06Å; L760-S763 PolarHBondContact O-OG 3.22Å; L760-I764 HydrophobicContact CD1-CD1 3.68Å; L760-I764 HydrophobicContact CD1-CG1 4.09Å; L760-I764 HydrophobicContact CD2-CD1 4.17Å; L760-I764 HydrophobicContact CG-CD1 3.67Å; L760-I764 HydrophobicContact CG-CG1 4.28Å; L760-I764 WeakPolarHBondContact O-CG1 3.47Å; L760-I764 PolarHBondContact O-N 3.38Å
761	F	77.6	Confident	80	Confident	11 Å²	11	46.8 Å²	46.8	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-68.3	-45.9	179.5	-171.9	-86.1	0	0	0	111.6	Y754 I758 T759 S763 I764 Q765 F768 V773 F799	Y754-F761 AromaticContact CD1-CD2 3.82Å; Y754-F761 HydrophobicContact CD1-CD2 3.82Å; Y754-F761 HydrophobicContact CD2-CD2 4.44Å; Y754-F761 HydrophobicContact CE1-CB 4.15Å; Y754-F761 AromaticContact CE1-CD2 3.98Å; Y754-F761 HydrophobicContact CE1-CD2 3.98Å; Y754-F761 HydrophobicContact CG-CD2 4.06Å; Y754-F761 PolarHBondContact OH-N 3.32Å; I758-F761 WeakPolarHBondContact O-CB 3.43Å; I758-F761 PolarHBondContact O-N 3.36Å; I758-F761 VanDerWaalsContact O-N 3.16Å; T759-F761 PolarHBondContact O-N 3.03Å; F761-S763 VanDerWaalsContact C-N 3.31Å; F761-S763 PolarHBondContact O-N 3.22Å; F761-I764 PolarHBondContact O-N 3.13Å; F761-Q765 HydrophobicContact CE1-CB 4.42Å; F761-Q765 HydrophobicContact CE1-CG 4.13Å; F761-Q765 WeakPolarHBondContact O-CB 3.46Å; F761-Q765 PolarHBondContact O-N 3.27Å; F761-F768 HydrophobicContact CD2-CE2 4.04Å; F761-F768 HydrophobicContact CE2-CD2 4.15Å; F761-F768 AromaticContact CE2-CE2 3.7Å; F761-F768 HydrophobicContact CE2-CE2 3.7Å; F761-F768 HydrophobicContact CZ-CD2 4.08Å; F761-F768 HydrophobicContact CZ-CE2 4.06Å; F761-V773 HydrophobicContact CE2-CG1 3.9Å; F761-V773 HydrophobicContact CZ-CG1 4.21Å; F761-F799 HydrophobicContact CB-CE1 4.13Å; F761-F799 HydrophobicContact CB-CZ 4.03Å; F761-F799 AromaticContact CD1-CE1 3.52Å; F761-F799 HydrophobicContact CD1-CE1 3.52Å; F761-F799 HydrophobicContact CD1-CZ 4.14Å; F761-F799 AromaticContact CD2-CE1 3.91Å; F761-F799 HydrophobicContact CD2-CE1 3.91Å; F761-F799 HydrophobicContact CE1-CD1 4.48Å; F761-F799 AromaticContact CE1-CE1 3.79Å; F761-F799 HydrophobicContact CE1-CE1 3.79Å; F761-F799 HydrophobicContact CE2-CE1 4.16Å; F761-F799 AromaticContact CG-CE1 3.57Å; F761-F799 HydrophobicContact CG-CE1 3.57Å; F761-F799 AromaticContact CG-CZ 3.99Å; F761-F799 HydrophobicContact CG-CZ 3.99Å; F761-F799 HydrophobicContact CZ-CE1 4.09Å
762	E	77.6	Confident	79.9	Confident	142 Å²	142	48 Å²	48	66%	0.664	27%	0.269	S	S	*	.	H	α-helix	trans	-62.1	-39.4	-178.6	-62.7	-177	174.7	0	0	111.5	I764 Q765	E762-I764 VanDerWaalsContact C-N 3.31Å; E762-I764 PolarHBondContact O-N 2.99Å; E762-Q765 PolarHBondContact O-N 3.38Å
763	S	78.2	Confident	79.7	Confident	58 Å²	58	49 Å²	49	41%	0.406	27%	0.274	S	S	.	.	H	α-helix	trans	-70.9	-23.1	-179.7	74.6	0	0	0	0	113.7	D728 L760 F761	D728-S763 PolarHBondContact OD1-OG 3.32Å; L760-S763 PolarHBondContact O-OG 3.22Å; F761-S763 VanDerWaalsContact C-N 3.31Å; F761-S763 PolarHBondContact O-N 3.22Å
764	I	81.2	Confident	79.7	Confident	2 Å²	2	49 Å²	49	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-100.9	-18.8	178.6	-58.7	-177.6	0	0	0	112.2	I726 L745 L760 F761 E762 P766 L767 F768	I726-I764 HydrophobicContact CB-CD1 4.31Å; I726-I764 HydrophobicContact CD1-CD1 3.87Å; I726-I764 HydrophobicContact CG2-CD1 3.94Å; L745-I764 HydrophobicContact CD1-CG2 4.02Å; L760-I764 HydrophobicContact CD1-CD1 3.68Å; L760-I764 HydrophobicContact CD1-CG1 4.09Å; L760-I764 HydrophobicContact CD2-CD1 4.17Å; L760-I764 HydrophobicContact CG-CD1 3.67Å; L760-I764 HydrophobicContact CG-CG1 4.28Å; L760-I764 WeakPolarHBondContact O-CG1 3.47Å; L760-I764 PolarHBondContact O-N 3.38Å; F761-I764 PolarHBondContact O-N 3.13Å; E762-I764 VanDerWaalsContact C-N 3.31Å; E762-I764 PolarHBondContact O-N 2.99Å; I764-P766 VanDerWaalsContact C-N 3.3Å; I764-P766 WeakPolarHBondContact O-CD 3.43Å; I764-L767 HydrophobicContact CG2-CB 4.39Å; I764-L767 HydrophobicContact CG2-CD1 4.22Å; I764-L767 WeakPolarHBondContact O-CB 3.23Å; I764-L767 PolarHBondContact O-N 2.88Å; I764-F768 HydrophobicContact CB-CE2 4.37Å; I764-F768 HydrophobicContact CB-CZ 4.04Å; I764-F768 HydrophobicContact CG2-CD1 4.44Å; I764-F768 HydrophobicContact CG2-CE1 3.57Å; I764-F768 HydrophobicContact CG2-CE2 4.05Å; I764-F768 HydrophobicContact CG2-CZ 3.33Å
765	Q	81.8	Confident	79.6	Confident	110 Å²	110	49 Å²	49	51%	0.514	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-44	-40.7	-175.3	-167.4	-179.3	14	0	0	115.5	F761 E762 L767 F768	F761-Q765 HydrophobicContact CE1-CB 4.42Å; F761-Q765 HydrophobicContact CE1-CG 4.13Å; F761-Q765 WeakPolarHBondContact O-CB 3.46Å; F761-Q765 PolarHBondContact O-N 3.27Å; E762-Q765 PolarHBondContact O-N 3.38Å; Q765-L767 PolarHBondContact O-N 2.84Å; Q765-L767 VanDerWaalsContact O-N 3.17Å; Q765-F768 WeakPolarHBondContact O-CB 3.22Å; Q765-F768 PolarHBondContact O-N 2.97Å
766	P	85.3	Confident	79.6	Confident	103 Å²	103	48.9 Å²	48.9	67%	0.669	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-59	-27.5	177.3	-25.8	36.3	0	0	0	114.7	I764 F768	I764-P766 VanDerWaalsContact C-N 3.3Å; I764-P766 WeakPolarHBondContact O-CD 3.43Å; P766-F768 VanDerWaalsContact C-N 3.28Å; P766-F768 PolarHBondContact O-N 3.33Å
767	L	83.3	Confident	80.4	Confident	52 Å²	52	48.7 Å²	48.7	27%	0.272	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-77.7	-11.9	178.7	-62.8	173.9	0	0	0	113.3	I742 I764 Q765 A769	I742-L767 HydrophobicContact CD1-CD1 3.99Å; I742-L767 HydrophobicContact CG2-CD1 4.03Å; I764-L767 HydrophobicContact CG2-CB 4.39Å; I764-L767 HydrophobicContact CG2-CD1 4.22Å; I764-L767 WeakPolarHBondContact O-CB 3.23Å; I764-L767 PolarHBondContact O-N 2.88Å; Q765-L767 PolarHBondContact O-N 2.84Å; Q765-L767 VanDerWaalsContact O-N 3.17Å; L767-A769 VanDerWaalsContact C-N 3.35Å
768	F	83.9	Confident	81.7	Confident	14 Å²	14	46.3 Å²	46.3	6%	0.061	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-89	0.6	178.5	-55.4	-32.1	0	0	0	113.6	L745 V752 Y754 F761 I764 Q765 P766 N770 K771 V773	L745-F768 HydrophobicContact CD1-CE1 4.39Å; L745-F768 HydrophobicContact CD2-CE1 4Å; V752-F768 HydrophobicContact CG1-CD1 4.27Å; V752-F768 HydrophobicContact CG1-CE1 3.79Å; V752-F768 HydrophobicContact CG1-CZ 4.38Å; V752-F768 HydrophobicContact CG2-CD1 4.27Å; Y754-F768 HydrophobicContact CD2-CZ 4.43Å; F761-F768 HydrophobicContact CD2-CE2 4.04Å; F761-F768 HydrophobicContact CE2-CD2 4.15Å; F761-F768 AromaticContact CE2-CE2 3.7Å; F761-F768 HydrophobicContact CE2-CE2 3.7Å; F761-F768 HydrophobicContact CZ-CD2 4.08Å; F761-F768 HydrophobicContact CZ-CE2 4.06Å; I764-F768 HydrophobicContact CB-CE2 4.37Å; I764-F768 HydrophobicContact CB-CZ 4.04Å; I764-F768 HydrophobicContact CG2-CD1 4.44Å; I764-F768 HydrophobicContact CG2-CE1 3.57Å; I764-F768 HydrophobicContact CG2-CE2 4.05Å; I764-F768 HydrophobicContact CG2-CZ 3.33Å; Q765-F768 WeakPolarHBondContact O-CB 3.22Å; Q765-F768 PolarHBondContact O-N 2.97Å; P766-F768 VanDerWaalsContact C-N 3.28Å; P766-F768 PolarHBondContact O-N 3.33Å; F768-N770 PolarHBondContact O-N 3.39Å; F768-K771 PolarHBondContact O-N 3.44Å; F768-V773 HydrophobicContact CB-CG2 3.62Å; F768-V773 HydrophobicContact CD1-CG2 4.41Å; F768-V773 HydrophobicContact CD2-CG2 4Å; F768-V773 HydrophobicContact CG-CG2 3.77Å
769	A	79.7	Confident	83	Confident	62 Å²	62	49.8 Å²	49.8	51%	0.512	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	128.3	174.8	0	0	0	0	0	111.6	L767 K771	L767-A769 VanDerWaalsContact C-N 3.35Å; A769-K771 VanDerWaalsContact C-N 3.33Å; A769-K771 PolarHBondContact O-N 2.95Å
770	N	84.3	Confident	84.1	Confident	174 Å²	174	46.9 Å²	46.9	93%	0.93	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	24	-176.6	-46.2	-55.6	0	0	0	115.7	F768	F768-N770 PolarHBondContact O-N 3.39Å
771	K	89.2	Confident	84.7	Confident	32 Å²	32	50.2 Å²	50.2	14%	0.139	28%	0.276	C	S	.	.	S	Bend	trans	-127.7	133.7	178.5	-57.8	-176.6	-167	-166.3	0	110.7	L745 A746 I748 V752 F768 A769 V773	L745-K771 PolarHBondContact O-NZ 3.17Å; A746-K771 PolarHBondContact O-NZ 3.03Å; I748-K771 PolarHBondContact O-NZ 3.11Å; V752-K771 HydrophobicContact CG2-CB 4.41Å; V752-K771 HydrophobicContact CG2-CD 4.4Å; F768-K771 PolarHBondContact O-N 3.44Å; A769-K771 VanDerWaalsContact C-N 3.33Å; A769-K771 PolarHBondContact O-N 2.95Å; K771-V773 PolarHBondContact O-N 2.91Å
772	P	91.2	Very high	85	Confident	27 Å²	27	55.6 Å²	55.6	18%	0.175	30%	0.304	C	S	.	.			trans	-68.5	123.8	172.6	25.8	-29.1	0	0	0	109.3	A751 V752 L827 L828	A751-P772 WeakPolarHBondContact CA-O 3.32Å; A751-P772 HydrophobicContact CB-CG 4.02Å; V752-P772 PolarHBondContact N-O 3.44Å; P772-L827 HydrophobicContact CB-CB 3.89Å; P772-L827 HydrophobicContact CG-CB 4.48Å; P772-L828 HydrophobicContact CG-CB 4.35Å; P772-L828 HydrophobicContact CG-CD1 3.95Å
773	V	90.6	Very high	85.2	Confident	20 Å²	20	57.3 Å²	57.3	12%	0.121	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.4	179.7	-179.5	0	0	0	0	109.2	V752 F761 F768 K771 V804	V752-V773 WeakPolarHBondContact O-CA 3.49Å; F761-V773 HydrophobicContact CE2-CG1 3.9Å; F761-V773 HydrophobicContact CZ-CG1 4.21Å; F768-V773 HydrophobicContact CB-CG2 3.62Å; F768-V773 HydrophobicContact CD1-CG2 4.41Å; F768-V773 HydrophobicContact CD2-CG2 4Å; F768-V773 HydrophobicContact CG-CG2 3.77Å; K771-V773 PolarHBondContact O-N 2.91Å; V773-V804 HydrophobicContact CB-CG1 4.4Å; V773-V804 HydrophobicContact CG1-CG1 4.09Å
774	L	90.3	Very high	85.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.9	172.2	-57.2	92.1	0	0	0	108.9	A751 V752 L753 Y754 P805 F807 Q823 A824 L827	A751-L774 HydrophobicContact CB-CD1 4.46Å; V752-L774 PolarHBondContact O-N 3.23Å; L753-L774 WeakPolarHBondContact CA-O 3.42Å; L753-L774 HydrophobicContact CD1-CB 4.21Å; Y754-L774 PolarHBondContact N-O 2.86Å; L774-P805 HydrophobicContact CB-CG 4.41Å; L774-P805 HydrophobicContact CD2-CG 4.08Å; L774-P805 HydrophobicContact CG-CG 3.96Å; L774-F807 HydrophobicContact CB-CE2 4.35Å; L774-F807 HydrophobicContact CD2-CE2 3.79Å; L774-F807 HydrophobicContact CD2-CZ 4.37Å; L774-Q823 HydrophobicContact CD2-CB 4.36Å; L774-Q823 HydrophobicContact CD2-CG 4.27Å; L774-A824 HydrophobicContact CD1-CB 3.7Å; L774-A824 HydrophobicContact CD2-CB 3.79Å; L774-A824 HydrophobicContact CG-CB 4.38Å; L774-L827 HydrophobicContact CD1-CD1 4.28Å; L774-L827 HydrophobicContact CD2-CD1 4.01Å; L774-L827 HydrophobicContact CG-CD1 4.13Å
775	V	88.9	Confident	85.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.2	-177.3	169	0	0	0	0	109.8	M756 F799 V804 P805 I806 F807	M756-V775 HydrophobicContact CB-CG1 4.29Å; M756-V775 HydrophobicContact CE-CG1 3.44Å; M756-V775 VanDerWaalsContact CE-CG1 3.44Å; M756-V775 HydrophobicContact CG-CG1 4.44Å; M756-V775 HydrophobicContact SD-CG1 4.33Å; V775-F799 HydrophobicContact CG2-CD1 4.41Å; V775-V804 HydrophobicContact CB-CG1 4.5Å; V775-V804 HydrophobicContact CG2-CG1 3.7Å; V775-P805 PolarHBondContact N-O 2.89Å; V775-I806 HydrophobicContact CB-CG1 4.32Å; V775-I806 HydrophobicContact CG1-CG1 4.42Å; V775-I806 HydrophobicContact CG1-CG2 4.29Å; V775-I806 CarbonylContact O-C 3.52Å; V775-I806 WeakPolarHBondContact O-CA 3.4Å; V775-F807 PolarHBondContact O-N 2.89Å
776	G	87.9	Confident	85.2	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	114.2	178.6	0	0	0	0	0	112.1	Y754 I755 M756 N778	Y754-G776 PolarHBondContact O-N 3.03Å; I755-G776 WeakPolarHBondContact CA-O 3.46Å; M756-G776 PolarHBondContact N-O 3Å; G776-N778 PolarHBondContact O-N 2.89Å
777	L	87.6	Confident	85.1	Confident	27 Å²	27	65.9 Å²	65.9	14%	0.141	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	101.6	167.2	-55.4	-179.9	0	0	0	107.5	M756 C780 V785 L796 I806 F807 I809	M756-L777 HydrophobicContact CB-CD2 4.16Å; M756-L777 HydrophobicContact CE-CD2 4.37Å; M756-L777 HydrophobicContact SD-CD2 3.59Å; M756-L777 VanDerWaalsContact SD-CD2 3.59Å; L777-C780 PolarHBondContact O-SG 3.34Å; L777-V785 HydrophobicContact CD1-CG2 3.74Å; L777-L796 HydrophobicContact CD1-CD1 4.26Å; L777-L796 HydrophobicContact CD2-CD2 4.21Å; L777-I806 HydrophobicContact CD1-CG2 3.83Å; L777-I806 HydrophobicContact CG-CG2 3.96Å; L777-F807 PolarHBondContact N-O 3.46Å; L777-I809 PolarHBondContact O-N 2.84Å
778	N	87	Confident	84.7	Confident	27 Å²	27	65.6 Å²	65.6	14%	0.144	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	161.9	178.8	-166	22.1	0	0	0	111.6	V680 I755 G776 I809	V680-N778 PolarHBondContact O-ND2 3.32Å; I755-N778 HydrophobicContact CG2-CB 3.76Å; G776-N778 PolarHBondContact O-N 2.89Å; N778-I809 CarbonylContact C-O 3.58Å; N778-I809 WeakPolarHBondContact CA-O 3.26Å; N778-I809 PolarHBondContact OD1-O 2.64Å
779	K	86.4	Confident	84.7	Confident	95 Å²	95	68 Å²	68	41%	0.413	35%	0.346	S	S	.	.			trans	68.9	32.1	179.5	-47.7	176	-173	172.7	0	114	N679 D781 I782 I809	N679-K779 PolarHBondContact O-NZ 2.94Å; K779-D781 WeakPolarHBondContact CA-OD1 3.03Å; K779-D781 PolarHBondContact O-N 3.37Å; K779-D781 VanDerWaalsContact O-N 3.1Å; K779-I782 HydrophobicContact CB-CD1 4.31Å; K779-I782 PolarHBondContact O-N 3.06Å; K779-I809 PolarHBondContact N-O 3.21Å; K779-I809 VanDerWaalsContact N-O 3.09Å
780	C	84	Confident	84.9	Confident	28 Å²	28	69.2 Å²	69.2	19%	0.189	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-13.5	177	-66.2	0	0	0	0	114.6	L777 I782 R783 S808 I809	L777-C780 PolarHBondContact O-SG 3.34Å; C780-I782 VanDerWaalsContact C-N 3.25Å; C780-I782 PolarHBondContact O-N 3.47Å; C780-R783 WeakPolarHBondContact CA-O 3.3Å; C780-S808 VanDerWaalsContact SG-CA 3.59Å; C780-S808 WeakPolarHBondContact SG-CB 3.47Å; C780-I809 PolarHBondContact N-O 3.44Å
781	D	82.4	Confident	84.8	Confident	71 Å²	71	68.2 Å²	68.2	38%	0.38	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.6	169.6	49.8	-67.4	0	0	0	113.8	K779 S810 T813	K779-D781 WeakPolarHBondContact CA-OD1 3.03Å; K779-D781 PolarHBondContact O-N 3.37Å; K779-D781 VanDerWaalsContact O-N 3.1Å; D781-S810 VanDerWaalsContact OD1-CB 3.24Å; D781-S810 WeakPolarHBondContact OD1-CB 3.2Å; D781-S810 PolarHBondContact OD1-OG 3.47Å; D781-T813 HydrophobicContact CB-CG2 4.21Å
782	I	84.1	Confident	84.2	Confident	124 Å²	124	71.4 Å²	71.4	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-37.9	179.7	-59	174.9	0	0	0	111.7	K779 C780	K779-I782 HydrophobicContact CB-CD1 4.31Å; K779-I782 PolarHBondContact O-N 3.06Å; C780-I782 VanDerWaalsContact C-N 3.25Å; C780-I782 PolarHBondContact O-N 3.47Å
783	R	82.1	Confident	83.6	Confident	177 Å²	177	73.1 Å²	73.1	67%	0.668	36%	0.358	S	S	*	.			trans	-147.2	133.8	175	-73.1	-173.2	-179.2	176.2	-1.4	111	C780 E787	C780-R783 WeakPolarHBondContact CA-O 3.3Å; R783-E787 WeakPolarHBondContact CA-OE2 3.06Å
784	K	80.2	Confident	83.1	Confident	117 Å²	117	78.8 Å²	78.8	51%	0.509	38%	0.381	S	S	.	.			trans	-83.9	161.5	174.8	-66.9	179.5	177.9	178.7	0	111.7	E786 E787	K784-E786 PolarHBondContact O-N 3.45Å; K784-E787 HydrophobicContact CB-CG 4.2Å; K784-E787 PolarHBondContact N-OE2 3.08Å; K784-E787 PolarHBondContact O-N 2.91Å; K784-E787 VanDerWaalsContact O-N 3.14Å
785	V	78.7	Confident	82.4	Confident	57 Å²	57	82.7 Å²	82.7	35%	0.345	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-63	-33.8	177.3	-174.4	0	0	0	0	111.4	L777 E787 L788 Q793 L796	L777-V785 HydrophobicContact CD1-CG2 3.74Å; V785-E787 PolarHBondContact O-N 2.92Å; V785-L788 HydrophobicContact CG1-CD1 4.26Å; V785-L788 WeakPolarHBondContact O-CB 3.14Å; V785-L788 PolarHBondContact O-N 3.4Å; V785-Q793 PolarHBondContact O-NE2 3.43Å; V785-L796 HydrophobicContact CG1-CD1 3.97Å
786	E	82	Confident	81.8	Confident	163 Å²	163	83.5 Å²	83.5	76%	0.762	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-62.6	-27.7	175.6	-66.7	157.4	-154.6	0	0	113	K784 Q793	K784-E786 PolarHBondContact O-N 3.45Å; E786-Q793 PolarHBondContact O-NE2 2.82Å
787	E	82.8	Confident	81.2	Confident	117 Å²	117	89.3 Å²	89.3	55%	0.547	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-91.4	2.7	-175.9	-61.2	163.4	177.8	0	0	112.9	R783 K784 V785	R783-E787 WeakPolarHBondContact CA-OE2 3.06Å; K784-E787 HydrophobicContact CB-CG 4.2Å; K784-E787 PolarHBondContact N-OE2 3.08Å; K784-E787 PolarHBondContact O-N 2.91Å; K784-E787 VanDerWaalsContact O-N 3.14Å; V785-E787 PolarHBondContact O-N 2.92Å
788	L	76.4	Confident	80.6	Confident	46 Å²	46	91.9 Å²	91.9	24%	0.241	45%	0.45	C	S	.	.	S	Bend	trans	-75.5	145.2	178.9	-75	168.4	0	0	0	111.5	V785 K792 Q793 L796	V785-L788 HydrophobicContact CG1-CD1 4.26Å; V785-L788 WeakPolarHBondContact O-CB 3.14Å; V785-L788 PolarHBondContact O-N 3.4Å; L788-K792 HydrophobicContact CB-CB 4.46Å; L788-K792 HydrophobicContact CD2-CD 4.41Å; L788-Q793 HydrophobicContact CB-CG 3.89Å; L788-Q793 PolarHBondContact O-NE2 2.92Å; L788-L796 HydrophobicContact CD1-CD1 3.77Å
789	P	83.8	Confident	79.8	Confident	63 Å²	63	91.1 Å²	91.1	41%	0.409	45%	0.445	S	S	.	.			trans	-54.8	145.8	170.7	-24.6	33.9	0	0	0	111.6	E791 K792 Q793	P789-E791 PolarHBondContact O-N 3.33Å; P789-E791 VanDerWaalsContact O-N 3.12Å; P789-K792 WeakPolarHBondContact O-CA 3.28Å; P789-K792 PolarHBondContact O-N 2.9Å; P789-Q793 PolarHBondContact O-N 2.81Å
790	P	83.2	Confident	78.9	Confident	89 Å²	89	90.4 Å²	90.4	58%	0.578	45%	0.452	S	S	*	.	H	α-helix	trans	-61	-27.4	-176.8	24.1	-34.5	0	0	0	112.7	Q793 K794	P790-Q793 PolarHBondContact O-N 3Å; P790-K794 VanDerWaalsContact O-CG 3.32Å; P790-K794 WeakPolarHBondContact O-CG 3.37Å; P790-K794 PolarHBondContact O-N 3.44Å
791	E	81.5	Confident	78	Confident	153 Å²	153	93.9 Å²	93.9	72%	0.715	48%	0.476	S	S	*	.	H	α-helix	trans	-59.8	-44.6	170.6	-62.9	175.3	174.7	0	0	112.1	P789 L795	P789-E791 PolarHBondContact O-N 3.33Å; P789-E791 VanDerWaalsContact O-N 3.12Å; E791-L795 WeakPolarHBondContact O-CG 3.27Å; E791-L795 PolarHBondContact O-N 3.38Å
792	K	77.7	Confident	77.2	Confident	99 Å²	99	93 Å²	93	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-74.2	-32.9	178	-66.4	-158.1	173.5	-154	0	112	L788 P789 L795 L796	L788-K792 HydrophobicContact CB-CB 4.46Å; L788-K792 HydrophobicContact CD2-CD 4.41Å; P789-K792 WeakPolarHBondContact O-CA 3.28Å; P789-K792 PolarHBondContact O-N 2.9Å; K792-L795 PolarHBondContact O-N 3.14Å; K792-L796 WeakPolarHBondContact O-CG 3.38Å; K792-L796 PolarHBondContact O-N 3.44Å; K792-L796 VanDerWaalsContact O-N 3.08Å
793	Q	78.4	Confident	76.7	Confident	63 Å²	63	92.4 Å²	92.4	29%	0.294	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-43.4	173	-69.6	177.4	-18.6	0	0	111.5	V785 E786 L788 P789 P790 L795 L796 E797	V785-Q793 PolarHBondContact O-NE2 3.43Å; E786-Q793 PolarHBondContact O-NE2 2.82Å; L788-Q793 HydrophobicContact CB-CG 3.89Å; L788-Q793 PolarHBondContact O-NE2 2.92Å; P789-Q793 PolarHBondContact O-N 2.81Å; P790-Q793 PolarHBondContact O-N 3Å; Q793-L795 VanDerWaalsContact C-N 3.29Å; Q793-L795 PolarHBondContact O-N 3.22Å; Q793-L796 WeakPolarHBondContact O-CA 3.06Å; Q793-L796 WeakPolarHBondContact O-CB 3.25Å; Q793-L796 PolarHBondContact O-N 3.23Å; Q793-E797 PolarHBondContact O-N 3.4Å
794	K	79.9	Confident	76.7	Confident	139 Å²	139	85.1 Å²	85.1	60%	0.604	46%	0.458	S	S	*	.	H	α-helix	trans	-57.2	-39.7	171.2	-74.2	173.2	-179.3	-177.8	0	112.9	P790 L796 E797 V798	P790-K794 VanDerWaalsContact O-CG 3.32Å; P790-K794 WeakPolarHBondContact O-CG 3.37Å; P790-K794 PolarHBondContact O-N 3.44Å; K794-L796 VanDerWaalsContact C-N 3.29Å; K794-L796 PolarHBondContact O-N 3.43Å; K794-E797 WeakPolarHBondContact O-CB 3.31Å; K794-E797 PolarHBondContact O-N 3.45Å; K794-V798 PolarHBondContact O-N 3.41Å
795	L	75.6	Confident	76.9	Confident	82 Å²	82	81 Å²	81	43%	0.429	44%	0.443	S	S	.	.	H	α-helix	trans	-66.8	-29	174.3	-66.7	172.1	0	0	0	112.7	I758 E791 K792 Q793 F799	I758-L795 HydrophobicContact CD1-CB 3.48Å; I758-L795 VanDerWaalsContact CD1-CB 3.48Å; I758-L795 HydrophobicContact CD1-CD1 4.16Å; I758-L795 HydrophobicContact CD1-CG 4.47Å; I758-L795 HydrophobicContact CG2-CB 4.37Å; E791-L795 WeakPolarHBondContact O-CG 3.27Å; E791-L795 PolarHBondContact O-N 3.38Å; K792-L795 PolarHBondContact O-N 3.14Å; Q793-L795 VanDerWaalsContact C-N 3.29Å; Q793-L795 PolarHBondContact O-N 3.22Å; L795-F799 WeakPolarHBondContact O-CD2 3.48Å; L795-F799 WeakPolarHBondContact O-CE2 3.5Å
796	L	76.3	Confident	77.3	Confident	16 Å²	16	80.8 Å²	80.8	8%	0.084	44%	0.44	C	S	.	.	H	α-helix	trans	-72.4	-33.9	171.2	-65	177.2	0	0	0	112.5	M756 I758 L777 V785 L788 K792 Q793 K794 V798 F799 S800	M756-L796 HydrophobicContact CE-CD2 3.51Å; M756-L796 HydrophobicContact SD-CD2 3.78Å; I758-L796 HydrophobicContact CD1-CD2 4.31Å; L777-L796 HydrophobicContact CD1-CD1 4.26Å; L777-L796 HydrophobicContact CD2-CD2 4.21Å; V785-L796 HydrophobicContact CG1-CD1 3.97Å; L788-L796 HydrophobicContact CD1-CD1 3.77Å; K792-L796 WeakPolarHBondContact O-CG 3.38Å; K792-L796 PolarHBondContact O-N 3.44Å; K792-L796 VanDerWaalsContact O-N 3.08Å; Q793-L796 WeakPolarHBondContact O-CA 3.06Å; Q793-L796 WeakPolarHBondContact O-CB 3.25Å; Q793-L796 PolarHBondContact O-N 3.23Å; K794-L796 VanDerWaalsContact C-N 3.29Å; K794-L796 PolarHBondContact O-N 3.43Å; L796-V798 PolarHBondContact O-N 3.44Å; L796-F799 WeakPolarHBondContact O-CB 3.5Å; L796-F799 PolarHBondContact O-N 2.91Å; L796-S800 PolarHBondContact O-N 2.96Å
797	E	75.8	Confident	77.5	Confident	123 Å²	123	74.3 Å²	74.3	58%	0.575	41%	0.409	S	S	*	.	H	α-helix	trans	-61.6	-29.9	176.5	-68.7	167.5	177	0	0	112.7	Q793 K794 F799 S800 S801	Q793-E797 PolarHBondContact O-N 3.4Å; K794-E797 WeakPolarHBondContact O-CB 3.31Å; K794-E797 PolarHBondContact O-N 3.45Å; E797-F799 VanDerWaalsContact C-N 3.28Å; E797-F799 PolarHBondContact O-N 2.83Å; E797-S800 WeakPolarHBondContact O-CB 3.42Å; E797-S800 PolarHBondContact O-N 2.81Å; E797-S801 PolarHBondContact O-N 3.36Å; E797-S801 PolarHBondContact O-OG 2.84Å
798	V	74.4	Confident	77.8	Confident	81 Å²	81	72 Å²	72	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-64.1	-30	173	-179.2	0	0	0	0	112.4	K794 L796 S801 S802	K794-V798 PolarHBondContact O-N 3.41Å; L796-V798 PolarHBondContact O-N 3.44Å; V798-S801 PolarHBondContact O-OG 3.14Å; V798-S801 VanDerWaalsContact O-OG 3.06Å; V798-S802 PolarHBondContact O-N 3.11Å; V798-S802 PolarHBondContact O-OG 2.82Å
799	F	69.4	Low	78.4	Confident	11 Å²	11	69.9 Å²	69.9	5%	0.048	40%	0.395	C	S	.	.	H	α-helix	trans	-77.9	-36.3	173.7	-68.3	-78.6	0	0	0	112.2	M756 I758 F761 V775 L795 L796 E797 S802 V804 I806	M756-F799 HydrophobicContact CE-CD2 3.65Å; M756-F799 HydrophobicContact CE-CE2 3.6Å; M756-F799 HydrophobicContact CE-CG 4.22Å; M756-F799 HydrophobicContact CE-CZ 4.11Å; I758-F799 HydrophobicContact CG1-CE2 4.28Å; I758-F799 HydrophobicContact CG2-CE2 3.89Å; I758-F799 HydrophobicContact CG2-CZ 4.19Å; F761-F799 HydrophobicContact CB-CE1 4.13Å; F761-F799 HydrophobicContact CB-CZ 4.03Å; F761-F799 AromaticContact CD1-CE1 3.52Å; F761-F799 HydrophobicContact CD1-CE1 3.52Å; F761-F799 HydrophobicContact CD1-CZ 4.14Å; F761-F799 AromaticContact CD2-CE1 3.91Å; F761-F799 HydrophobicContact CD2-CE1 3.91Å; F761-F799 HydrophobicContact CE1-CD1 4.48Å; F761-F799 AromaticContact CE1-CE1 3.79Å; F761-F799 HydrophobicContact CE1-CE1 3.79Å; F761-F799 HydrophobicContact CE2-CE1 4.16Å; F761-F799 AromaticContact CG-CE1 3.57Å; F761-F799 HydrophobicContact CG-CE1 3.57Å; F761-F799 AromaticContact CG-CZ 3.99Å; F761-F799 HydrophobicContact CG-CZ 3.99Å; F761-F799 HydrophobicContact CZ-CE1 4.09Å; V775-F799 HydrophobicContact CG2-CD1 4.41Å; L795-F799 WeakPolarHBondContact O-CD2 3.48Å; L795-F799 WeakPolarHBondContact O-CE2 3.5Å; L796-F799 WeakPolarHBondContact O-CB 3.5Å; L796-F799 PolarHBondContact O-N 2.91Å; E797-F799 VanDerWaalsContact C-N 3.28Å; E797-F799 PolarHBondContact O-N 2.83Å; F799-S802 WeakPolarHBondContact CA-OG 3.43Å; F799-S802 PolarHBondContact O-N 3.18Å; F799-S802 PolarHBondContact O-OG 3.49Å; F799-S802 VanDerWaalsContact O-OG 3.12Å; F799-V804 PolarHBondContact O-N 3.45Å; F799-I806 HydrophobicContact CB-CD1 3.89Å; F799-I806 HydrophobicContact CB-CG1 4.36Å
800	S	67.7	Low	78.7	Confident	79 Å²	79	67 Å²	67	55%	0.552	38%	0.376	S	S	*	.	H	α-helix	trans	-63.5	-39.5	174.6	-59.4	0	0	0	0	112.3	L796 E797 S802	L796-S800 PolarHBondContact O-N 2.96Å; E797-S800 WeakPolarHBondContact O-CB 3.42Å; E797-S800 PolarHBondContact O-N 2.81Å; S800-S802 VanDerWaalsContact C-N 3.34Å
801	S	65.8	Low	78.8	Confident	101 Å²	101	63.7 Å²	63.7	71%	0.706	35%	0.354	S	S	*	.	H	α-helix	trans	-72.3	-25.1	177.3	66.3	0	0	0	0	113.7	E797 V798 S803	E797-S801 PolarHBondContact O-N 3.36Å; E797-S801 PolarHBondContact O-OG 2.84Å; V798-S801 PolarHBondContact O-OG 3.14Å; V798-S801 VanDerWaalsContact O-OG 3.06Å; S801-S803 VanDerWaalsContact C-N 3.29Å; S801-S803 PolarHBondContact O-N 2.98Å
802	S	66.3	Low	79.1	Confident	52 Å²	52	61.5 Å²	61.5	36%	0.364	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	15.4	177.6	50.1	0	0	0	0	114.2	V798 F799 S800 V804	V798-S802 PolarHBondContact O-N 3.11Å; V798-S802 PolarHBondContact O-OG 2.82Å; F799-S802 WeakPolarHBondContact CA-OG 3.43Å; F799-S802 PolarHBondContact O-N 3.18Å; F799-S802 PolarHBondContact O-OG 3.49Å; F799-S802 VanDerWaalsContact O-OG 3.12Å; S800-S802 VanDerWaalsContact C-N 3.34Å; S802-V804 VanDerWaalsContact C-N 3.25Å; S802-V804 PolarHBondContact O-N 3.1Å
803	S	73.5	Confident	79.5	Confident	113 Å²	113	59.9 Å²	59.9	79%	0.79	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	14.7	177.1	72.2	0	0	0	0	116.5	S801	S801-S803 VanDerWaalsContact C-N 3.29Å; S801-S803 PolarHBondContact O-N 2.98Å
804	V	80.3	Confident	80	Confident	24 Å²	24	61.4 Å²	61.4	15%	0.145	36%	0.359	C	S	.	.			trans	-88.6	122.5	-179.1	-175	0	0	0	0	110.4	V773 V775 F799 S802	V773-V804 HydrophobicContact CB-CG1 4.4Å; V773-V804 HydrophobicContact CG1-CG1 4.09Å; V775-V804 HydrophobicContact CB-CG1 4.5Å; V775-V804 HydrophobicContact CG2-CG1 3.7Å; F799-V804 PolarHBondContact O-N 3.45Å; S802-V804 VanDerWaalsContact C-N 3.25Å; S802-V804 PolarHBondContact O-N 3.1Å
805	P	85.9	Confident	80.3	Confident	31 Å²	31	61 Å²	61	20%	0.201	36%	0.359	C	S	.	.			trans	-74.7	134.2	-178.3	30.9	-36.1	0	0	0	112.1	L774 V775 F807 L827	L774-P805 HydrophobicContact CB-CG 4.41Å; L774-P805 HydrophobicContact CD2-CG 4.08Å; L774-P805 HydrophobicContact CG-CG 3.96Å; V775-P805 PolarHBondContact N-O 2.89Å; P805-F807 HydrophobicContact CB-CE2 3.82Å; P805-F807 HydrophobicContact CB-CZ 3.94Å; P805-F807 HydrophobicContact CG-CE2 4.2Å; P805-L827 HydrophobicContact CG-CD1 4.22Å
806	I	87	Confident	80.8	Confident	52 Å²	52	58 Å²	58	27%	0.267	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.2	-177.1	-53.7	170.5	0	0	0	109.8	V775 L777 F799	V775-I806 HydrophobicContact CB-CG1 4.32Å; V775-I806 HydrophobicContact CG1-CG1 4.42Å; V775-I806 HydrophobicContact CG1-CG2 4.29Å; V775-I806 CarbonylContact O-C 3.52Å; V775-I806 WeakPolarHBondContact O-CA 3.4Å; L777-I806 HydrophobicContact CD1-CG2 3.83Å; L777-I806 HydrophobicContact CG-CG2 3.96Å; F799-I806 HydrophobicContact CB-CD1 3.89Å; F799-I806 HydrophobicContact CB-CG1 4.36Å
807	F	86.9	Confident	81.5	Confident	27 Å²	27	57.7 Å²	57.7	12%	0.118	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.6	176.4	-58	-85.2	0	0	0	111.7	L774 V775 L777 P805 I809 M820 Q823	L774-F807 HydrophobicContact CB-CE2 4.35Å; L774-F807 HydrophobicContact CD2-CE2 3.79Å; L774-F807 HydrophobicContact CD2-CZ 4.37Å; V775-F807 PolarHBondContact O-N 2.89Å; L777-F807 PolarHBondContact N-O 3.46Å; P805-F807 HydrophobicContact CB-CE2 3.82Å; P805-F807 HydrophobicContact CB-CZ 3.94Å; P805-F807 HydrophobicContact CG-CE2 4.2Å; F807-I809 HydrophobicContact CB-CD1 4.25Å; F807-I809 HydrophobicContact CB-CG1 3.96Å; F807-M820 HydrophobicContact CB-CB 4.14Å; F807-M820 HydrophobicContact CD1-CB 4.14Å; F807-M820 HydrophobicContact CD2-CB 4.11Å; F807-M820 HydrophobicContact CD2-CG 4.08Å; F807-M820 HydrophobicContact CG-CB 3.81Å; F807-M820 HydrophobicContact CG-CG 4.24Å; F807-Q823 HydrophobicContact CZ-CB 4.2Å; F807-Q823 VanDerWaalsContact CZ-CD 3.5Å; F807-Q823 HydrophobicContact CZ-CG 4.16Å; F807-Q823 VanDerWaalsContact CZ-OE1 3.22Å
808	S	88	Confident	82.2	Confident	69 Å²	69	57 Å²	57	48%	0.483	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.6	157.1	44.3	0	0	0	0	109.7	C780 G816	C780-S808 VanDerWaalsContact SG-CA 3.59Å; C780-S808 WeakPolarHBondContact SG-CB 3.47Å; S808-G816 WeakPolarHBondContact O-CA 3.41Å
809	I	89.2	Confident	83	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.1	-174.6	-51.5	175	0	0	0	108.8	L685 L777 N778 K779 C780 F807 I817 M820	L685-I809 HydrophobicContact CD1-CG2 4.31Å; L777-I809 PolarHBondContact O-N 2.84Å; N778-I809 CarbonylContact C-O 3.58Å; N778-I809 WeakPolarHBondContact CA-O 3.26Å; N778-I809 PolarHBondContact OD1-O 2.64Å; K779-I809 PolarHBondContact N-O 3.21Å; K779-I809 VanDerWaalsContact N-O 3.09Å; C780-I809 PolarHBondContact N-O 3.44Å; F807-I809 HydrophobicContact CB-CD1 4.25Å; F807-I809 HydrophobicContact CB-CG1 3.96Å; I809-I817 HydrophobicContact CG2-CG1 3.69Å; I809-M820 HydrophobicContact CD1-CB 4.25Å; I809-M820 HydrophobicContact CD1-CE 4.14Å; I809-M820 HydrophobicContact CD1-CG 3.93Å
810	S	89.1	Confident	84.1	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.007	35%	0.347	C	S	.	.			trans	-130.8	127.6	164	176.5	0	0	0	0	111.3	D781 V812 T813 L814 E815 I817	D781-S810 VanDerWaalsContact OD1-CB 3.24Å; D781-S810 WeakPolarHBondContact OD1-CB 3.2Å; D781-S810 PolarHBondContact OD1-OG 3.47Å; S810-V812 PolarHBondContact O-N 2.81Å; S810-V812 PolarHBondContact OG-N 3.34Å; S810-T813 VanDerWaalsContact CB-OG1 3.3Å; S810-T813 WeakPolarHBondContact CB-OG1 3.22Å; S810-T813 PolarHBondContact OG-N 3.39Å; S810-L814 VanDerWaalsContact O-CA 3.26Å; S810-L814 WeakPolarHBondContact O-CA 3.39Å; S810-L814 PolarHBondContact O-N 3.14Å; S810-L814 VanDerWaalsContact O-N 3.08Å; S810-E815 PolarHBondContact N-O 3.37Å; S810-E815 VanDerWaalsContact N-O 3.16Å; S810-I817 WeakPolarHBondContact O-CD1 3.37Å
811	T	86.6	Confident	85.3	Confident	21 Å²	21	56.2 Å²	56.2	13%	0.129	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.1	170.9	53.3	0	0	0	0	113.7	L685 K688	L685-T811 HydrophobicContact CB-CG2 4.17Å; L685-T811 HydrophobicContact CD1-CG2 4.2Å; K688-T811 WeakPolarHBondContact CE-O 3.34Å
812	V	87.3	Confident	86.6	Confident	106 Å²	106	53.7 Å²	53.7	64%	0.642	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-56.4	179.4	-176.6	0	0	0	0	110.5	S810 L814	S810-V812 PolarHBondContact O-N 2.81Å; S810-V812 PolarHBondContact OG-N 3.34Å; V812-L814 VanDerWaalsContact C-N 3.29Å; V812-L814 PolarHBondContact O-N 3.09Å
813	T	87.1	Confident	87.9	Confident	65 Å²	65	55.1 Å²	55.1	40%	0.399	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-14.5	179.2	67.1	0	0	0	0	113.1	D781 S810 E815	D781-T813 HydrophobicContact CB-CG2 4.21Å; S810-T813 VanDerWaalsContact CB-OG1 3.3Å; S810-T813 WeakPolarHBondContact CB-OG1 3.22Å; S810-T813 PolarHBondContact OG-N 3.39Å; T813-E815 WeakPolarHBondContact CB-OE2 3.4Å; T813-E815 PolarHBondContact O-N 3.43Å; T813-E815 WeakPolarHBondContact OG1-CB 3.39Å; T813-E815 VanDerWaalsContact OG1-CD 3.28Å; T813-E815 VanDerWaalsContact OG1-CG 3.3Å; T813-E815 WeakPolarHBondContact OG1-CG 3.28Å; T813-E815 PolarHBondContact OG1-N 3.25Å; T813-E815 PolarHBondContact OG1-OE2 3.36Å
814	L	87.3	Confident	88.8	Confident	95 Å²	95	49.8 Å²	49.8	50%	0.497	27%	0.271	S	S	.	.			trans	65.7	9.7	-172.8	-51.1	175.1	0	0	0	114.5	K688 S810 V812 I817	K688-L814 HydrophobicContact CB-CD2 4.4Å; K688-L814 HydrophobicContact CD-CD2 3.84Å; K688-L814 HydrophobicContact CG-CD2 4.07Å; S810-L814 VanDerWaalsContact O-CA 3.26Å; S810-L814 WeakPolarHBondContact O-CA 3.39Å; S810-L814 PolarHBondContact O-N 3.14Å; S810-L814 VanDerWaalsContact O-N 3.08Å; V812-L814 VanDerWaalsContact C-N 3.29Å; V812-L814 PolarHBondContact O-N 3.09Å; L814-I817 HydrophobicContact CB-CD1 4.36Å; L814-I817 HydrophobicContact CD2-CD1 3.83Å
815	E	87.1	Confident	89.5	Confident	130 Å²	130	48.7 Å²	48.7	61%	0.607	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	146.4	176	-67.3	166.8	149.2	0	0	111.4	S810 T813 I817	S810-E815 PolarHBondContact N-O 3.37Å; S810-E815 VanDerWaalsContact N-O 3.16Å; T813-E815 WeakPolarHBondContact CB-OE2 3.4Å; T813-E815 PolarHBondContact O-N 3.43Å; T813-E815 WeakPolarHBondContact OG1-CB 3.39Å; T813-E815 VanDerWaalsContact OG1-CD 3.28Å; T813-E815 VanDerWaalsContact OG1-CG 3.3Å; T813-E815 WeakPolarHBondContact OG1-CG 3.28Å; T813-E815 PolarHBondContact OG1-N 3.25Å; T813-E815 PolarHBondContact OG1-OE2 3.36Å; E815-I817 PolarHBondContact O-N 3.45Å
816	G	86.3	Confident	89.9	Confident	21 Å²	21	49 Å²	49	22%	0.216	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	-30.6	179.1	0	0	0	0	0	116.1	S808 M818 N819 M820	S808-G816 WeakPolarHBondContact O-CA 3.41Å; G816-M818 PolarHBondContact O-N 3.03Å; G816-N819 PolarHBondContact O-N 2.97Å; G816-N819 VanDerWaalsContact O-N 3.08Å; G816-M820 PolarHBondContact O-N 3.42Å
817	I	90.1	Very high	90.2	Very high	9 Å²	9	48.9 Å²	48.9	5%	0.046	27%	0.265	C	S	.	.	H	α-helix	trans	-51.6	-50.6	-173.4	-61.2	-179.9	0	0	0	112.4	L685 K688 L689 I809 S810 L814 E815 R821	L685-I817 HydrophobicContact CD1-CD1 4.2Å; L685-I817 HydrophobicContact CD1-CG1 4.07Å; L685-I817 HydrophobicContact CD1-CG2 4.13Å; K688-I817 HydrophobicContact CB-CD1 4.23Å; L689-I817 HydrophobicContact CD2-CG2 3.45Å; L689-I817 VanDerWaalsContact CD2-CG2 3.45Å; L689-I817 HydrophobicContact CG-CG2 4.06Å; I809-I817 HydrophobicContact CG2-CG1 3.69Å; S810-I817 WeakPolarHBondContact O-CD1 3.37Å; L814-I817 HydrophobicContact CB-CD1 4.36Å; L814-I817 HydrophobicContact CD2-CD1 3.83Å; E815-I817 PolarHBondContact O-N 3.45Å; I817-R821 VanDerWaalsContact O-CB 3.3Å; I817-R821 WeakPolarHBondContact O-CB 3.41Å; I817-R821 PolarHBondContact O-N 2.89Å
818	M	90.6	Very high	90.5	Very high	108 Å²	108	47.9 Å²	47.9	53%	0.532	26%	0.26	S	S	.	.	H	α-helix	trans	-67.7	-36.6	-177.6	-73.6	-65.5	-153.7	0	0	112.5	G816 R821 N822	G816-M818 PolarHBondContact O-N 3.03Å; M818-R821 PolarHBondContact O-N 3.21Å; M818-R821 PolarHBondContact SD-NH1 2.72Å; M818-R821 VanDerWaalsContact SD-NH1 3.38Å; M818-N822 WeakPolarHBondContact O-CB 3.36Å; M818-N822 PolarHBondContact O-N 3.48Å; M818-N822 PolarHBondContact O-ND2 3.36Å; M818-N822 PolarHBondContact O-OD1 3.35Å
819	N	91.7	Very high	90.8	Very high	110 Å²	110	45.6 Å²	45.6	59%	0.588	24%	0.243	S	C	*	.	H	α-helix	trans	-69.6	-50.5	-178.5	-65.4	-5.1	0	0	0	110.1	G816 R821 N822 Q823	G816-N819 PolarHBondContact O-N 2.97Å; G816-N819 VanDerWaalsContact O-N 3.08Å; N819-R821 VanDerWaalsContact C-N 3.32Å; N819-R821 PolarHBondContact O-N 3.46Å; N819-N822 PolarHBondContact O-N 3.49Å; N819-Q823 PolarHBondContact O-N 3.49Å
820	M	91.8	Very high	90.9	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-53.6	-47.9	172.6	171.7	-79.3	-66	0	0	111.2	L685 L689 L753 F807 I809 G816 N822 Q823 A824	L685-M820 HydrophobicContact CD1-CE 4.32Å; L685-M820 HydrophobicContact CD2-CE 4.03Å; L689-M820 HydrophobicContact CD1-CE 4.36Å; L753-M820 HydrophobicContact CD1-CG 3.76Å; L753-M820 HydrophobicContact CD1-SD 3.73Å; L753-M820 HydrophobicContact CD2-CE 3.69Å; L753-M820 HydrophobicContact CD2-SD 3.59Å; L753-M820 VanDerWaalsContact CD2-SD 3.59Å; L753-M820 HydrophobicContact CG-SD 4.25Å; F807-M820 HydrophobicContact CB-CB 4.14Å; F807-M820 HydrophobicContact CD1-CB 4.14Å; F807-M820 HydrophobicContact CD2-CB 4.11Å; F807-M820 HydrophobicContact CD2-CG 4.08Å; F807-M820 HydrophobicContact CG-CB 3.81Å; F807-M820 HydrophobicContact CG-CG 4.24Å; I809-M820 HydrophobicContact CD1-CB 4.25Å; I809-M820 HydrophobicContact CD1-CE 4.14Å; I809-M820 HydrophobicContact CD1-CG 3.93Å; G816-M820 PolarHBondContact O-N 3.42Å; M820-N822 PolarHBondContact O-N 2.72Å; M820-Q823 PolarHBondContact O-N 3.29Å; M820-A824 VanDerWaalsContact O-CB 3.28Å; M820-A824 WeakPolarHBondContact O-CB 3.42Å; M820-A824 PolarHBondContact O-N 2.92Å
821	R	92.9	Very high	90.9	Very high	44 Å²	44	52.6 Å²	52.6	17%	0.166	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-48	178.9	-177.7	-157.3	68.5	179.9	-2.8	111.7	L689 M711 I817 M818 N819 A824 C825	L689-R821 HydrophobicContact CD2-CB 3.96Å; L689-R821 HydrophobicContact CD2-CG 4.02Å; M711-R821 HydrophobicContact CE-CG 4.02Å; M711-R821 HydrophobicContact SD-CG 3.84Å; I817-R821 VanDerWaalsContact O-CB 3.3Å; I817-R821 WeakPolarHBondContact O-CB 3.41Å; I817-R821 PolarHBondContact O-N 2.89Å; M818-R821 PolarHBondContact O-N 3.21Å; M818-R821 PolarHBondContact SD-NH1 2.72Å; M818-R821 VanDerWaalsContact SD-NH1 3.38Å; N819-R821 VanDerWaalsContact C-N 3.32Å; N819-R821 PolarHBondContact O-N 3.46Å; R821-A824 PolarHBondContact O-N 3.17Å; R821-C825 WeakPolarHBondContact O-CB 3.46Å; R821-C825 PolarHBondContact O-N 2.81Å; R821-C825 PolarHBondContact O-SG 3.22Å
822	N	93.9	Very high	91.1	Very high	48 Å²	48	53.7 Å²	53.7	26%	0.257	28%	0.281	S	S	.	.	H	α-helix	trans	-61.9	-47.7	-177.8	-65.8	-12.1	0	0	0	110.5	Y713 M818 N819 M820 C825 D826	Y713-N822 HydrophobicContact CE2-CB 4.11Å; Y713-N822 WeakPolarHBondContact CE2-OD1 3.41Å; M818-N822 WeakPolarHBondContact O-CB 3.36Å; M818-N822 PolarHBondContact O-N 3.48Å; M818-N822 PolarHBondContact O-ND2 3.36Å; M818-N822 PolarHBondContact O-OD1 3.35Å; N819-N822 PolarHBondContact O-N 3.49Å; M820-N822 PolarHBondContact O-N 2.72Å; N822-C825 PolarHBondContact O-N 2.69Å; N822-D826 WeakPolarHBondContact O-CB 3.32Å; N822-D826 PolarHBondContact O-N 3.3Å
823	Q	92.9	Very high	91.2	Very high	82 Å²	82	53 Å²	53	38%	0.383	27%	0.273	S	S	.	.	H	α-helix	trans	-67.2	-39.8	-179.7	-169.8	159.8	-12.7	0	0	112.5	L774 F807 N819 M820 C825 D826 L827	L774-Q823 HydrophobicContact CD2-CB 4.36Å; L774-Q823 HydrophobicContact CD2-CG 4.27Å; F807-Q823 HydrophobicContact CZ-CB 4.2Å; F807-Q823 VanDerWaalsContact CZ-CD 3.5Å; F807-Q823 HydrophobicContact CZ-CG 4.16Å; F807-Q823 VanDerWaalsContact CZ-OE1 3.22Å; N819-Q823 PolarHBondContact O-N 3.49Å; M820-Q823 PolarHBondContact O-N 3.29Å; Q823-C825 VanDerWaalsContact C-N 3.28Å; Q823-C825 PolarHBondContact O-N 3.04Å; Q823-D826 PolarHBondContact O-N 2.8Å; Q823-L827 HydrophobicContact CG-CD1 4.23Å; Q823-L827 HydrophobicContact CG-CG 4.48Å; Q823-L827 WeakPolarHBondContact O-CG 2.99Å; Q823-L827 PolarHBondContact O-N 2.99Å
824	A	92.9	Very high	91.3	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-37.5	173.5	0	0	0	0	0	112.6	L672 L774 M820 R821 L828	L672-A824 HydrophobicContact CD1-CB 3.87Å; L774-A824 HydrophobicContact CD1-CB 3.7Å; L774-A824 HydrophobicContact CD2-CB 3.79Å; L774-A824 HydrophobicContact CG-CB 4.38Å; M820-A824 VanDerWaalsContact O-CB 3.28Å; M820-A824 WeakPolarHBondContact O-CB 3.42Å; M820-A824 PolarHBondContact O-N 2.92Å; R821-A824 PolarHBondContact O-N 3.17Å; A824-L828 PolarHBondContact O-N 2.84Å
825	C	94.7	Very high	91.3	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-70.9	-38.8	175.2	-66.6	0	0	0	0	112	Y713 W718 R821 N822 Q823 L828 L829	Y713-C825 HydrophobicContact CD1-CB 3.31Å; Y713-C825 HydrophobicContact CE1-CB 3.38Å; Y713-C825 HydrophobicContact CG-CB 4.2Å; W718-C825 VanDerWaalsContact CH2-CA 3.47Å; W718-C825 HydrophobicContact CH2-CB 3.66Å; W718-C825 WeakPolarHBondContact CH2-O 3.45Å; W718-C825 HydrophobicContact CZ2-CB 3.68Å; W718-C825 HydrophobicContact CZ3-CB 4.06Å; R821-C825 WeakPolarHBondContact O-CB 3.46Å; R821-C825 PolarHBondContact O-N 2.81Å; R821-C825 PolarHBondContact O-SG 3.22Å; N822-C825 PolarHBondContact O-N 2.69Å; Q823-C825 VanDerWaalsContact C-N 3.28Å; Q823-C825 PolarHBondContact O-N 3.04Å; C825-L828 PolarHBondContact O-N 2.68Å; C825-L829 VanDerWaalsContact O-CG 3.28Å; C825-L829 WeakPolarHBondContact O-CG 3.45Å; C825-L829 PolarHBondContact O-N 2.88Å
826	D	94.6	Very high	91.2	Very high	38 Å²	38	54.3 Å²	54.3	20%	0.203	27%	0.27	C	S	.	.	H	α-helix	trans	-72.1	-43.5	-176.1	-75.5	-11.8	0	0	0	112.5	Y713 K714 N822 Q823 L828 L829 E830	Y713-D826 WeakPolarHBondContact CE1-OD1 3.48Å; Y713-D826 PolarHBondContact OH-OD1 3.47Å; Y713-D826 PolarHBondContact OH-OD2 3.03Å; K714-D826 WeakPolarHBondContact CE-OD1 3.2Å; K714-D826 IonicContact NZ-OD1 3.42Å; K714-D826 PolarHBondContact NZ-OD1 2.96Å; K714-D826 IonicContact NZ-OD2 2.69Å; K714-D826 PolarHBondContact NZ-OD2 2.88Å; N822-D826 WeakPolarHBondContact O-CB 3.32Å; N822-D826 PolarHBondContact O-N 3.3Å; Q823-D826 PolarHBondContact O-N 2.8Å; D826-L828 VanDerWaalsContact C-N 3.28Å; D826-L828 PolarHBondContact O-N 3.05Å; D826-L829 WeakPolarHBondContact O-CA 3.49Å; D826-L829 WeakPolarHBondContact O-CB 3.35Å; D826-L829 PolarHBondContact O-N 2.96Å; D826-E830 WeakPolarHBondContact O-CG 3.43Å; D826-E830 PolarHBondContact O-N 3.18Å
827	L	92.8	Very high	91.2	Very high	50 Å²	50	59.2 Å²	59.2	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-59	-36.8	172.7	-66.4	171	0	0	0	112.8	P772 L774 P805 Q823 S831	P772-L827 HydrophobicContact CB-CB 3.89Å; P772-L827 HydrophobicContact CG-CB 4.48Å; L774-L827 HydrophobicContact CD1-CD1 4.28Å; L774-L827 HydrophobicContact CD2-CD1 4.01Å; L774-L827 HydrophobicContact CG-CD1 4.13Å; P805-L827 HydrophobicContact CG-CD1 4.22Å; Q823-L827 HydrophobicContact CG-CD1 4.23Å; Q823-L827 HydrophobicContact CG-CG 4.48Å; Q823-L827 WeakPolarHBondContact O-CG 2.99Å; Q823-L827 PolarHBondContact O-N 2.99Å; L827-S831 PolarHBondContact O-N 2.83Å; L827-S831 PolarHBondContact O-OG 2.85Å
828	L	94.3	Very high	91	Very high	5 Å²	5	65.8 Å²	65.8	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-74.6	-28.2	173.9	-166.4	66	0	0	0	112.5	R670 T671 W718 A751 P772 A824 C825 D826 S831 R832	R670-L828 HydrophobicContact CB-CD2 4.35Å; T671-L828 WeakPolarHBondContact O-CD2 3.42Å; W718-L828 HydrophobicContact CE3-CD2 4.49Å; W718-L828 HydrophobicContact CH2-CB 4.09Å; W718-L828 HydrophobicContact CH2-CD2 4.16Å; W718-L828 HydrophobicContact CZ3-CB 4.11Å; W718-L828 HydrophobicContact CZ3-CD2 3.57Å; W718-L828 HydrophobicContact CZ3-CG 4.35Å; A751-L828 HydrophobicContact CB-CB 4.21Å; A751-L828 HydrophobicContact CB-CD2 4.44Å; P772-L828 HydrophobicContact CG-CB 4.35Å; P772-L828 HydrophobicContact CG-CD1 3.95Å; A824-L828 PolarHBondContact O-N 2.84Å; C825-L828 PolarHBondContact O-N 2.68Å; D826-L828 VanDerWaalsContact C-N 3.28Å; D826-L828 PolarHBondContact O-N 3.05Å; L828-S831 WeakPolarHBondContact CA-OG 3.32Å; L828-S831 PolarHBondContact O-OG 2.85Å; L828-R832 HydrophobicContact CD1-CG 4.38Å; L828-R832 HydrophobicContact CG-CG 4.29Å; L828-R832 WeakPolarHBondContact O-CB 3.16Å; L828-R832 WeakPolarHBondContact O-CG 3.41Å; L828-R832 PolarHBondContact O-N 2.85Å
829	L	93.8	Very high	90.6	Very high	22 Å²	22	62.6 Å²	62.6	12%	0.115	32%	0.315	C	S	.	.	H	α-helix	trans	-72.5	-42	174.7	-75.4	172.7	0	0	0	111.4	K714 L716 W718 C825 D826 R832 I833	K714-L829 HydrophobicContact CD-CD1 4.04Å; L716-L829 HydrophobicContact CD1-CD2 3.77Å; W718-L829 HydrophobicContact CH2-CD2 4.39Å; W718-L829 HydrophobicContact CH2-CG 4.02Å; W718-L829 HydrophobicContact CZ2-CD1 4.05Å; W718-L829 HydrophobicContact CZ2-CD2 4.02Å; W718-L829 HydrophobicContact CZ2-CG 3.82Å; C825-L829 VanDerWaalsContact O-CG 3.28Å; C825-L829 WeakPolarHBondContact O-CG 3.45Å; C825-L829 PolarHBondContact O-N 2.88Å; D826-L829 WeakPolarHBondContact O-CA 3.49Å; D826-L829 WeakPolarHBondContact O-CB 3.35Å; D826-L829 PolarHBondContact O-N 2.96Å; L829-R832 CarbonylContact O-C 3.57Å; L829-R832 PolarHBondContact O-N 3.09Å; L829-I833 WeakPolarHBondContact O-CB 3.39Å; L829-I833 WeakPolarHBondContact O-CD1 3.46Å; L829-I833 WeakPolarHBondContact O-CG1 3.35Å; L829-I833 PolarHBondContact O-N 3.05Å
830	E	92	Very high	89.9	Confident	109 Å²	109	67 Å²	67	51%	0.509	33%	0.328	S	S	.	.	H	α-helix	trans	-57.2	-60.7	177.5	-73.6	162.4	-175.8	0	0	111.1	D826 R832 I833 E834	D826-E830 WeakPolarHBondContact O-CG 3.43Å; D826-E830 PolarHBondContact O-N 3.18Å; E830-R832 VanDerWaalsContact C-N 3.3Å; E830-R832 PolarHBondContact O-N 3.09Å; E830-I833 WeakPolarHBondContact O-CA 3.25Å; E830-I833 WeakPolarHBondContact O-CB 3.3Å; E830-I833 PolarHBondContact O-N 2.96Å; E830-E834 PolarHBondContact O-N 3.46Å
831	S	89	Confident	89.1	Confident	40 Å²	40	70.9 Å²	70.9	28%	0.28	35%	0.353	S	S	.	.	H	α-helix	trans	-53.8	-41.5	175.7	50.2	0	0	0	0	113.6	L827 L828 I833 E834 E835	L827-S831 PolarHBondContact O-N 2.83Å; L827-S831 PolarHBondContact O-OG 2.85Å; L828-S831 WeakPolarHBondContact CA-OG 3.32Å; L828-S831 PolarHBondContact O-OG 2.85Å; S831-I833 VanDerWaalsContact C-N 3.33Å; S831-I833 PolarHBondContact O-N 2.84Å; S831-E834 PolarHBondContact O-N 3.07Å; S831-E835 PolarHBondContact O-N 2.88Å
832	R	90.7	Very high	88	Confident	43 Å²	43	69.7 Å²	69.7	16%	0.162	35%	0.354	C	S	.	.	H	α-helix	trans	-74.3	-18.2	176.3	-67.5	-72.5	-159.3	123	12.2	113.8	N668 T669 R749 L828 L829 E830 E835 K836	N668-R832 PolarHBondContact O-NH1 2.91Å; N668-R832 PolarHBondContact O-NH2 2.91Å; N668-R832 VanDerWaalsContact O-NH2 3.11Å; T669-R832 PolarHBondContact O-NH2 2.89Å; T669-R832 VanDerWaalsContact O-NH2 3.09Å; R749-R832 PolarHBondContact O-NH2 2.75Å; L828-R832 HydrophobicContact CD1-CG 4.38Å; L828-R832 HydrophobicContact CG-CG 4.29Å; L828-R832 WeakPolarHBondContact O-CB 3.16Å; L828-R832 WeakPolarHBondContact O-CG 3.41Å; L828-R832 PolarHBondContact O-N 2.85Å; L829-R832 CarbonylContact O-C 3.57Å; L829-R832 PolarHBondContact O-N 3.09Å; E830-R832 VanDerWaalsContact C-N 3.3Å; E830-R832 PolarHBondContact O-N 3.09Å; R832-E835 VanDerWaalsContact CD-OE2 3.32Å; R832-E835 WeakPolarHBondContact CD-OE2 3.11Å; R832-K836 WeakPolarHBondContact O-CD 3.06Å; R832-K836 VanDerWaalsContact O-CG 3.25Å; R832-K836 WeakPolarHBondContact O-CG 3.42Å
833	I	88.9	Confident	87	Confident	93 Å²	93	71.7 Å²	71.7	48%	0.477	37%	0.372	S	S	.	.	H	α-helix	trans	-80	-43.5	172.2	-75.6	162.2	0	0	0	109	L829 E830 S831 K836 L837	L829-I833 WeakPolarHBondContact O-CB 3.39Å; L829-I833 WeakPolarHBondContact O-CD1 3.46Å; L829-I833 WeakPolarHBondContact O-CG1 3.35Å; L829-I833 PolarHBondContact O-N 3.05Å; E830-I833 WeakPolarHBondContact O-CA 3.25Å; E830-I833 WeakPolarHBondContact O-CB 3.3Å; E830-I833 PolarHBondContact O-N 2.96Å; S831-I833 VanDerWaalsContact C-N 3.33Å; S831-I833 PolarHBondContact O-N 2.84Å; I833-K836 CarbonylContact O-C 3.46Å; I833-K836 WeakPolarHBondContact O-CA 3.43Å; I833-K836 WeakPolarHBondContact O-CB 3.19Å; I833-K836 PolarHBondContact O-N 2.94Å; I833-L837 HydrophobicContact CG2-CD1 3.81Å; I833-L837 HydrophobicContact CG2-CG 4.16Å; I833-L837 WeakPolarHBondContact O-CG 3.4Å; I833-L837 PolarHBondContact O-N 3.08Å
834	E	88.9	Confident	86.2	Confident	122 Å²	122	72 Å²	72	57%	0.57	38%	0.383	S	S	*	.	H	α-helix	trans	-58	-49.9	173.9	-67.2	175.3	167.5	0	0	111.9	E830 S831 K836 L837 N838	E830-E834 PolarHBondContact O-N 3.46Å; S831-E834 PolarHBondContact O-N 3.07Å; E834-K836 PolarHBondContact O-N 3.13Å; E834-K836 VanDerWaalsContact O-N 3.12Å; E834-L837 PolarHBondContact O-N 3.31Å; E834-N838 WeakPolarHBondContact O-CB 3.49Å; E834-N838 PolarHBondContact O-N 3.29Å; E834-N838 PolarHBondContact O-ND2 2.73Å
835	E	86.9	Confident	85.6	Confident	87 Å²	87	75.7 Å²	75.7	41%	0.407	40%	0.402	S	S	.	.	H	α-helix	trans	-51.3	-37.2	172.2	-78.5	-170.3	154.9	0	0	112.3	R749 S831 R832 S839	R749-E835 IonicContact CZ-OE1 2.7Å; R749-E835 IonicContact NH1-OE1 2.65Å; R749-E835 PolarHBondContact NH1-OE1 3.15Å; R749-E835 IonicContact NH1-OE2 2.78Å; S831-E835 PolarHBondContact O-N 2.88Å; R832-E835 VanDerWaalsContact CD-OE2 3.32Å; R832-E835 WeakPolarHBondContact CD-OE2 3.11Å; E835-S839 PolarHBondContact O-N 2.9Å
836	K	85.8	Confident	84.9	Confident	107 Å²	107	77.9 Å²	77.9	47%	0.465	42%	0.42	S	S	.	.	H	α-helix	trans	-81.8	-35.9	-177.6	-79.1	177.8	180	-177.8	0	113.8	R832 I833 E834 N838 S839	R832-K836 WeakPolarHBondContact O-CD 3.06Å; R832-K836 VanDerWaalsContact O-CG 3.25Å; R832-K836 WeakPolarHBondContact O-CG 3.42Å; I833-K836 CarbonylContact O-C 3.46Å; I833-K836 WeakPolarHBondContact O-CA 3.43Å; I833-K836 WeakPolarHBondContact O-CB 3.19Å; I833-K836 PolarHBondContact O-N 2.94Å; E834-K836 PolarHBondContact O-N 3.13Å; E834-K836 VanDerWaalsContact O-N 3.12Å; K836-N838 VanDerWaalsContact C-N 3.33Å; K836-S839 WeakPolarHBondContact O-CB 3.4Å; K836-S839 PolarHBondContact O-N 2.88Å; K836-S839 VanDerWaalsContact O-N 3.13Å; K836-S839 PolarHBondContact O-OG 3.41Å
837	L	85.8	Confident	84.3	Confident	124 Å²	124	82.9 Å²	82.9	65%	0.649	45%	0.447	S	S	*	.	H	α-helix	trans	-65.3	-40.4	174.7	-71.6	172.3	0	0	0	110.6	I833 E834 S839	I833-L837 HydrophobicContact CG2-CD1 3.81Å; I833-L837 HydrophobicContact CG2-CG 4.16Å; I833-L837 WeakPolarHBondContact O-CG 3.4Å; I833-L837 PolarHBondContact O-N 3.08Å; E834-L837 PolarHBondContact O-N 3.31Å; L837-S839 PolarHBondContact O-N 3.45Å
838	N	85.8	Confident	83.9	Confident	148 Å²	148	88.4 Å²	88.4	79%	0.791	46%	0.464	S	S	*	.	S	Bend	trans	-66.1	-19.3	172.5	-67.3	-21.2	0	0	0	112.9	E834 K836	E834-N838 WeakPolarHBondContact O-CB 3.49Å; E834-N838 PolarHBondContact O-N 3.29Å; E834-N838 PolarHBondContact O-ND2 2.73Å; K836-N838 VanDerWaalsContact C-N 3.33Å
839	S	82.3	Confident	83.4	Confident	40 Å²	40	94.8 Å²	94.8	28%	0.28	50%	0.498	S	S	.	.	S	Bend	trans	-84.6	146.3	176.5	89.1	0	0	0	0	112.5	E835 K836 L837 T841 G842	E835-S839 PolarHBondContact O-N 2.9Å; K836-S839 WeakPolarHBondContact O-CB 3.4Å; K836-S839 PolarHBondContact O-N 2.88Å; K836-S839 VanDerWaalsContact O-N 3.13Å; K836-S839 PolarHBondContact O-OG 3.41Å; L837-S839 PolarHBondContact O-N 3.45Å; S839-T841 PolarHBondContact O-N 2.93Å; S839-T841 PolarHBondContact OG-N 2.6Å; S839-T841 PolarHBondContact OG-OG1 3.34Å; S839-G842 PolarHBondContact O-N 2.69Å; S839-G842 VanDerWaalsContact O-N 3.12Å
840	K	78.1	Confident	83.2	Confident	202 Å²	202	100.5 Å²	100.5	88%	0.878	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-7	171.9	-62.2	-174.8	-179.7	-178.2	0	114.4	S843	K840-S843 PolarHBondContact O-OG 3.19Å
841	T	73.8	Confident	83.1	Confident	83 Å²	83	101.1 Å²	101.1	51%	0.509	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-21.5	177.2	73	0	0	0	0	113.3	S839 S843 S844 L845	S839-T841 PolarHBondContact O-N 2.93Å; S839-T841 PolarHBondContact OG-N 2.6Å; S839-T841 PolarHBondContact OG-OG1 3.34Å; T841-S843 PolarHBondContact O-N 2.91Å; T841-S844 PolarHBondContact O-N 3.41Å; T841-L845 PolarHBondContact O-N 3Å
842	G	70.3	Confident	83.1	Confident	19 Å²	19	103.2 Å²	103.2	20%	0.196	55%	0.554	C	S	.	*	H	α-helix	trans	-60.2	-43.5	179.7	0	0	0	0	0	113.2	S839 S844 L845 A846	S839-G842 PolarHBondContact O-N 2.69Å; S839-G842 VanDerWaalsContact O-N 3.12Å; G842-S844 VanDerWaalsContact C-N 3.3Å; G842-S844 PolarHBondContact O-N 3.05Å; G842-L845 WeakPolarHBondContact O-CB 3.47Å; G842-L845 PolarHBondContact O-N 3.44Å; G842-A846 PolarHBondContact O-N 3.35Å
843	S	72.4	Confident	83	Confident	90 Å²	90	107.3 Å²	107.3	63%	0.629	58%	0.584	S	S	*	*	H	α-helix	trans	-63.3	-32.7	178.7	59.1	0	0	0	0	113.3	K840 T841 L845 A846	K840-S843 PolarHBondContact O-OG 3.19Å; T841-S843 PolarHBondContact O-N 2.91Å; S843-L845 VanDerWaalsContact C-N 3.29Å; S843-L845 PolarHBondContact O-N 2.93Å; S843-A846 WeakPolarHBondContact O-CB 3.31Å; S843-A846 PolarHBondContact O-N 2.8Å
844	S	77.4	Confident	82.8	Confident	89 Å²	89	108.2 Å²	108.2	62%	0.622	60%	0.596	S	S	*	*	H	α-helix	trans	-68.8	-28.3	174.7	-173.8	0	0	0	0	112.7	T841 G842	T841-S844 PolarHBondContact O-N 3.41Å; G842-S844 VanDerWaalsContact C-N 3.3Å; G842-S844 PolarHBondContact O-N 3.05Å
845	L	78.6	Confident	82.6	Confident	77 Å²	77	106.8 Å²	106.8	40%	0.403	60%	0.604	S	S	.	*	H	α-helix	trans	-82.6	-21.8	177.7	-66.6	172.5	0	0	0	113.3	T841 G842 S843 N847 R848 L849	T841-L845 PolarHBondContact O-N 3Å; G842-L845 WeakPolarHBondContact O-CB 3.47Å; G842-L845 PolarHBondContact O-N 3.44Å; S843-L845 VanDerWaalsContact C-N 3.29Å; S843-L845 PolarHBondContact O-N 2.93Å; L845-N847 VanDerWaalsContact C-N 3.25Å; L845-N847 PolarHBondContact O-N 2.96Å; L845-R848 WeakPolarHBondContact O-CA 3.2Å; L845-R848 WeakPolarHBondContact O-CB 3.34Å; L845-R848 PolarHBondContact O-N 3.36Å; L845-L849 PolarHBondContact O-N 3.35Å
846	A	80.2	Confident	82.2	Confident	47 Å²	47	112.4 Å²	112.4	39%	0.388	63%	0.628	S	S	.	*	H	α-helix	trans	-51.9	-42.8	-179.8	0	0	0	0	0	112.7	G842 S843 R848 L849 H850	G842-A846 PolarHBondContact O-N 3.35Å; S843-A846 WeakPolarHBondContact O-CB 3.31Å; S843-A846 PolarHBondContact O-N 2.8Å; A846-R848 PolarHBondContact O-N 2.99Å; A846-R848 VanDerWaalsContact O-N 3.09Å; A846-L849 PolarHBondContact O-N 3.35Å; A846-H850 PolarHBondContact O-N 2.92Å
847	N	82	Confident	81.7	Confident	144 Å²	144	112.9 Å²	112.9	77%	0.77	64%	0.639	S	S	*	*	H	α-helix	trans	-61.6	-17.9	176.8	-66.2	-8.5	0	0	0	114.5	L845	L845-N847 VanDerWaalsContact C-N 3.25Å; L845-N847 PolarHBondContact O-N 2.96Å
848	R	84.5	Confident	81.2	Confident	165 Å²	165	115.7 Å²	115.7	62%	0.623	65%	0.649	S	S	*	*	H	α-helix	trans	-97.3	-22.5	175.2	-61.1	-174.3	178.6	-163.9	-0.2	113	L845 A846	L845-R848 WeakPolarHBondContact O-CA 3.2Å; L845-R848 WeakPolarHBondContact O-CB 3.34Å; L845-R848 PolarHBondContact O-N 3.36Å; A846-R848 PolarHBondContact O-N 2.99Å; A846-R848 VanDerWaalsContact O-N 3.09Å
849	L	85.3	Confident	80.8	Confident	140 Å²	140	112.5 Å²	112.5	73%	0.733	65%	0.651	S	S	*	*	H	α-helix	trans	-83.5	-27.8	176.6	-64.5	172.3	0	0	0	111.5	L845 A846 V851	L845-L849 PolarHBondContact O-N 3.35Å; A846-L849 PolarHBondContact O-N 3.35Å; L849-V851 PolarHBondContact O-N 3.47Å
850	H	87.6	Confident	80.7	Confident	142 Å²	142	116.6 Å²	116.6	66%	0.657	67%	0.669	S	S	*	*			trans	-68.6	109.8	177.1	-179.8	-77.1	0	0	0	112.3	A846	A846-H850 PolarHBondContact O-N 2.92Å
851	V	90.1	Very high	80.9	Confident	122 Å²	122	115.9 Å²	115.9	74%	0.739	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-81.5	123.1	170.4	-179.6	0	0	0	0	109.3	L849 V853	L849-V851 PolarHBondContact O-N 3.47Å; V851-V853 PolarHBondContact O-N 2.86Å
852	A	89.4	Confident	81.3	Confident	83 Å²	83	122.3 Å²	122.3	69%	0.686	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-73.7	117.7	178.6	0	0	0	0	0	111.1
853	V	89.7	Confident	82.2	Confident	130 Å²	130	126 Å²	126	79%	0.788	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-87.7	124.5	172.3	-177.5	0	0	0	0	108.7	V851	V851-V853 PolarHBondContact O-N 2.86Å
854	P	84.2	Confident	83	Confident	112 Å²	112	127.1 Å²	127.1	73%	0.727	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-69.4	138.3	176.8	28.7	-33.8	0	0	0	110.9
855	A	83.6	Confident	83.7	Confident	91 Å²	91	132 Å²	132	75%	0.752	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-62.2	138.1	172.2	0	0	0	0	0	110.5	V857	A855-V857 PolarHBondContact O-N 3.33Å
856	K	79.9	Confident	84.3	Confident	206 Å²	206	132.1 Å²	132.1	90%	0.896	72%	0.72	S	S	*	*			trans	-68.5	115.7	174.7	-67.8	-179	-179.6	179.4	0	109
857	V	74.9	Confident	84.9	Confident	116 Å²	116	132.8 Å²	132.8	70%	0.703	72%	0.721	S	S	*	*			trans	-99.2	121.5	166.4	179.7	0	0	0	0	106.6	A855	A855-V857 PolarHBondContact O-N 3.33Å
858	E	76.2	Confident	85.4	Confident	183 Å²	183	130.7 Å²	130.7	86%	0.855	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	153.9	-175.1	-58.9	-163.1	153.4	0	0	112.5
859	G	76.8	Confident	85.6	Confident	82 Å²	82	125.8 Å²	125.8	85%	0.845	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.2	-14.5	170.4	0	0	0	0	0	118.1
860	L	78.8	Confident	85.8	Confident	125 Å²	125	122 Å²	122	65%	0.654	68%	0.683	S	S	*	*			trans	-128.2	104.7	-175.3	-76.1	160.2	0	0	0	113.3
861	Q	82.5	Confident	85.8	Confident	187 Å²	187	118.9 Å²	118.9	87%	0.874	67%	0.672	S	S	*	*			trans	-76.7	137.3	170	-63.2	-171.2	7.9	0	0	111.1	P863	Q861-P863 VanDerWaalsContact C-CD 3.49Å
862	R	83.4	Confident	85.6	Confident	218 Å²	218	120.8 Å²	120.8	82%	0.823	67%	0.665	S	S	*	*			trans	-126.6	66.9	178	-61.9	-179.2	-174.5	163.7	2.7	111.1
863	P	88.9	Confident	85.1	Confident	97 Å²	97	123.6 Å²	123.6	63%	0.63	66%	0.662	S	S	*	*			trans	-66.8	152.6	-179.6	29.5	-35.6	0	0	0	111.8	Q861 F865	Q861-P863 VanDerWaalsContact C-CD 3.49Å; P863-F865 PolarHBondContact O-N 3.23Å
864	P	90	Very high	84.5	Confident	113 Å²	113	124.7 Å²	124.7	73%	0.734	65%	0.652	S	S	*	*			trans	-70.7	117.3	174.2	29.1	-33.4	0	0	0	110.7	I866	P864-I866 PolarHBondContact O-N 3.42Å
865	F	91.1	Very high	84.2	Confident	191 Å²	191	122.6 Å²	122.6	84%	0.838	64%	0.64	S	S	*	*			trans	-78.7	99.4	176.7	-172	-99.4	0	0	0	111	P863 P867	P863-F865 PolarHBondContact O-N 3.23Å; F865-P867 HydrophobicContact CE1-CG 4.17Å
866	I	91.8	Very high	84	Confident	80 Å²	80	120.2 Å²	120.2	41%	0.41	62%	0.62	S	S	.	*			trans	-109.4	115.1	175.2	-57	177	0	0	0	108.1	P864 V870 L871	P864-I866 PolarHBondContact O-N 3.42Å; I866-V870 HydrophobicContact CG2-CB 4.28Å; I866-V870 HydrophobicContact CG2-CG1 4.43Å; I866-L871 HydrophobicContact CG2-CD2 3.93Å; I866-L871 HydrophobicContact CG2-CG 4.09Å
867	P	93.2	Very high	83.4	Confident	62 Å²	62	116.4 Å²	116.4	40%	0.403	61%	0.607	S	S	.	*			trans	-63.3	140.4	178.5	-23.6	33.9	0	0	0	112.7	F865 A869 V870 L871	F865-P867 HydrophobicContact CE1-CG 4.17Å; P867-A869 PolarHBondContact O-N 3.33Å; P867-A869 VanDerWaalsContact O-N 3.14Å; P867-V870 HydrophobicContact CB-CG2 4.37Å; P867-V870 WeakPolarHBondContact O-CB 3.44Å; P867-V870 PolarHBondContact O-N 3.44Å; P867-L871 PolarHBondContact O-N 2.93Å
868	E	91.6	Very high	83.1	Confident	100 Å²	100	115.2 Å²	115.2	47%	0.467	60%	0.6	S	S	.	*	H	α-helix	trans	-52.5	-36.6	179.1	175.7	59.7	-170	0	0	113.1	V870 L871 R872	E868-V870 PolarHBondContact O-N 3.04Å; E868-L871 PolarHBondContact O-N 2.79Å; E868-L871 VanDerWaalsContact O-N 3.13Å; E868-R872 PolarHBondContact O-N 3.48Å; E868-R872 IonicContact OE1-CZ 3.75Å; E868-R872 VanDerWaalsContact OE1-CZ 3.3Å; E868-R872 IonicContact OE1-NE 2.78Å; E868-R872 PolarHBondContact OE1-NE 3.2Å; E868-R872 IonicContact OE1-NH2 3.08Å; E868-R872 PolarHBondContact OE1-NH2 3.46Å
869	A	88.8	Confident	82.8	Confident	62 Å²	62	110.9 Å²	110.9	51%	0.512	58%	0.582	S	S	.	*	H	α-helix	trans	-60.2	-29.6	175	0	0	0	0	0	113.7	P867 K873	P867-A869 PolarHBondContact O-N 3.33Å; P867-A869 VanDerWaalsContact O-N 3.14Å; A869-K873 WeakPolarHBondContact O-CB 3.46Å; A869-K873 VanDerWaalsContact O-CG 3.31Å; A869-K873 WeakPolarHBondContact O-CG 3.41Å; A869-K873 PolarHBondContact O-N 2.79Å; A869-K873 VanDerWaalsContact O-N 3.09Å
870	V	88.8	Confident	82.2	Confident	59 Å²	59	110.4 Å²	110.4	36%	0.358	56%	0.56	S	S	.	*	H	α-helix	trans	-77.2	-36	176.3	-178.5	0	0	0	0	110.8	I866 P867 E868 K873 R874	I866-V870 HydrophobicContact CG2-CB 4.28Å; I866-V870 HydrophobicContact CG2-CG1 4.43Å; P867-V870 HydrophobicContact CB-CG2 4.37Å; P867-V870 WeakPolarHBondContact O-CB 3.44Å; P867-V870 PolarHBondContact O-N 3.44Å; E868-V870 PolarHBondContact O-N 3.04Å; V870-K873 PolarHBondContact O-N 2.86Å; V870-R874 WeakPolarHBondContact O-CG 3.45Å; V870-R874 PolarHBondContact O-N 2.85Å
871	L	88.2	Confident	81.5	Confident	78 Å²	78	109.1 Å²	109.1	41%	0.408	55%	0.55	S	S	.	*	H	α-helix	trans	-64.8	-47	175.1	-62.9	177.1	0	0	0	110.8	I866 P867 E868 K873 R874 S875	I866-L871 HydrophobicContact CG2-CD2 3.93Å; I866-L871 HydrophobicContact CG2-CG 4.09Å; P867-L871 PolarHBondContact O-N 2.93Å; E868-L871 PolarHBondContact O-N 2.79Å; E868-L871 VanDerWaalsContact O-N 3.13Å; L871-K873 PolarHBondContact O-N 3.19Å; L871-R874 PolarHBondContact O-N 3.32Å; L871-S875 PolarHBondContact O-N 3.05Å; L871-S875 PolarHBondContact O-OG 2.85Å
872	R	85.2	Confident	80.5	Confident	161 Å²	161	105.9 Å²	105.9	61%	0.608	54%	0.535	S	S	*	.	H	α-helix	trans	-62.4	-38.4	174.7	-64.8	-178.8	-167.7	179.2	4.7	113.2	E868 S875 A876	E868-R872 PolarHBondContact O-N 3.48Å; E868-R872 IonicContact OE1-CZ 3.75Å; E868-R872 VanDerWaalsContact OE1-CZ 3.3Å; E868-R872 IonicContact OE1-NE 2.78Å; E868-R872 PolarHBondContact OE1-NE 3.2Å; E868-R872 IonicContact OE1-NH2 3.08Å; E868-R872 PolarHBondContact OE1-NH2 3.46Å; R872-S875 PolarHBondContact O-OG 3.29Å; R872-A876 WeakPolarHBondContact O-CB 3.35Å; R872-A876 PolarHBondContact O-N 2.84Å
873	K	80	Confident	79.4	Confident	142 Å²	142	101.1 Å²	101.1	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-64.9	-40.1	173.1	-80.1	-179.6	176.8	-174.3	0	112.1	A869 V870 L871 A876 M877	A869-K873 WeakPolarHBondContact O-CB 3.46Å; A869-K873 VanDerWaalsContact O-CG 3.31Å; A869-K873 WeakPolarHBondContact O-CG 3.41Å; A869-K873 PolarHBondContact O-N 2.79Å; A869-K873 VanDerWaalsContact O-N 3.09Å; V870-K873 PolarHBondContact O-N 2.86Å; L871-K873 PolarHBondContact O-N 3.19Å; K873-A876 PolarHBondContact O-N 3.32Å; K873-M877 WeakPolarHBondContact O-CB 3.3Å; K873-M877 VanDerWaalsContact O-CG 3.26Å; K873-M877 WeakPolarHBondContact O-CG 3.13Å; K873-M877 PolarHBondContact O-N 2.78Å
874	R	76.7	Confident	78.1	Confident	153 Å²	153	100.3 Å²	100.3	58%	0.577	51%	0.509	S	S	*	.	H	α-helix	trans	-64.6	-43	176.2	-76.3	175.7	176.4	-176.5	-0.4	112.3	V870 L871 V878	V870-R874 WeakPolarHBondContact O-CG 3.45Å; V870-R874 PolarHBondContact O-N 2.85Å; L871-R874 PolarHBondContact O-N 3.32Å; R874-V878 WeakPolarHBondContact O-CG2 2.95Å; R874-V878 PolarHBondContact O-N 2.89Å
875	S	78.1	Confident	76.6	Confident	69 Å²	69	100.9 Å²	100.9	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-40.3	176.4	57.8	0	0	0	0	112.3	L871 R872 V878 I879	L871-S875 PolarHBondContact O-N 3.05Å; L871-S875 PolarHBondContact O-OG 2.85Å; R872-S875 PolarHBondContact O-OG 3.29Å; S875-V878 PolarHBondContact O-N 2.73Å; S875-I879 WeakPolarHBondContact O-CG1 3.33Å; S875-I879 PolarHBondContact O-N 3.26Å
876	A	78.3	Confident	75.1	Confident	40 Å²	40	99 Å²	99	33%	0.331	49%	0.491	S	S	.	.	H	α-helix	trans	-60.6	-48.4	173.6	0	0	0	0	0	112.4	R872 K873 V878 I879 D880	R872-A876 WeakPolarHBondContact O-CB 3.35Å; R872-A876 PolarHBondContact O-N 2.84Å; K873-A876 PolarHBondContact O-N 3.32Å; A876-V878 VanDerWaalsContact C-N 3.28Å; A876-V878 PolarHBondContact O-N 2.62Å; A876-I879 WeakPolarHBondContact O-CB 3.26Å; A876-I879 PolarHBondContact O-N 2.84Å; A876-D880 PolarHBondContact O-N 2.95Å
877	M	68.2	Low	73.5	Confident	127 Å²	127	98.7 Å²	98.7	63%	0.626	49%	0.49	S	S	*	.	H	α-helix	trans	-60.4	-33.2	179.8	-73.2	-179.9	76.2	0	0	113.3	K873 I879 D880 E881	K873-M877 WeakPolarHBondContact O-CB 3.3Å; K873-M877 VanDerWaalsContact O-CG 3.26Å; K873-M877 WeakPolarHBondContact O-CG 3.13Å; K873-M877 PolarHBondContact O-N 2.78Å; M877-I879 VanDerWaalsContact C-N 3.35Å; M877-D880 PolarHBondContact O-N 2.93Å; M877-E881 WeakPolarHBondContact O-CB 3.33Å; M877-E881 PolarHBondContact O-N 2.83Å
878	V	67.9	Low	71.9	Confident	90 Å²	90	100 Å²	100	55%	0.545	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-37	174.9	171.3	0	0	0	0	111.6	R874 S875 A876 Q882	R874-V878 WeakPolarHBondContact O-CG2 2.95Å; R874-V878 PolarHBondContact O-N 2.89Å; S875-V878 PolarHBondContact O-N 2.73Å; A876-V878 VanDerWaalsContact C-N 3.28Å; A876-V878 PolarHBondContact O-N 2.62Å; V878-Q882 WeakPolarHBondContact O-CG 3.36Å
879	I	69.6	Low	70.3	Confident	92 Å²	92	99 Å²	99	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-70.5	-43.5	175.8	-63.5	166.3	0	0	0	110.2	S875 A876 M877 Q882 K883	S875-I879 WeakPolarHBondContact O-CG1 3.33Å; S875-I879 PolarHBondContact O-N 3.26Å; A876-I879 WeakPolarHBondContact O-CB 3.26Å; A876-I879 PolarHBondContact O-N 2.84Å; M877-I879 VanDerWaalsContact C-N 3.35Å; I879-Q882 PolarHBondContact O-N 3.4Å; I879-K883 PolarHBondContact O-N 3.24Å; I879-K883 VanDerWaalsContact O-N 3.12Å
880	D	65.3	Low	68.9	Low	73 Å²	73	100.6 Å²	100.6	39%	0.39	49%	0.492	S	S	.	.	H	α-helix	trans	-72.3	-35.8	-177.5	-66.9	-27.7	0	0	0	112.2	A876 M877 Q882 K883 E884	A876-D880 PolarHBondContact O-N 2.95Å; M877-D880 PolarHBondContact O-N 2.93Å; D880-Q882 PolarHBondContact O-N 2.7Å; D880-K883 CarbonylContact O-C 3.59Å; D880-K883 PolarHBondContact O-N 2.99Å; D880-K883 VanDerWaalsContact O-N 3.1Å; D880-K883 IonicContact OD1-NZ 3.7Å; D880-K883 PolarHBondContact OD1-NZ 2.9Å; D880-K883 VanDerWaalsContact OD1-NZ 3.15Å; D880-E884 WeakPolarHBondContact O-CB 3.46Å; D880-E884 WeakPolarHBondContact O-CG 3.22Å; D880-E884 PolarHBondContact O-N 3.03Å
881	E	63.7	Low	67.5	Low	97 Å²	97	102.6 Å²	102.6	45%	0.453	50%	0.5	S	S	.	.	H	α-helix	trans	-57.1	-36.1	169.4	-91.3	-162.3	-151.3	0	0	112.6	M877 K885	M877-E881 WeakPolarHBondContact O-CB 3.33Å; M877-E881 PolarHBondContact O-N 2.83Å; E881-K885 WeakPolarHBondContact O-CB 3.3Å; E881-K885 WeakPolarHBondContact O-CD 3.47Å; E881-K885 WeakPolarHBondContact O-CG 3.32Å; E881-K885 PolarHBondContact O-N 3.23Å; E881-K885 IonicContact OE2-NZ 2.95Å; E881-K885 PolarHBondContact OE2-NZ 3.39Å
882	Q	60.9	Low	66	Low	119 Å²	119	108.1 Å²	108.1	56%	0.556	52%	0.516	S	S	*	.	H	α-helix	trans	-71.8	-37.4	176.7	-69.7	-179	10.9	0	0	111.9	V878 I879 D880 K886	V878-Q882 WeakPolarHBondContact O-CG 3.36Å; I879-Q882 PolarHBondContact O-N 3.4Å; D880-Q882 PolarHBondContact O-N 2.7Å; Q882-K886 WeakPolarHBondContact O-CG 3.35Å; Q882-K886 PolarHBondContact O-N 3.32Å
883	K	62.2	Low	64.6	Low	118 Å²	118	110 Å²	110	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-67.6	-45.6	173.3	-68.9	174.6	-171.3	158.5	0	111.4	I879 D880 K886 L887	I879-K883 PolarHBondContact O-N 3.24Å; I879-K883 VanDerWaalsContact O-N 3.12Å; D880-K883 CarbonylContact O-C 3.59Å; D880-K883 PolarHBondContact O-N 2.99Å; D880-K883 VanDerWaalsContact O-N 3.1Å; D880-K883 IonicContact OD1-NZ 3.7Å; D880-K883 PolarHBondContact OD1-NZ 2.9Å; D880-K883 VanDerWaalsContact OD1-NZ 3.15Å; K883-K886 CarbonylContact O-C 3.56Å; K883-K886 WeakPolarHBondContact O-CB 3.42Å; K883-K886 PolarHBondContact O-N 3.3Å; K883-L887 PolarHBondContact O-N 3.25Å
884	E	60.1	Low	63.3	Low	81 Å²	81	109.5 Å²	109.5	38%	0.379	52%	0.52	S	S	.	.	H	α-helix	trans	-59.9	-46.2	176.5	-77.6	-169	157.4	0	0	111.7	D880 K886 L887 L888 F905	D880-E884 WeakPolarHBondContact O-CB 3.46Å; D880-E884 WeakPolarHBondContact O-CG 3.22Å; D880-E884 PolarHBondContact O-N 3.03Å; E884-K886 VanDerWaalsContact C-N 3.27Å; E884-K886 PolarHBondContact O-N 3.37Å; E884-L887 PolarHBondContact O-N 3.16Å; E884-L888 WeakPolarHBondContact O-CB 3.43Å; E884-L888 PolarHBondContact O-N 3.23Å; E884-F905 WeakPolarHBondContact OE1-CE1 3.49Å; E884-F905 WeakPolarHBondContact OE1-CZ 3.29Å
885	K	59.5	Low	62	Low	125 Å²	125	109.7 Å²	109.7	54%	0.543	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-38	176.3	-73.3	164.4	-165.2	162.4	0	111.5	E881 V889	E881-K885 WeakPolarHBondContact O-CB 3.3Å; E881-K885 WeakPolarHBondContact O-CD 3.47Å; E881-K885 WeakPolarHBondContact O-CG 3.32Å; E881-K885 PolarHBondContact O-N 3.23Å; E881-K885 IonicContact OE2-NZ 2.95Å; E881-K885 PolarHBondContact OE2-NZ 3.39Å; K885-V889 WeakPolarHBondContact O-CB 3.16Å; K885-V889 WeakPolarHBondContact O-CG2 3.44Å; K885-V889 PolarHBondContact O-N 3.26Å
886	K	59.5	Low	60.4	Low	151 Å²	151	111.2 Å²	111.2	66%	0.657	54%	0.54	S	S	*	.	H	α-helix	trans	-66.4	-47.8	172.1	-76.3	175.8	175.2	179.7	0	112.2	Q882 K883 E884 V889 I890	Q882-K886 WeakPolarHBondContact O-CG 3.35Å; Q882-K886 PolarHBondContact O-N 3.32Å; K883-K886 CarbonylContact O-C 3.56Å; K883-K886 WeakPolarHBondContact O-CB 3.42Å; K883-K886 PolarHBondContact O-N 3.3Å; E884-K886 VanDerWaalsContact C-N 3.27Å; E884-K886 PolarHBondContact O-N 3.37Å; K886-V889 PolarHBondContact O-N 3.1Å; K886-I890 WeakPolarHBondContact O-CG1 3.18Å; K886-I890 PolarHBondContact O-N 3.35Å; K886-I890 VanDerWaalsContact O-N 3.1Å
887	L	58.1	Low	59	Low	73 Å²	73	120.4 Å²	120.4	38%	0.382	57%	0.567	S	S	.	*	H	α-helix	trans	-64.8	-42.5	-179.5	-126.1	90.7	0	0	0	112.1	K883 E884 V889 I890 I891 I903	K883-L887 PolarHBondContact O-N 3.25Å; E884-L887 PolarHBondContact O-N 3.16Å; L887-V889 VanDerWaalsContact C-N 3.31Å; L887-V889 PolarHBondContact O-N 3.47Å; L887-I890 WeakPolarHBondContact O-CB 3.36Å; L887-I890 PolarHBondContact O-N 3.02Å; L887-I890 VanDerWaalsContact O-N 3.1Å; L887-I891 HydrophobicContact CD2-CD1 4.39Å; L887-I891 WeakPolarHBondContact O-CG1 3.19Å; L887-I891 PolarHBondContact O-N 3.35Å; L887-I903 HydrophobicContact CD2-CD1 4.09Å
888	L	58.6	Low	58.1	Low	89 Å²	89	124.2 Å²	124.2	47%	0.466	58%	0.576	S	S	.	*	H	α-helix	trans	-66.4	-32.5	178.5	-161.9	96.2	0	0	0	111.8	E884 R892	E884-L888 WeakPolarHBondContact O-CB 3.43Å; E884-L888 PolarHBondContact O-N 3.23Å; L888-R892 VanDerWaalsContact O-CB 3.28Å; L888-R892 WeakPolarHBondContact O-CB 3.37Å; L888-R892 WeakPolarHBondContact O-CG 3.29Å; L888-R892 PolarHBondContact O-N 2.89Å
889	V	58.3	Low	57	Low	81 Å²	81	124.4 Å²	124.4	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-69.3	-34.1	171.4	165.5	0	0	0	0	111.6	K885 K886 L887 R893	K885-V889 WeakPolarHBondContact O-CB 3.16Å; K885-V889 WeakPolarHBondContact O-CG2 3.44Å; K885-V889 PolarHBondContact O-N 3.26Å; K886-V889 PolarHBondContact O-N 3.1Å; L887-V889 VanDerWaalsContact C-N 3.31Å; L887-V889 PolarHBondContact O-N 3.47Å; V889-R893 WeakPolarHBondContact O-CB 3.31Å; V889-R893 WeakPolarHBondContact O-CG 3.35Å; V889-R893 PolarHBondContact O-N 3.13Å
890	I	59.2	Low	55.7	Low	95 Å²	95	126.1 Å²	126.1	49%	0.487	60%	0.599	S	S	.	*	H	α-helix	trans	-69.5	-50	173.1	-65.5	163.1	0	0	0	110	K886 L887 R892 R893 F894	K886-I890 WeakPolarHBondContact O-CG1 3.18Å; K886-I890 PolarHBondContact O-N 3.35Å; K886-I890 VanDerWaalsContact O-N 3.1Å; L887-I890 WeakPolarHBondContact O-CB 3.36Å; L887-I890 PolarHBondContact O-N 3.02Å; L887-I890 VanDerWaalsContact O-N 3.1Å; I890-R892 PolarHBondContact O-N 3.49Å; I890-R893 WeakPolarHBondContact O-CB 3.44Å; I890-R893 PolarHBondContact O-N 3.33Å; I890-F894 HydrophobicContact CG2-CD2 4.16Å; I890-F894 HydrophobicContact CG2-CE2 4.49Å; I890-F894 WeakPolarHBondContact O-CD2 3.37Å; I890-F894 PolarHBondContact O-N 3.15Å
891	I	60.4	Low	54.7	Low	101 Å²	101	129.9 Å²	129.9	52%	0.518	62%	0.618	S	S	.	*	H	α-helix	trans	-60.7	-42.1	179.6	-66	163.5	0	0	0	111.2	L887 R893 F894	L887-I891 HydrophobicContact CD2-CD1 4.39Å; L887-I891 WeakPolarHBondContact O-CG1 3.19Å; L887-I891 PolarHBondContact O-N 3.35Å; I891-R893 PolarHBondContact O-N 3.27Å; I891-F894 CarbonylContact O-C 3.48Å; I891-F894 PolarHBondContact O-N 3.21Å
892	R	56.6	Low	53.7	Low	194 Å²	194	134.7 Å²	134.7	73%	0.732	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-8.9	175.3	-75.4	-179.1	173.6	174.7	-0.3	115	L888 I890	L888-R892 VanDerWaalsContact O-CB 3.28Å; L888-R892 WeakPolarHBondContact O-CB 3.37Å; L888-R892 WeakPolarHBondContact O-CG 3.29Å; L888-R892 PolarHBondContact O-N 2.89Å; I890-R892 PolarHBondContact O-N 3.49Å
893	R	55.7	Low	53.1	Low	201 Å²	201	132.7 Å²	132.7	76%	0.758	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-19.9	173.4	-83.5	179.8	168.5	-168.4	-3.5	113	V889 I890 I891	V889-R893 WeakPolarHBondContact O-CB 3.31Å; V889-R893 WeakPolarHBondContact O-CG 3.35Å; V889-R893 PolarHBondContact O-N 3.13Å; I890-R893 WeakPolarHBondContact O-CB 3.44Å; I890-R893 PolarHBondContact O-N 3.33Å; I891-R893 PolarHBondContact O-N 3.27Å
894	F	52.8	Low	52.3	Low	130 Å²	130	133.7 Å²	133.7	57%	0.57	65%	0.646	S	S	*	*			trans	-122	94	179.4	-66.6	-76.2	0	0	0	108.8	I890 I891 T896	I890-F894 HydrophobicContact CG2-CD2 4.16Å; I890-F894 HydrophobicContact CG2-CE2 4.49Å; I890-F894 WeakPolarHBondContact O-CD2 3.37Å; I890-F894 PolarHBondContact O-N 3.15Å; I891-F894 CarbonylContact O-C 3.48Å; I891-F894 PolarHBondContact O-N 3.21Å; F894-T896 HydrophobicContact CB-CG2 4.35Å; F894-T896 PolarHBondContact O-N 3.45Å; F894-T896 PolarHBondContact O-OG1 3.4Å
895	D	49.3	Very low	51.9	Low	157 Å²	157	135.6 Å²	135.6	84%	0.84	65%	0.653	S	S	*	*			trans	-67.8	54.7	171.4	-79.1	-35.3	0	0	0	111.4
896	T	44.5	Very low	51.9	Low	102 Å²	102	136.5 Å²	136.5	63%	0.626	66%	0.663	S	S	*	*			trans	-96.9	113.7	-179.1	47.3	0	0	0	0	109.9	F894 Y898	F894-T896 HydrophobicContact CB-CG2 4.35Å; F894-T896 PolarHBondContact O-N 3.45Å; F894-T896 PolarHBondContact O-OG1 3.4Å; T896-Y898 PolarHBondContact O-N 3.32Å
897	Y	49.4	Very low	52.2	Low	232 Å²	232	134.3 Å²	134.3	91%	0.91	66%	0.658	S	S	*	*			trans	-65	70.5	171.4	-86.8	-104.2	0	0	0	111.6
898	Y	49.7	Very low	53.2	Low	207 Å²	207	136.9 Å²	136.9	81%	0.812	67%	0.668	S	S	*	*			trans	-138.8	122.2	170.5	-99.8	-82.9	0	0	0	112.5	T896	T896-Y898 PolarHBondContact O-N 3.32Å
899	S	44.2	Very low	54.4	Low	95 Å²	95	135.7 Å²	135.7	66%	0.664	66%	0.66	S	S	*	*			trans	24.4	125.4	157.1	-54.7	0	0	0	0	119	L901	S899-L901 PolarHBondContact O-N 3.26Å
900	P	42.8	Very low	55.7	Low	127 Å²	127	139.9 Å²	139.9	83%	0.825	67%	0.667	S	S	*	*			trans	-64.6	106.1	175.4	28.8	-33.7	0	0	0	110	K902	P900-K902 PolarHBondContact O-N 2.71Å
901	L	43.8	Very low	56.9	Low	152 Å²	152	138.2 Å²	138.2	80%	0.796	66%	0.659	S	S	*	*			trans	-49.8	115.4	160.1	-86.7	155.9	0	0	0	107.2	S899 I903	S899-L901 PolarHBondContact O-N 3.26Å; L901-I903 PolarHBondContact O-N 3.32Å
902	K	42.7	Very low	58.1	Low	198 Å²	198	135.2 Å²	135.2	86%	0.861	64%	0.644	S	S	*	*			trans	-63.5	79.5	172.8	-89.8	-177.7	170.3	178.6	0	109	P900 V904	P900-K902 PolarHBondContact O-N 2.71Å; K902-V904 PolarHBondContact O-N 2.96Å
903	I	48.5	Very low	59.6	Low	78 Å²	78	130.5 Å²	130.5	40%	0.4	63%	0.63	S	S	.	*			trans	-56	120.8	155	-61.6	171.6	0	0	0	104.5	L887 L901 F905	L887-I903 HydrophobicContact CD2-CD1 4.09Å; L901-I903 PolarHBondContact O-N 3.32Å; I903-F905 HydrophobicContact CB-CD2 4.03Å; I903-F905 HydrophobicContact CB-CE2 3.7Å; I903-F905 HydrophobicContact CB-CZ 4.35Å; I903-F905 HydrophobicContact CD1-CE2 4.36Å; I903-F905 HydrophobicContact CG2-CD2 3.97Å; I903-F905 HydrophobicContact CG2-CE1 4.39Å; I903-F905 HydrophobicContact CG2-CE2 3.67Å; I903-F905 HydrophobicContact CG2-CG 4.46Å; I903-F905 HydrophobicContact CG2-CZ 3.89Å; I903-F905 WeakPolarHBondContact O-CD2 3.37Å; I903-F905 PolarHBondContact O-N 3.07Å
904	V	44.5	Very low	61.1	Low	139 Å²	139	127 Å²	127	84%	0.842	63%	0.625	S	S	*	*			trans	-75.4	71	-178.6	-173.1	0	0	0	0	108.3	K902	K902-V904 PolarHBondContact O-N 2.96Å
905	F	51.9	Low	62.8	Low	120 Å²	120	127.6 Å²	127.6	53%	0.526	63%	0.63	S	S	.	*			trans	-56	140.6	159.6	-69.8	-73.8	0	0	0	107.9	E884 I903 I907	E884-F905 WeakPolarHBondContact OE1-CE1 3.49Å; E884-F905 WeakPolarHBondContact OE1-CZ 3.29Å; I903-F905 HydrophobicContact CB-CD2 4.03Å; I903-F905 HydrophobicContact CB-CE2 3.7Å; I903-F905 HydrophobicContact CB-CZ 4.35Å; I903-F905 HydrophobicContact CD1-CE2 4.36Å; I903-F905 HydrophobicContact CG2-CD2 3.97Å; I903-F905 HydrophobicContact CG2-CE1 4.39Å; I903-F905 HydrophobicContact CG2-CE2 3.67Å; I903-F905 HydrophobicContact CG2-CG 4.46Å; I903-F905 HydrophobicContact CG2-CZ 3.89Å; I903-F905 WeakPolarHBondContact O-CD2 3.37Å; I903-F905 PolarHBondContact O-N 3.07Å; F905-I907 VanDerWaalsContact C-N 3.3Å; F905-I907 PolarHBondContact O-N 3.44Å
906	N	59.6	Low	64.7	Low	144 Å²	144	124.6 Å²	124.6	77%	0.77	61%	0.614	S	S	*	*			trans	-59.6	99.8	167.2	-67.8	-73.6	0	0	0	107.2	Q908	N906-Q908 PolarHBondContact O-N 3.15Å
907	I	66.2	Low	66.8	Low	105 Å²	105	121.7 Å²	121.7	54%	0.538	60%	0.604	S	S	.	*			trans	-56.1	112.8	-177.4	-54.9	179.6	0	0	0	106.5	F905 D911 I912	F905-I907 VanDerWaalsContact C-N 3.3Å; F905-I907 PolarHBondContact O-N 3.44Å; I907-D911 HydrophobicContact CG2-CB 3.76Å; I907-I912 HydrophobicContact CG2-CD1 4.31Å; I907-I912 HydrophobicContact CG2-CG1 3.64Å
908	Q	79.5	Confident	68.7	Low	128 Å²	128	119 Å²	119	60%	0.598	61%	0.606	S	S	*	*			trans	-74.7	153.9	178.8	-56.3	-173.6	22.5	0	0	107.8	N906 R910 D911 I912	N906-Q908 PolarHBondContact O-N 3.15Å; Q908-R910 PolarHBondContact O-N 3.31Å; Q908-D911 WeakPolarHBondContact CB-OD2 3.32Å; Q908-D911 PolarHBondContact N-OD2 3.22Å; Q908-D911 WeakPolarHBondContact O-CA 3.36Å; Q908-D911 WeakPolarHBondContact O-CB 3.49Å; Q908-D911 PolarHBondContact O-N 2.87Å; Q908-I912 PolarHBondContact O-N 3.43Å
909	E	83.2	Confident	70.6	Confident	64 Å²	64	116 Å²	116	30%	0.299	60%	0.603	S	S	.	*	H	α-helix	trans	-59.6	-23.5	176.5	-150.1	72.4	-150.8	0	0	111.6	I912 E913 Y920 L922 K926	E909-I912 WeakPolarHBondContact O-CB 3.34Å; E909-I912 PolarHBondContact O-N 3.35Å; E909-E913 WeakPolarHBondContact O-CB 3.21Å; E909-E913 PolarHBondContact O-N 3.12Å; E909-Y920 WeakPolarHBondContact CG-OH 3.35Å; E909-L922 HydrophobicContact CG-CD1 4.29Å; E909-K926 IonicContact OE1-NZ 3.95Å; E909-K926 PolarHBondContact OE1-NZ 3.39Å; E909-K926 IonicContact OE2-NZ 2.62Å; E909-K926 PolarHBondContact OE2-NZ 2.99Å
910	R	84.6	Confident	72.9	Confident	169 Å²	169	113.8 Å²	113.8	64%	0.638	58%	0.581	S	S	*	*	H	α-helix	trans	-67.5	-32.5	169.8	-170	175	-171.7	-169.2	0.2	114	Q908 I912 L914	Q908-R910 PolarHBondContact O-N 3.31Å; R910-I912 VanDerWaalsContact C-N 3.32Å; R910-L914 HydrophobicContact CG-CD1 4.37Å; R910-L914 WeakPolarHBondContact O-CB 3.47Å; R910-L914 VanDerWaalsContact O-CG 3.23Å; R910-L914 WeakPolarHBondContact O-CG 3.37Å; R910-L914 PolarHBondContact O-N 2.8Å
911	D	85.1	Confident	75.1	Confident	59 Å²	59	113.6 Å²	113.6	32%	0.316	58%	0.578	S	S	.	*	H	α-helix	trans	-74.7	-29.3	175.4	-53.9	-42.9	0	0	0	110.5	I907 Q908 Q915	I907-D911 HydrophobicContact CG2-CB 3.76Å; Q908-D911 WeakPolarHBondContact CB-OD2 3.32Å; Q908-D911 PolarHBondContact N-OD2 3.22Å; Q908-D911 WeakPolarHBondContact O-CA 3.36Å; Q908-D911 WeakPolarHBondContact O-CB 3.49Å; Q908-D911 PolarHBondContact O-N 2.87Å; D911-Q915 WeakPolarHBondContact O-CB 3.19Å; D911-Q915 WeakPolarHBondContact O-CG 3.29Å; D911-Q915 PolarHBondContact O-N 3.32Å; D911-Q915 VanDerWaalsContact O-N 3.14Å; D911-Q915 PolarHBondContact O-NE2 3.24Å
912	I	85	Confident	77.2	Confident	38 Å²	38	111.3 Å²	111.3	20%	0.195	57%	0.566	C	S	.	*	H	α-helix	trans	-70.6	-47.4	171	-59.5	178.4	0	0	0	110.3	I907 Q908 E909 R910 L914 Q915 L916 Y920	I907-I912 HydrophobicContact CG2-CD1 4.31Å; I907-I912 HydrophobicContact CG2-CG1 3.64Å; Q908-I912 PolarHBondContact O-N 3.43Å; E909-I912 WeakPolarHBondContact O-CB 3.34Å; E909-I912 PolarHBondContact O-N 3.35Å; R910-I912 VanDerWaalsContact C-N 3.32Å; I912-L914 VanDerWaalsContact C-N 3.32Å; I912-L914 PolarHBondContact O-N 3.32Å; I912-Q915 PolarHBondContact O-N 3.4Å; I912-Q915 VanDerWaalsContact O-N 3.07Å; I912-L916 HydrophobicContact CG2-CD1 3.8Å; I912-L916 PolarHBondContact O-N 3.47Å; I912-Y920 HydrophobicContact CG2-CD2 4.28Å; I912-Y920 HydrophobicContact CG2-CE2 4.13Å
913	E	89	Confident	79.4	Confident	95 Å²	95	104.3 Å²	104.3	44%	0.444	54%	0.538	S	S	.	.	H	α-helix	trans	-53.6	-46.6	172.2	177.3	-174.6	-159	0	0	111.4	E909 Q915 G917 Y920	E909-E913 WeakPolarHBondContact O-CB 3.21Å; E909-E913 PolarHBondContact O-N 3.12Å; E913-Q915 VanDerWaalsContact C-N 3.32Å; E913-Q915 PolarHBondContact O-N 2.99Å; E913-G917 WeakPolarHBondContact O-CA 3.46Å; E913-G917 PolarHBondContact O-N 3.4Å; E913-Y920 HydrophobicContact CB-CD1 3.82Å; E913-Y920 HydrophobicContact CB-CE1 3.92Å; E913-Y920 HydrophobicContact CB-CG 4.2Å; E913-Y920 HydrophobicContact CG-CD1 3.77Å; E913-Y920 HydrophobicContact CG-CE1 4.09Å; E913-Y920 HydrophobicContact CG-CG 4.43Å
914	L	87.7	Confident	81.4	Confident	127 Å²	127	106.4 Å²	106.4	67%	0.665	55%	0.549	S	S	*	.	H	α-helix	trans	-69.9	-23.2	177	-72.9	170.2	0	0	0	114.2	R910 I912	R910-L914 HydrophobicContact CG-CD1 4.37Å; R910-L914 WeakPolarHBondContact O-CB 3.47Å; R910-L914 VanDerWaalsContact O-CG 3.23Å; R910-L914 WeakPolarHBondContact O-CG 3.37Å; R910-L914 PolarHBondContact O-N 2.8Å; I912-L914 VanDerWaalsContact C-N 3.32Å; I912-L914 PolarHBondContact O-N 3.32Å
915	Q	87.3	Confident	83.5	Confident	144 Å²	144	102.6 Å²	102.6	67%	0.673	52%	0.521	S	S	*	.	H	α-helix	trans	-84.3	-37.7	176.8	-79.9	168.8	47.7	0	0	112.8	D911 I912 E913	D911-Q915 WeakPolarHBondContact O-CB 3.19Å; D911-Q915 WeakPolarHBondContact O-CG 3.29Å; D911-Q915 PolarHBondContact O-N 3.32Å; D911-Q915 VanDerWaalsContact O-N 3.14Å; D911-Q915 PolarHBondContact O-NE2 3.24Å; I912-Q915 PolarHBondContact O-N 3.4Å; I912-Q915 VanDerWaalsContact O-N 3.07Å; E913-Q915 VanDerWaalsContact C-N 3.32Å; E913-Q915 PolarHBondContact O-N 2.99Å
916	L	89	Confident	85	Confident	93 Å²	93	100.6 Å²	100.6	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-88.4	-21.6	179.8	-70.8	172.3	0	0	0	112.9	I912 D918 D919 Y920	I912-L916 HydrophobicContact CG2-CD1 3.8Å; I912-L916 PolarHBondContact O-N 3.47Å; L916-D918 PolarHBondContact O-N 3.29Å; L916-D919 PolarHBondContact O-N 3.21Å; L916-Y920 HydrophobicContact CB-CD2 4.49Å; L916-Y920 HydrophobicContact CD1-CD2 4Å
917	G	88.6	Confident	86.1	Confident	42 Å²	42	99.8 Å²	99.8	43%	0.433	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	61.1	-127.7	176.4	0	0	0	0	0	112.1	E913 D919 Y920	E913-G917 WeakPolarHBondContact O-CA 3.46Å; E913-G917 PolarHBondContact O-N 3.4Å; G917-D919 VanDerWaalsContact C-N 3.28Å; G917-D919 PolarHBondContact O-N 3.45Å; G917-Y920 VanDerWaalsContact O-CB 3.27Å; G917-Y920 WeakPolarHBondContact O-CB 3.46Å; G917-Y920 PolarHBondContact O-N 3.44Å
918	D	89.1	Confident	87.2	Confident	176 Å²	176	100.4 Å²	100.4	94%	0.941	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-70.8	-20.3	-178.3	-65.5	-28.8	0	0	0	113.3	L916 Y920	L916-D918 PolarHBondContact O-N 3.29Å; D918-Y920 PolarHBondContact O-N 3.06Å
919	D	90.8	Very high	87.7	Confident	142 Å²	142	103 Å²	103	76%	0.759	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-77.7	-4.7	175.3	-69.3	-29.7	0	0	0	112.6	L916 G917 T921	L916-D919 PolarHBondContact O-N 3.21Å; G917-D919 VanDerWaalsContact C-N 3.28Å; G917-D919 PolarHBondContact O-N 3.45Å; D919-T921 PolarHBondContact O-N 2.86Å
920	Y	91.9	Very high	87.9	Confident	49 Å²	49	104.4 Å²	104.4	19%	0.192	53%	0.53	C	S	.	.			trans	-73.1	112.8	-178.4	177.9	-112.9	0	0	0	112.8	E909 I912 E913 L916 G917 D918 L922	E909-Y920 WeakPolarHBondContact CG-OH 3.35Å; I912-Y920 HydrophobicContact CG2-CD2 4.28Å; I912-Y920 HydrophobicContact CG2-CE2 4.13Å; E913-Y920 HydrophobicContact CB-CD1 3.82Å; E913-Y920 HydrophobicContact CB-CE1 3.92Å; E913-Y920 HydrophobicContact CB-CG 4.2Å; E913-Y920 HydrophobicContact CG-CD1 3.77Å; E913-Y920 HydrophobicContact CG-CE1 4.09Å; E913-Y920 HydrophobicContact CG-CG 4.43Å; L916-Y920 HydrophobicContact CB-CD2 4.49Å; L916-Y920 HydrophobicContact CD1-CD2 4Å; G917-Y920 VanDerWaalsContact O-CB 3.27Å; G917-Y920 WeakPolarHBondContact O-CB 3.46Å; G917-Y920 PolarHBondContact O-N 3.44Å; D918-Y920 PolarHBondContact O-N 3.06Å; Y920-L922 HydrophobicContact CE1-CB 4.26Å; Y920-L922 VanDerWaalsContact OH-CD1 3.23Å; Y920-L922 WeakPolarHBondContact OH-CD1 3.37Å
921	T	88.3	Confident	88	Confident	123 Å²	123	104.8 Å²	104.8	76%	0.755	53%	0.532	S	S	*	.			trans	-110	122.2	163.5	59	0	0	0	0	110.6	D919 D923	D919-T921 PolarHBondContact O-N 2.86Å; T921-D923 PolarHBondContact O-N 3.19Å
922	L	89.8	Confident	87.9	Confident	105 Å²	105	109.4 Å²	109.4	55%	0.55	55%	0.551	S	S	.	*			trans	-63.4	104.3	174.1	174	66.8	0	0	0	110.5	E909 Y920 L924	E909-L922 HydrophobicContact CG-CD1 4.29Å; Y920-L922 HydrophobicContact CE1-CB 4.26Å; Y920-L922 VanDerWaalsContact OH-CD1 3.23Å; Y920-L922 WeakPolarHBondContact OH-CD1 3.37Å; L922-L924 HydrophobicContact CD2-CD2 3.92Å; L922-L924 HydrophobicContact CG-CD2 4.08Å; L922-L924 PolarHBondContact O-N 3.38Å
923	D	88.8	Confident	88	Confident	50 Å²	50	116 Å²	116	27%	0.267	58%	0.581	S	S	.	*			trans	-80.2	110.2	173.2	178.3	21.3	0	0	0	111.3	T921 K925 K926 Y936	T921-D923 PolarHBondContact O-N 3.19Å; D923-K925 VanDerWaalsContact C-N 3.3Å; D923-K925 WeakPolarHBondContact OD1-CB 3.23Å; D923-K925 PolarHBondContact OD1-N 3.49Å; D923-K926 HydrophobicContact CB-CB 4.25Å; D923-K926 WeakPolarHBondContact OD2-CA 3.29Å; D923-K926 WeakPolarHBondContact OD2-CB 3.47Å; D923-K926 PolarHBondContact OD2-N 2.93Å; D923-Y936 VanDerWaalsContact OD2-CE1 3.31Å; D923-Y936 WeakPolarHBondContact OD2-CE1 3.44Å; D923-Y936 PolarHBondContact OD2-OH 3.23Å
924	L	90	Very high	88	Confident	122 Å²	122	114.9 Å²	114.9	64%	0.639	58%	0.576	S	S	*	*	S	Bend	trans	-72.6	-21.2	177.3	-60	178.1	0	0	0	113.1	L922 Y928	L922-L924 HydrophobicContact CD2-CD2 3.92Å; L922-L924 HydrophobicContact CG-CD2 4.08Å; L922-L924 PolarHBondContact O-N 3.38Å; L924-Y928 WeakPolarHBondContact O-CE1 3.39Å
925	K	88.2	Confident	88	Confident	59 Å²	59	110.6 Å²	110.6	26%	0.257	55%	0.552	S	S	.	*	S	Bend	trans	-85.8	-30.8	-175.3	-64.9	177.3	157.5	-136.6	0	113.1	D923 N927 Y928 K935 Y936 D937	D923-K925 VanDerWaalsContact C-N 3.3Å; D923-K925 WeakPolarHBondContact OD1-CB 3.23Å; D923-K925 PolarHBondContact OD1-N 3.49Å; K925-N927 PolarHBondContact O-N 3.46Å; K925-Y928 HydrophobicContact CB-CD2 4.49Å; K925-Y928 HydrophobicContact CG-CE2 4.2Å; K925-Y928 WeakPolarHBondContact O-CB 3.49Å; K925-Y928 PolarHBondContact O-N 2.89Å; K925-K935 WeakPolarHBondContact CD-O 3.42Å; K925-K935 PolarHBondContact NZ-O 2.89Å; K925-Y936 HydrophobicContact CB-CD1 4.36Å; K925-Y936 HydrophobicContact CB-CE1 4.16Å; K925-Y936 HydrophobicContact CD-CD1 4.03Å; K925-Y936 PolarHBondContact NZ-O 2.88Å; K925-D937 PolarHBondContact NZ-O 2.84Å
926	K	83.6	Confident	88.2	Confident	79 Å²	79	110 Å²	110	34%	0.343	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-32.2	-46.1	176.1	-171.8	176.8	173.4	-173.2	0	115.2	E909 D923	E909-K926 IonicContact OE1-NZ 3.95Å; E909-K926 PolarHBondContact OE1-NZ 3.39Å; E909-K926 IonicContact OE2-NZ 2.62Å; E909-K926 PolarHBondContact OE2-NZ 2.99Å; D923-K926 HydrophobicContact CB-CB 4.25Å; D923-K926 WeakPolarHBondContact OD2-CA 3.29Å; D923-K926 WeakPolarHBondContact OD2-CB 3.47Å; D923-K926 PolarHBondContact OD2-N 2.93Å
927	N	83	Confident	88.2	Confident	126 Å²	126	110.5 Å²	110.5	67%	0.674	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	12.1	-171.7	-64.8	-28.4	0	0	0	114.6	K925	K925-N927 PolarHBondContact O-N 3.46Å
928	Y	89.4	Confident	88.3	Confident	119 Å²	119	118 Å²	118	47%	0.467	57%	0.568	S	S	.	*			trans	-72.3	143.9	176.5	-71	-0.1	0	0	0	111.9	L924 K925 L930 K935	L924-Y928 WeakPolarHBondContact O-CE1 3.39Å; K925-Y928 HydrophobicContact CB-CD2 4.49Å; K925-Y928 HydrophobicContact CG-CE2 4.2Å; K925-Y928 WeakPolarHBondContact O-CB 3.49Å; K925-Y928 PolarHBondContact O-N 2.89Å; Y928-L930 VanDerWaalsContact C-N 3.26Å; Y928-L930 HydrophobicContact CD2-CD1 4.4Å; Y928-L930 PolarHBondContact O-N 3.43Å; Y928-L930 VanDerWaalsContact O-N 3.14Å; Y928-K935 VanDerWaalsContact O-CE 3.29Å; Y928-K935 WeakPolarHBondContact O-CE 3.43Å
929	L	89.4	Confident	88.3	Confident	181 Å²	181	115.9 Å²	115.9	95%	0.948	56%	0.556	S	S	*	*	S	Bend	trans	-88.3	58.1	178.4	-61.3	176.6	0	0	0	111.1
930	L	88.2	Confident	88.3	Confident	95 Å²	95	113.1 Å²	113.1	50%	0.497	55%	0.545	S	S	.	.	S	Bend	trans	-118.4	168.2	176.1	-64.4	173	0	0	0	110.2	Y928 K935	Y928-L930 VanDerWaalsContact C-N 3.26Å; Y928-L930 HydrophobicContact CD2-CD1 4.4Å; Y928-L930 PolarHBondContact O-N 3.43Å; Y928-L930 VanDerWaalsContact O-N 3.14Å; L930-K935 HydrophobicContact CB-CG 4.09Å; L930-K935 VanDerWaalsContact O-CE 3.27Å; L930-K935 WeakPolarHBondContact O-CE 3.48Å
931	R	86.2	Confident	88.2	Confident	177 Å²	177	117.6 Å²	117.6	67%	0.668	57%	0.568	S	S	*	*			trans	-59.3	144.9	169.8	-59.6	-171.5	-176.1	132.7	-10.8	109.5	E933 E934 K935	R931-E933 VanDerWaalsContact C-N 3.26Å; R931-E933 PolarHBondContact O-N 3.39Å; R931-E934 HydrophobicContact CB-CB 4.38Å; R931-E934 HydrophobicContact CB-CG 4.14Å; R931-E934 WeakPolarHBondContact CD-OE1 3.22Å; R931-E934 IonicContact CZ-OE1 2.67Å; R931-E934 IonicContact NE-OE1 2.61Å; R931-E934 IonicContact NH1-OE1 2.89Å; R931-E934 PolarHBondContact NH1-OE1 3.4Å; R931-E934 PolarHBondContact O-N 2.9Å; R931-E934 VanDerWaalsContact O-N 3.07Å; R931-K935 WeakPolarHBondContact O-CG 3.19Å; R931-K935 PolarHBondContact O-N 2.94Å; R931-K935 VanDerWaalsContact O-N 3.13Å
932	E	82.8	Confident	88.4	Confident	155 Å²	155	117 Å²	117	72%	0.724	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-33.4	-169.9	-56	-154.7	128	0	0	113.4	K935	E932-K935 IonicContact OE1-NZ 2.85Å
933	E	87	Confident	88.4	Confident	176 Å²	176	120 Å²	120	82%	0.822	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-45.6	173.2	-62.8	170.2	-170.9	0	0	111.6	R931	R931-E933 VanDerWaalsContact C-N 3.26Å; R931-E933 PolarHBondContact O-N 3.39Å
934	E	88.3	Confident	88.5	Confident	72 Å²	72	125.1 Å²	125.1	34%	0.336	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-77.5	-20.3	-174.5	-62.2	166.1	-178.3	0	0	113.4	R931 Y936 D937	R931-E934 HydrophobicContact CB-CB 4.38Å; R931-E934 HydrophobicContact CB-CG 4.14Å; R931-E934 WeakPolarHBondContact CD-OE1 3.22Å; R931-E934 IonicContact CZ-OE1 2.67Å; R931-E934 IonicContact NE-OE1 2.61Å; R931-E934 IonicContact NH1-OE1 2.89Å; R931-E934 PolarHBondContact NH1-OE1 3.4Å; R931-E934 PolarHBondContact O-N 2.9Å; R931-E934 VanDerWaalsContact O-N 3.07Å; E934-Y936 PolarHBondContact O-N 3.05Å; E934-Y936 VanDerWaalsContact O-N 3.12Å; E934-D937 PolarHBondContact O-N 3.38Å
935	K	89	Confident	88.5	Confident	37 Å²	37	122.7 Å²	122.7	16%	0.161	59%	0.591	C	S	.	*	G	3₁₀ helix	trans	-54.2	-37	-174.6	-79.9	176.5	-170.3	175.9	0	113.4	K925 Y928 L930 R931 E932	K925-K935 WeakPolarHBondContact CD-O 3.42Å; K925-K935 PolarHBondContact NZ-O 2.89Å; Y928-K935 VanDerWaalsContact O-CE 3.29Å; Y928-K935 WeakPolarHBondContact O-CE 3.43Å; L930-K935 HydrophobicContact CB-CG 4.09Å; L930-K935 VanDerWaalsContact O-CE 3.27Å; L930-K935 WeakPolarHBondContact O-CE 3.48Å; R931-K935 WeakPolarHBondContact O-CG 3.19Å; R931-K935 PolarHBondContact O-N 2.94Å; R931-K935 VanDerWaalsContact O-N 3.13Å; E932-K935 IonicContact OE1-NZ 2.85Å
936	Y	90.6	Very high	88.6	Confident	132 Å²	132	125.4 Å²	125.4	52%	0.518	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-94.9	-3.9	-173.5	-68.8	-77.4	0	0	0	114.7	D923 K925 E934	D923-Y936 VanDerWaalsContact OD2-CE1 3.31Å; D923-Y936 WeakPolarHBondContact OD2-CE1 3.44Å; D923-Y936 PolarHBondContact OD2-OH 3.23Å; K925-Y936 HydrophobicContact CB-CD1 4.36Å; K925-Y936 HydrophobicContact CB-CE1 4.16Å; K925-Y936 HydrophobicContact CD-CD1 4.03Å; K925-Y936 PolarHBondContact NZ-O 2.88Å; E934-Y936 PolarHBondContact O-N 3.05Å; E934-Y936 VanDerWaalsContact O-N 3.12Å
937	D	90.2	Very high	89	Confident	103 Å²	103	125.2 Å²	125.2	55%	0.551	61%	0.607	S	S	*	*			trans	-60	152	-178.3	-75.2	-24.3	0	0	0	114.1	K925 E934	K925-D937 PolarHBondContact NZ-O 2.84Å; E934-D937 PolarHBondContact O-N 3.38Å
938	K	88.9	Confident	89.4	Confident	199 Å²	199	121.4 Å²	121.4	87%	0.865	59%	0.586	S	S	*	*			trans	-98.1	102.8	177.9	-66.7	178.9	-176.7	173.9	0	108.7	P940	K938-P940 WeakPolarHBondContact O-CD 3.31Å
939	I	89.1	Confident	89.4	Confident	133 Å²	133	120.6 Å²	120.6	68%	0.682	59%	0.593	S	S	*	*			trans	-63.6	120.5	173.5	-56.1	174	0	0	0	107.9	E941	I939-E941 PolarHBondContact O-N 2.77Å
940	P	91	Very high	89.4	Confident	83 Å²	83	117.5 Å²	117.5	54%	0.539	58%	0.577	S	S	.	*			trans	-70.4	126.8	172	29.1	-32.1	0	0	0	109.1	K938 I948	K938-P940 WeakPolarHBondContact O-CD 3.31Å; P940-I948 HydrophobicContact CB-CD1 3.74Å; P940-I948 HydrophobicContact CG-CD1 3.77Å; P940-I948 WeakPolarHBondContact O-CD1 3.38Å
941	E	90.2	Very high	89.5	Confident	144 Å²	144	118.9 Å²	118.9	67%	0.673	58%	0.58	S	S	*	*			trans	-90.1	-31.2	-176.4	-65.6	-176.8	163.1	0	0	112.9	I939 N947 I948	I939-E941 PolarHBondContact O-N 2.77Å; E941-N947 CarbonylContact O-C 3.49Å; E941-N947 WeakPolarHBondContact O-CA 3.43Å; E941-I948 PolarHBondContact O-N 3.23Å
942	I	92.6	Very high	89.6	Confident	110 Å²	110	117 Å²	117	56%	0.564	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-134.7	133.7	-170	-58.6	174.8	0	0	0	110.1	H946	I942-H946 CarbonylContact C-O 3.58Å; I942-H946 WeakPolarHBondContact CA-O 3.46Å; I942-H946 WeakPolarHBondContact CG2-O 3.43Å
943	W	90.6	Very high	89.8	Confident	167 Å²	167	112.7 Å²	112.7	63%	0.633	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.2	121.1	169.6	-175.6	-90.2	0	0	0	110	G945 H946 I948	W943-G945 PolarHBondContact O-N 2.93Å; W943-H946 PolarHBondContact N-O 3.49Å; W943-H946 PolarHBondContact O-N 2.86Å; W943-I948 HydrophobicContact CB-CD1 3.97Å; W943-I948 HydrophobicContact CB-CG1 3.92Å
944	E	90.9	Very high	89.9	Confident	158 Å²	158	110.8 Å²	110.8	74%	0.738	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.4	39.8	173.5	-63.4	-176	136.5	0	0	115.4	H946	E944-H946 PolarHBondContact O-ND1 2.97Å
945	G	88.8	Confident	90.1	Very high	72 Å²	72	109.9 Å²	109.9	74%	0.742	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	88.6	-2	178.6	0	0	0	0	0	115.5	W943	W943-G945 PolarHBondContact O-N 2.93Å
946	H	91.4	Very high	90	Very high	116 Å²	116	110.2 Å²	110.2	54%	0.537	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	149.2	174.9	-51.5	84.8	0	0	0	110.1	I942 W943 E944 F951	I942-H946 CarbonylContact C-O 3.58Å; I942-H946 WeakPolarHBondContact CA-O 3.46Å; I942-H946 WeakPolarHBondContact CG2-O 3.43Å; W943-H946 PolarHBondContact N-O 3.49Å; W943-H946 PolarHBondContact O-N 2.86Å; E944-H946 PolarHBondContact O-ND1 2.97Å; H946-F951 HydrophobicContact CB-CE2 3.98Å
947	N	91.1	Very high	89.9	Confident	75 Å²	75	110.3 Å²	110.3	40%	0.401	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.4	132.6	176.4	-39.1	-65.1	0	0	0	109.5	E941 V949 D950 F951	E941-N947 CarbonylContact O-C 3.49Å; E941-N947 WeakPolarHBondContact O-CA 3.43Å; N947-V949 PolarHBondContact O-N 3.08Å; N947-D950 WeakPolarHBondContact CB-OD2 3.42Å; N947-D950 PolarHBondContact ND2-OD2 3.25Å; N947-D950 WeakPolarHBondContact O-CB 3.42Å; N947-D950 PolarHBondContact O-N 2.99Å; N947-D950 VanDerWaalsContact O-N 3.1Å; N947-F951 WeakPolarHBondContact O-CD2 3.17Å
948	I	91.5	Very high	89.9	Confident	46 Å²	46	112 Å²	112	24%	0.236	58%	0.581	C	S	.	*	G	3₁₀ helix	trans	-67.2	-27.7	-179.2	-60	-175.1	0	0	0	111.1	P940 E941 W943 D950 F951 M952	P940-I948 HydrophobicContact CB-CD1 3.74Å; P940-I948 HydrophobicContact CG-CD1 3.77Å; P940-I948 WeakPolarHBondContact O-CD1 3.38Å; E941-I948 PolarHBondContact O-N 3.23Å; W943-I948 HydrophobicContact CB-CD1 3.97Å; W943-I948 HydrophobicContact CB-CG1 3.92Å; I948-D950 PolarHBondContact O-N 3.15Å; I948-F951 CarbonylContact O-C 3.56Å; I948-F951 WeakPolarHBondContact O-CA 3.48Å; I948-F951 PolarHBondContact O-N 2.92Å; I948-M952 WeakPolarHBondContact O-CG 3.42Å; I948-M952 PolarHBondContact O-N 2.92Å
949	V	89.6	Confident	90	Very high	102 Å²	102	107.4 Å²	107.4	62%	0.618	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-57.4	-33.6	173.4	-177.1	0	0	0	0	112.2	N947 F951 M952	N947-V949 PolarHBondContact O-N 3.08Å; V949-F951 PolarHBondContact O-N 3.1Å; V949-M952 PolarHBondContact O-N 3.24Å
950	D	90.3	Very high	90.2	Very high	116 Å²	116	105.2 Å²	105.2	62%	0.62	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-69.9	-14.9	178.8	-56.8	-31.1	0	0	0	112.1	N947 I948	N947-D950 WeakPolarHBondContact CB-OD2 3.42Å; N947-D950 PolarHBondContact ND2-OD2 3.25Å; N947-D950 WeakPolarHBondContact O-CB 3.42Å; N947-D950 PolarHBondContact O-N 2.99Å; N947-D950 VanDerWaalsContact O-N 3.1Å; I948-D950 PolarHBondContact O-N 3.15Å
951	F	89.3	Confident	90.2	Very high	124 Å²	124	107.5 Å²	107.5	54%	0.544	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-113.5	14.7	178.3	-60.5	-96.7	0	0	0	113	H946 N947 I948 V949 D953 N956	H946-F951 HydrophobicContact CB-CE2 3.98Å; N947-F951 WeakPolarHBondContact O-CD2 3.17Å; I948-F951 CarbonylContact O-C 3.56Å; I948-F951 WeakPolarHBondContact O-CA 3.48Å; I948-F951 PolarHBondContact O-N 2.92Å; V949-F951 PolarHBondContact O-N 3.1Å; F951-D953 PolarHBondContact O-N 2.83Å; F951-N956 PolarHBondContact O-ND2 2.63Å
952	M	87.9	Confident	90.3	Very high	138 Å²	138	103.2 Å²	103.2	68%	0.68	54%	0.541	S	S	*	.			trans	-89.9	88.5	178.7	-74.7	-98	-73.6	0	0	111.5	I948 V949	I948-M952 WeakPolarHBondContact O-CG 3.42Å; I948-M952 PolarHBondContact O-N 2.92Å; V949-M952 PolarHBondContact O-N 3.24Å
953	D	88	Confident	90.3	Very high	64 Å²	64	102.3 Å²	102.3	34%	0.342	54%	0.537	S	S	.	.			trans	-135.2	131.1	177.3	-174.8	-36.1	0	0	0	110.7	F951 T955 N956 K959	F951-D953 PolarHBondContact O-N 2.83Å; D953-T955 VanDerWaalsContact CG-OG1 3.26Å; D953-T955 PolarHBondContact O-N 3.03Å; D953-T955 VanDerWaalsContact O-N 3.13Å; D953-T955 WeakPolarHBondContact OD1-CB 3.32Å; D953-T955 PolarHBondContact OD1-N 3.46Å; D953-T955 PolarHBondContact OD1-OG1 2.65Å; D953-T955 PolarHBondContact OD2-OG1 3.27Å; D953-N956 WeakPolarHBondContact O-CB 3.29Å; D953-N956 PolarHBondContact O-N 3.43Å; D953-N956 VanDerWaalsContact O-N 3.15Å; D953-K959 VanDerWaalsContact CG-NZ 3.34Å; D953-K959 IonicContact OD2-NZ 3.47Å; D953-K959 PolarHBondContact OD2-NZ 3.07Å
954	P	88.9	Confident	90.4	Very high	136 Å²	136	98.5 Å²	98.5	88%	0.883	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.6	178.2	24.9	-35.8	0	0	0	114.5
955	T	91.3	Very high	90.5	Very high	53 Å²	53	97 Å²	97	33%	0.325	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	1.3	-179.5	62	0	0	0	0	114.1	D953 L957 E958 K959	D953-T955 VanDerWaalsContact CG-OG1 3.26Å; D953-T955 PolarHBondContact O-N 3.03Å; D953-T955 VanDerWaalsContact O-N 3.13Å; D953-T955 WeakPolarHBondContact OD1-CB 3.32Å; D953-T955 PolarHBondContact OD1-N 3.46Å; D953-T955 PolarHBondContact OD1-OG1 2.65Å; D953-T955 PolarHBondContact OD2-OG1 3.27Å; T955-L957 VanDerWaalsContact C-N 3.31Å; T955-L957 PolarHBondContact O-N 2.94Å; T955-E958 WeakPolarHBondContact O-CB 3.22Å; T955-E958 PolarHBondContact O-N 3.03Å; T955-K959 PolarHBondContact O-N 2.97Å; T955-K959 WeakPolarHBondContact OG1-CE 3.25Å
956	N	88	Confident	90.6	Very high	44 Å²	44	97.9 Å²	97.9	24%	0.235	50%	0.504	C	S	.	.	H	α-helix	trans	-59	-35.1	-172.5	-97.4	8.9	0	0	0	115.1	F951 D953 E958 K959 I960	F951-N956 PolarHBondContact O-ND2 2.63Å; D953-N956 WeakPolarHBondContact O-CB 3.29Å; D953-N956 PolarHBondContact O-N 3.43Å; D953-N956 VanDerWaalsContact O-N 3.15Å; N956-E958 PolarHBondContact O-N 2.74Å; N956-K959 PolarHBondContact O-N 3.34Å; N956-I960 VanDerWaalsContact O-CG1 3.29Å; N956-I960 WeakPolarHBondContact O-CG1 3.41Å; N956-I960 PolarHBondContact O-N 3.37Å
957	L	88.6	Confident	90.5	Very high	134 Å²	134	96.6 Å²	96.6	70%	0.702	50%	0.498	S	S	*	.	H	α-helix	trans	-64.8	-29.2	177.9	-70.4	171.4	0	0	0	112.4	T955 K961	T955-L957 VanDerWaalsContact C-N 3.31Å; T955-L957 PolarHBondContact O-N 2.94Å; L957-K961 VanDerWaalsContact O-CG 3.3Å; L957-K961 WeakPolarHBondContact O-CG 3.38Å; L957-K961 PolarHBondContact O-N 3.43Å
958	E	90.7	Very high	90.5	Very high	138 Å²	138	98.1 Å²	98.1	65%	0.645	50%	0.501	S	S	*	.	H	α-helix	trans	-75.5	-42.6	174.7	-59.3	178.2	163.1	0	0	110.6	T955 N956 I960 K961 A962	T955-E958 WeakPolarHBondContact O-CB 3.22Å; T955-E958 PolarHBondContact O-N 3.03Å; N956-E958 PolarHBondContact O-N 2.74Å; E958-I960 VanDerWaalsContact C-N 3.35Å; E958-I960 PolarHBondContact O-N 3.33Å; E958-K961 PolarHBondContact O-N 2.82Å; E958-A962 WeakPolarHBondContact O-CB 3.42Å; E958-A962 PolarHBondContact O-N 3.43Å
959	K	90.3	Very high	90.5	Very high	102 Å²	102	101.7 Å²	101.7	44%	0.443	52%	0.52	S	S	.	.	H	α-helix	trans	-60.9	-41.9	174.9	-62.2	178.9	-168.8	163	0	112.3	D953 T955 N956 A962 L963	D953-K959 VanDerWaalsContact CG-NZ 3.34Å; D953-K959 IonicContact OD2-NZ 3.47Å; D953-K959 PolarHBondContact OD2-NZ 3.07Å; T955-K959 PolarHBondContact O-N 2.97Å; T955-K959 WeakPolarHBondContact OG1-CE 3.25Å; N956-K959 PolarHBondContact O-N 3.34Å; K959-A962 PolarHBondContact O-N 3.36Å; K959-L963 WeakPolarHBondContact O-CB 3.41Å; K959-L963 PolarHBondContact O-N 3.09Å
960	I	92	Very high	90.3	Very high	87 Å²	87	101.3 Å²	101.3	45%	0.446	51%	0.507	S	S	.	.	H	α-helix	trans	-64.4	-46.3	176.9	-69.4	165.4	0	0	0	110.1	N956 E958 A962 L963 E964	N956-I960 VanDerWaalsContact O-CG1 3.29Å; N956-I960 WeakPolarHBondContact O-CG1 3.41Å; N956-I960 PolarHBondContact O-N 3.37Å; E958-I960 VanDerWaalsContact C-N 3.35Å; E958-I960 PolarHBondContact O-N 3.33Å; I960-A962 PolarHBondContact O-N 2.87Å; I960-L963 PolarHBondContact O-N 3.06Å; I960-L963 VanDerWaalsContact O-N 3.16Å; I960-E964 HydrophobicContact CG2-CG 4.4Å; I960-E964 WeakPolarHBondContact O-CG 3.39Å; I960-E964 PolarHBondContact O-N 3Å
961	K	92.5	Very high	90.2	Very high	131 Å²	131	102.5 Å²	102.5	57%	0.57	51%	0.509	S	S	*	.	H	α-helix	trans	-58.9	-44.6	175.6	-75.8	173.9	-179.7	-178.4	0	112.7	L957 E958 L963 E964 E965	L957-K961 VanDerWaalsContact O-CG 3.3Å; L957-K961 WeakPolarHBondContact O-CG 3.38Å; L957-K961 PolarHBondContact O-N 3.43Å; E958-K961 PolarHBondContact O-N 2.82Å; K961-L963 VanDerWaalsContact C-N 3.3Å; K961-L963 PolarHBondContact O-N 3.03Å; K961-E964 PolarHBondContact O-N 2.87Å; K961-E965 WeakPolarHBondContact O-CB 3.41Å; K961-E965 WeakPolarHBondContact O-CG 3.49Å; K961-E965 PolarHBondContact O-N 3.12Å
962	A	92.8	Very high	90.1	Very high	55 Å²	55	105.2 Å²	105.2	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-37.6	176.6	0	0	0	0	0	112.1	E958 K959 I960 E965 E966	E958-A962 WeakPolarHBondContact O-CB 3.42Å; E958-A962 PolarHBondContact O-N 3.43Å; K959-A962 PolarHBondContact O-N 3.36Å; I960-A962 PolarHBondContact O-N 2.87Å; A962-E965 PolarHBondContact O-N 3.11Å; A962-E966 WeakPolarHBondContact O-CB 3.25Å; A962-E966 PolarHBondContact O-N 3.28Å
963	L	91.6	Very high	90.1	Very high	90 Å²	90	102.5 Å²	102.5	47%	0.471	52%	0.52	S	S	.	.	H	α-helix	trans	-71	-40.6	176.8	-163.3	154.4	0	0	0	111.6	K959 I960 K961 E965 E966 E967	K959-L963 WeakPolarHBondContact O-CB 3.41Å; K959-L963 PolarHBondContact O-N 3.09Å; I960-L963 PolarHBondContact O-N 3.06Å; I960-L963 VanDerWaalsContact O-N 3.16Å; K961-L963 VanDerWaalsContact C-N 3.3Å; K961-L963 PolarHBondContact O-N 3.03Å; L963-E965 VanDerWaalsContact C-N 3.32Å; L963-E965 PolarHBondContact O-N 3.42Å; L963-E966 PolarHBondContact O-N 3.11Å; L963-E967 HydrophobicContact CD2-CG 4.1Å; L963-E967 PolarHBondContact O-N 3.48Å
964	E	92.1	Very high	89.7	Confident	87 Å²	87	100.7 Å²	100.7	41%	0.407	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-35.9	171.8	-74	-178.4	-158.7	0	0	112.6	I960 K961 K968	I960-E964 HydrophobicContact CG2-CG 4.4Å; I960-E964 WeakPolarHBondContact O-CG 3.39Å; I960-E964 PolarHBondContact O-N 3Å; K961-E964 PolarHBondContact O-N 2.87Å; E964-K968 WeakPolarHBondContact O-CB 3.42Å; E964-K968 VanDerWaalsContact O-CD 3.31Å; E964-K968 WeakPolarHBondContact O-CD 3.45Å; E964-K968 WeakPolarHBondContact O-CG 3.36Å; E964-K968 PolarHBondContact O-N 3.03Å; E964-K968 IonicContact OE2-NZ 3.37Å; E964-K968 PolarHBondContact OE2-NZ 3.07Å
965	E	93.2	Very high	89.3	Confident	127 Å²	127	101.3 Å²	101.3	59%	0.593	51%	0.506	S	S	*	.	H	α-helix	trans	-68.6	-39.9	173.4	-75.3	175.2	-173.5	0	0	111.3	K961 A962 L963 K968 L969	K961-E965 WeakPolarHBondContact O-CB 3.41Å; K961-E965 WeakPolarHBondContact O-CG 3.49Å; K961-E965 PolarHBondContact O-N 3.12Å; A962-E965 PolarHBondContact O-N 3.11Å; L963-E965 VanDerWaalsContact C-N 3.32Å; L963-E965 PolarHBondContact O-N 3.42Å; E965-K968 PolarHBondContact O-N 3.15Å; E965-L969 WeakPolarHBondContact O-CG 3.43Å; E965-L969 PolarHBondContact O-N 3.42Å; E965-L969 VanDerWaalsContact O-N 3.09Å
966	E	91.2	Very high	88.8	Confident	90 Å²	90	104.4 Å²	104.4	42%	0.421	51%	0.513	S	S	.	.	H	α-helix	trans	-64.2	-42.7	173.4	-170.9	179.6	-175.1	0	0	112.3	A962 L963 L969 R970	A962-E966 WeakPolarHBondContact O-CB 3.25Å; A962-E966 PolarHBondContact O-N 3.28Å; L963-E966 PolarHBondContact O-N 3.11Å; E966-L969 WeakPolarHBondContact O-CB 3.33Å; E966-L969 PolarHBondContact O-N 3.38Å; E966-R970 WeakPolarHBondContact O-CG 3.45Å; E966-R970 PolarHBondContact O-N 3.23Å; E966-R970 IonicContact OE1-CZ 3.29Å; E966-R970 VanDerWaalsContact OE1-CZ 3.29Å; E966-R970 IonicContact OE1-NE 3.69Å; E966-R970 IonicContact OE1-NH2 2.62Å; E966-R970 PolarHBondContact OE1-NH2 3.45Å; E966-R970 IonicContact OE2-NH2 3.97Å
967	E	89.6	Confident	88.2	Confident	90 Å²	90	108 Å²	108	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-44.3	175.6	-75.6	-172.9	159.2	0	0	111.9	L963 L969 R970 E971	L963-E967 HydrophobicContact CD2-CG 4.1Å; L963-E967 PolarHBondContact O-N 3.48Å; E967-L969 PolarHBondContact O-N 3.48Å; E967-R970 PolarHBondContact O-N 2.87Å; E967-R970 VanDerWaalsContact O-N 3.08Å; E967-E971 WeakPolarHBondContact O-CB 3.48Å; E967-E971 PolarHBondContact O-N 3.47Å
968	K	90.9	Very high	87.3	Confident	106 Å²	106	106.6 Å²	106.6	46%	0.461	53%	0.533	S	S	.	.	H	α-helix	trans	-60.4	-28	173.8	-73.9	162.8	-169.4	146.4	0	113	E964 E965 K972	E964-K968 WeakPolarHBondContact O-CB 3.42Å; E964-K968 VanDerWaalsContact O-CD 3.31Å; E964-K968 WeakPolarHBondContact O-CD 3.45Å; E964-K968 WeakPolarHBondContact O-CG 3.36Å; E964-K968 PolarHBondContact O-N 3.03Å; E964-K968 IonicContact OE2-NZ 3.37Å; E964-K968 PolarHBondContact OE2-NZ 3.07Å; E965-K968 PolarHBondContact O-N 3.15Å; K968-K972 WeakPolarHBondContact O-CD 3.37Å; K968-K972 VanDerWaalsContact O-CG 3.26Å; K968-K972 WeakPolarHBondContact O-CG 3.21Å; K968-K972 PolarHBondContact O-N 3.16Å
969	L	90.9	Very high	85.7	Confident	122 Å²	122	107.2 Å²	107.2	64%	0.639	54%	0.541	S	S	*	.	H	α-helix	trans	-77	-40.9	172.8	-73.6	167.3	0	0	0	111.9	E965 E966 E967 A973	E965-L969 WeakPolarHBondContact O-CG 3.43Å; E965-L969 PolarHBondContact O-N 3.42Å; E965-L969 VanDerWaalsContact O-N 3.09Å; E966-L969 WeakPolarHBondContact O-CB 3.33Å; E966-L969 PolarHBondContact O-N 3.38Å; E967-L969 PolarHBondContact O-N 3.48Å; L969-A973 WeakPolarHBondContact O-CB 3.38Å; L969-A973 PolarHBondContact O-N 2.8Å; L969-A973 VanDerWaalsContact O-N 3.13Å
970	R	86.4	Confident	84.1	Confident	93 Å²	93	110.7 Å²	110.7	35%	0.351	56%	0.561	S	S	.	*	H	α-helix	trans	-65.9	-41.1	176.8	-73.8	177.3	-179.2	160.6	0.8	113	E966 E967 A973 G974 F975 Y976	E966-R970 WeakPolarHBondContact O-CG 3.45Å; E966-R970 PolarHBondContact O-N 3.23Å; E966-R970 IonicContact OE1-CZ 3.29Å; E966-R970 VanDerWaalsContact OE1-CZ 3.29Å; E966-R970 IonicContact OE1-NE 3.69Å; E966-R970 IonicContact OE1-NH2 2.62Å; E966-R970 PolarHBondContact OE1-NH2 3.45Å; E966-R970 IonicContact OE2-NH2 3.97Å; E967-R970 PolarHBondContact O-N 2.87Å; E967-R970 VanDerWaalsContact O-N 3.08Å; R970-A973 PolarHBondContact O-N 3.42Å; R970-A973 VanDerWaalsContact O-N 3.16Å; R970-G974 PolarHBondContact O-N 3.3Å; R970-F975 HydrophobicContact CB-CB 4.14Å; R970-F975 WeakPolarHBondContact O-CB 3.47Å; R970-F975 PolarHBondContact O-N 2.94Å; R970-F975 VanDerWaalsContact O-N 3.12Å; R970-Y976 HydrophobicContact CB-CE2 3.86Å
971	E	87.3	Confident	82.5	Confident	142 Å²	142	115.4 Å²	115.4	66%	0.664	58%	0.581	S	S	*	*	H	α-helix	trans	-64.3	-45.3	177.4	-167.5	177	-146.7	0	0	110.9	E967 A973 G974	E967-E971 WeakPolarHBondContact O-CB 3.48Å; E967-E971 PolarHBondContact O-N 3.47Å; E971-A973 PolarHBondContact O-N 3.08Å; E971-G974 PolarHBondContact O-N 3.19Å; E971-G974 VanDerWaalsContact O-N 3.09Å
972	K	88.4	Confident	80.8	Confident	181 Å²	181	115.7 Å²	115.7	79%	0.787	59%	0.593	S	S	*	*	H	α-helix	trans	-63.4	-20.5	172.2	-74.5	176.6	-176.9	177.9	0	114.6	K968	K968-K972 WeakPolarHBondContact O-CD 3.37Å; K968-K972 VanDerWaalsContact O-CG 3.26Å; K968-K972 WeakPolarHBondContact O-CG 3.21Å; K968-K972 PolarHBondContact O-N 3.16Å
973	A	87.4	Confident	79.1	Confident	80 Å²	80	117.9 Å²	117.9	66%	0.661	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	1.2	177	0	0	0	0	0	113.4	L969 R970 E971 F975	L969-A973 WeakPolarHBondContact O-CB 3.38Å; L969-A973 PolarHBondContact O-N 2.8Å; L969-A973 VanDerWaalsContact O-N 3.13Å; R970-A973 PolarHBondContact O-N 3.42Å; R970-A973 VanDerWaalsContact O-N 3.16Å; E971-A973 PolarHBondContact O-N 3.08Å; A973-F975 VanDerWaalsContact C-N 3.29Å; A973-F975 PolarHBondContact O-N 3.18Å
974	G	80.6	Confident	78.3	Confident	27 Å²	27	119 Å²	119	28%	0.278	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	70.6	19.5	-178.4	0	0	0	0	0	114.4	R970 E971 Y976 D977	R970-G974 PolarHBondContact O-N 3.3Å; E971-G974 PolarHBondContact O-N 3.19Å; E971-G974 VanDerWaalsContact O-N 3.09Å; G974-Y976 PolarHBondContact O-N 3.28Å; G974-Y976 VanDerWaalsContact O-N 3.11Å; G974-D977 WeakPolarHBondContact CA-OD2 3.32Å; G974-D977 PolarHBondContact O-N 3.5Å; G974-D977 VanDerWaalsContact O-N 3.13Å
975	F	79.5	Confident	77.6	Confident	148 Å²	148	123.4 Å²	123.4	65%	0.649	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-20.8	-175.2	-173.5	-95.4	0	0	0	113.9	R970 A973	R970-F975 HydrophobicContact CB-CB 4.14Å; R970-F975 WeakPolarHBondContact O-CB 3.47Å; R970-F975 PolarHBondContact O-N 2.94Å; R970-F975 VanDerWaalsContact O-N 3.12Å; A973-F975 VanDerWaalsContact C-N 3.29Å; A973-F975 PolarHBondContact O-N 3.18Å
976	Y	79.9	Confident	76.8	Confident	119 Å²	119	124.9 Å²	124.9	47%	0.467	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.2	-2.4	-179.9	-57.9	-74.4	0	0	0	113.5	R970 G974 S978	R970-Y976 HydrophobicContact CB-CE2 3.86Å; G974-Y976 PolarHBondContact O-N 3.28Å; G974-Y976 VanDerWaalsContact O-N 3.11Å; Y976-S978 PolarHBondContact O-N 3Å
977	D	76.2	Confident	76	Confident	120 Å²	120	123 Å²	123	64%	0.642	63%	0.626	S	S	*	*			trans	-73.5	118.3	177.8	-64.5	-32.3	0	0	0	108.9	G974	G974-D977 WeakPolarHBondContact CA-OD2 3.32Å; G974-D977 PolarHBondContact O-N 3.5Å; G974-D977 VanDerWaalsContact O-N 3.13Å
978	S	69.1	Low	75.6	Confident	104 Å²	104	119.9 Å²	119.9	73%	0.727	62%	0.615	S	S	*	*			trans	-109.3	66.4	-176.3	42	0	0	0	0	110.7	Y976 M980	Y976-S978 PolarHBondContact O-N 3Å; S978-M980 PolarHBondContact O-N 2.92Å
979	D	58.8	Low	75.2	Confident	151 Å²	151	120.3 Å²	120.3	81%	0.807	62%	0.619	S	S	*	*			trans	-66.2	102.8	175.2	-75.9	-19	0	0	0	110.5	E981	D979-E981 PolarHBondContact O-N 3.48Å; D979-E981 VanDerWaalsContact O-N 3.15Å
980	M	56.4	Low	74.8	Confident	175 Å²	175	119.7 Å²	119.7	86%	0.862	62%	0.616	S	S	*	*			trans	-77.2	90.4	175.8	-71.5	-84.7	-60.5	0	0	109.9	S978	S978-M980 PolarHBondContact O-N 2.92Å
981	E	57.9	Low	74.5	Confident	185 Å²	185	120.2 Å²	120.2	86%	0.864	63%	0.625	S	S	*	*			trans	-62.3	141.3	166.2	-70.2	-169.9	146.5	0	0	110.7	D979	D979-E981 PolarHBondContact O-N 3.48Å; D979-E981 VanDerWaalsContact O-N 3.15Å
982	V	57.5	Low	74.5	Confident	138 Å²	138	120.1 Å²	120.1	84%	0.836	62%	0.623	S	S	*	*			trans	-82.7	124	-169.1	177.4	0	0	0	0	110.2	D984	V982-D984 PolarHBondContact O-N 3.11Å
983	D	56.9	Low	74.4	Confident	100 Å²	100	116.6 Å²	116.6	54%	0.535	61%	0.609	S	S	.	*			trans	-46	130.9	177.7	-72.5	-40.7	0	0	0	112.5	A988	D983-A988 HydrophobicContact CB-CB 4.24Å
984	D	73.6	Confident	74.3	Confident	114 Å²	114	114.4 Å²	114.4	61%	0.61	59%	0.591	S	S	*	*			trans	-55.9	155.4	166.7	-30.2	-69.9	0	0	0	111	V982 E986 T987 A988	V982-D984 PolarHBondContact O-N 3.11Å; D984-E986 PolarHBondContact O-N 3.17Å; D984-T987 WeakPolarHBondContact CA-OG1 3.43Å; D984-T987 WeakPolarHBondContact CB-OG1 3.42Å; D984-T987 PolarHBondContact N-OG1 3.17Å; D984-T987 PolarHBondContact O-N 3.24Å; D984-T987 VanDerWaalsContact O-N 3.14Å; D984-T987 PolarHBondContact O-OG1 2.91Å; D984-T987 PolarHBondContact OD2-OG1 3.01Å; D984-T987 VanDerWaalsContact OD2-OG1 3.07Å; D984-A988 WeakPolarHBondContact O-CB 3.37Å; D984-A988 PolarHBondContact O-N 3.41Å
985	E	77.1	Confident	74.6	Confident	179 Å²	179	115.9 Å²	115.9	84%	0.836	60%	0.6	S	S	*	*	H	α-helix	trans	-57.1	-37.6	178.7	-95.5	-171.3	145.8	0	0	112.4	E989	E985-E989 WeakPolarHBondContact O-CB 3.41Å; E985-E989 WeakPolarHBondContact O-CG 3.47Å; E985-E989 PolarHBondContact O-N 3.28Å
986	E	77.9	Confident	75.1	Confident	159 Å²	159	114.5 Å²	114.5	74%	0.743	60%	0.599	S	S	*	*	H	α-helix	trans	-65.2	-42.7	176.5	-67.8	-162.7	146	0	0	113.1	D984 E989 L990	D984-E986 PolarHBondContact O-N 3.17Å; E986-E989 PolarHBondContact O-N 3.31Å; E986-L990 WeakPolarHBondContact O-CB 3.35Å; E986-L990 VanDerWaalsContact O-CG 3.32Å; E986-L990 WeakPolarHBondContact O-CG 3.41Å; E986-L990 PolarHBondContact O-N 3.16Å
987	T	74.9	Confident	75.4	Confident	50 Å²	50	113.5 Å²	113.5	31%	0.307	60%	0.601	S	S	.	*	H	α-helix	trans	-69.4	-40.9	179.4	26.7	0	0	0	0	111	D984 E989 L990 L991	D984-T987 WeakPolarHBondContact CA-OG1 3.43Å; D984-T987 WeakPolarHBondContact CB-OG1 3.42Å; D984-T987 PolarHBondContact N-OG1 3.17Å; D984-T987 PolarHBondContact O-N 3.24Å; D984-T987 VanDerWaalsContact O-N 3.14Å; D984-T987 PolarHBondContact O-OG1 2.91Å; D984-T987 PolarHBondContact OD2-OG1 3.01Å; D984-T987 VanDerWaalsContact OD2-OG1 3.07Å; T987-E989 VanDerWaalsContact C-N 3.35Å; T987-E989 PolarHBondContact O-N 3.44Å; T987-L990 PolarHBondContact O-N 2.96Å; T987-L991 WeakPolarHBondContact O-CG 3.19Å; T987-L991 PolarHBondContact O-N 3.43Å
988	A	79.5	Confident	75.9	Confident	24 Å²	24	116.5 Å²	116.5	20%	0.198	60%	0.603	C	S	.	*	H	α-helix	trans	-62.2	-38.5	172.1	0	0	0	0	0	112.5	D983 D984 K992	D983-A988 HydrophobicContact CB-CB 4.24Å; D984-A988 WeakPolarHBondContact O-CB 3.37Å; D984-A988 PolarHBondContact O-N 3.41Å; A988-K992 WeakPolarHBondContact O-CD 3.36Å; A988-K992 VanDerWaalsContact O-CG 3.24Å; A988-K992 WeakPolarHBondContact O-CG 3.32Å; A988-K992 PolarHBondContact O-N 3.16Å; A988-K992 VanDerWaalsContact O-N 3.12Å
989	E	83.9	Confident	76.8	Confident	116 Å²	116	118.6 Å²	118.6	54%	0.542	60%	0.599	S	S	.	*	H	α-helix	trans	-67.8	-45.5	173.2	-77.3	-153	153.1	0	0	112.8	E985 E986 T987 L991 K992 Q993	E985-E989 WeakPolarHBondContact O-CB 3.41Å; E985-E989 WeakPolarHBondContact O-CG 3.47Å; E985-E989 PolarHBondContact O-N 3.28Å; E986-E989 PolarHBondContact O-N 3.31Å; T987-E989 VanDerWaalsContact C-N 3.35Å; T987-E989 PolarHBondContact O-N 3.44Å; E989-L991 VanDerWaalsContact C-N 3.3Å; E989-L991 PolarHBondContact O-N 3.16Å; E989-K992 PolarHBondContact O-N 3.15Å; E989-K992 VanDerWaalsContact O-N 3.17Å; E989-Q993 WeakPolarHBondContact O-CG 3.39Å; E989-Q993 PolarHBondContact O-N 2.99Å
990	L	81.3	Confident	78.2	Confident	109 Å²	109	118.3 Å²	118.3	57%	0.571	59%	0.587	S	S	*	*	H	α-helix	trans	-58	-42	176.5	-78.2	165.5	0	0	0	111.7	E986 T987 Q993 A994	E986-L990 WeakPolarHBondContact O-CB 3.35Å; E986-L990 VanDerWaalsContact O-CG 3.32Å; E986-L990 WeakPolarHBondContact O-CG 3.41Å; E986-L990 PolarHBondContact O-N 3.16Å; T987-L990 PolarHBondContact O-N 2.96Å; L990-Q993 PolarHBondContact O-N 2.83Å; L990-A994 WeakPolarHBondContact O-CB 3.41Å; L990-A994 PolarHBondContact O-N 3.33Å
991	L	81.3	Confident	79.6	Confident	104 Å²	104	115.6 Å²	115.6	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-43.6	174.7	-77.5	171.9	0	0	0	112.4	T987 E989 Q993 A994 A995	T987-L991 WeakPolarHBondContact O-CG 3.19Å; T987-L991 PolarHBondContact O-N 3.43Å; E989-L991 VanDerWaalsContact C-N 3.3Å; E989-L991 PolarHBondContact O-N 3.16Å; L991-Q993 PolarHBondContact O-N 2.94Å; L991-A994 PolarHBondContact O-N 3.37Å; L991-A995 WeakPolarHBondContact O-CB 3.48Å; L991-A995 PolarHBondContact O-N 2.93Å
992	K	85.8	Confident	80.9	Confident	140 Å²	140	114 Å²	114	61%	0.609	57%	0.566	S	S	*	*	H	α-helix	trans	-59.9	-44.5	174.1	-73.2	163.7	-171.9	161	0	111.5	A988 E989 A995 L996	A988-K992 WeakPolarHBondContact O-CD 3.36Å; A988-K992 VanDerWaalsContact O-CG 3.24Å; A988-K992 WeakPolarHBondContact O-CG 3.32Å; A988-K992 PolarHBondContact O-N 3.16Å; A988-K992 VanDerWaalsContact O-N 3.12Å; E989-K992 PolarHBondContact O-N 3.15Å; E989-K992 VanDerWaalsContact O-N 3.17Å; K992-A995 PolarHBondContact O-N 3.41Å; K992-L996 WeakPolarHBondContact O-CG 3.45Å; K992-L996 PolarHBondContact O-N 3.4Å
993	Q	86.5	Confident	82.3	Confident	107 Å²	107	112.6 Å²	112.6	50%	0.5	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-45.5	176.3	-69.5	-175.2	27.9	0	0	111.8	E989 L990 L991 A995 L996 I997	E989-Q993 WeakPolarHBondContact O-CG 3.39Å; E989-Q993 PolarHBondContact O-N 2.99Å; L990-Q993 PolarHBondContact O-N 2.83Å; L991-Q993 PolarHBondContact O-N 2.94Å; Q993-A995 VanDerWaalsContact C-N 3.33Å; Q993-A995 PolarHBondContact O-N 2.81Å; Q993-L996 WeakPolarHBondContact O-CB 3.36Å; Q993-L996 PolarHBondContact O-N 3.23Å; Q993-I997 WeakPolarHBondContact O-CG1 3.42Å; Q993-I997 PolarHBondContact O-N 3.06Å
994	A	86	Confident	83.7	Confident	34 Å²	34	112.8 Å²	112.8	28%	0.281	55%	0.553	S	S	.	*	H	α-helix	trans	-61	-40.7	176.9	0	0	0	0	0	112.2	L990 L991 I997 R998	L990-A994 WeakPolarHBondContact O-CB 3.41Å; L990-A994 PolarHBondContact O-N 3.33Å; L991-A994 PolarHBondContact O-N 3.37Å; A994-I997 PolarHBondContact O-N 3.41Å; A994-R998 WeakPolarHBondContact O-CG 3.29Å; A994-R998 PolarHBondContact O-N 2.88Å
995	A	87.3	Confident	84.2	Confident	57 Å²	57	111.5 Å²	111.5	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-63	-43.1	174.7	0	0	0	0	0	112.1	L991 K992 Q993 R998 K999	L991-A995 WeakPolarHBondContact O-CB 3.48Å; L991-A995 PolarHBondContact O-N 2.93Å; K992-A995 PolarHBondContact O-N 3.41Å; Q993-A995 VanDerWaalsContact C-N 3.33Å; Q993-A995 PolarHBondContact O-N 2.81Å; A995-R998 PolarHBondContact O-N 3.49Å; A995-K999 WeakPolarHBondContact O-CB 3.46Å; A995-K999 PolarHBondContact O-N 2.87Å
996	L	88.3	Confident	84.5	Confident	120 Å²	120	109.1 Å²	109.1	63%	0.628	54%	0.537	S	S	*	.	H	α-helix	trans	-60.5	-44.6	174.2	-76.9	163	0	0	0	112	K992 Q993 K999 R1000	K992-L996 WeakPolarHBondContact O-CG 3.45Å; K992-L996 PolarHBondContact O-N 3.4Å; Q993-L996 WeakPolarHBondContact O-CB 3.36Å; Q993-L996 PolarHBondContact O-N 3.23Å; L996-K999 PolarHBondContact O-N 2.92Å; L996-R1000 WeakPolarHBondContact O-CB 3.39Å; L996-R1000 PolarHBondContact O-N 3.4Å
997	I	87.5	Confident	84.9	Confident	97 Å²	97	105.3 Å²	105.3	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-50.5	176.8	-68.1	164.6	0	0	0	110.6	Q993 A994 K999 R1000 Q1001	Q993-I997 WeakPolarHBondContact O-CG1 3.42Å; Q993-I997 PolarHBondContact O-N 3.06Å; A994-I997 PolarHBondContact O-N 3.41Å; I997-K999 PolarHBondContact O-N 3.37Å; I997-R1000 PolarHBondContact O-N 3.47Å; I997-Q1001 HydrophobicContact CG2-CG 4.48Å; I997-Q1001 WeakPolarHBondContact O-CG 3.37Å; I997-Q1001 PolarHBondContact O-N 3.18Å
998	R	87	Confident	85.3	Confident	183 Å²	183	104.9 Å²	104.9	69%	0.691	52%	0.518	S	S	*	.	H	α-helix	trans	-58.8	-46.6	178.1	-71.6	174.8	-174.9	174.3	4.1	111.7	A994 A995 R1000 Q1001 M1002	A994-R998 WeakPolarHBondContact O-CG 3.29Å; A994-R998 PolarHBondContact O-N 2.88Å; A995-R998 PolarHBondContact O-N 3.49Å; R998-R1000 VanDerWaalsContact C-N 3.32Å; R998-R1000 PolarHBondContact O-N 2.86Å; R998-Q1001 PolarHBondContact O-N 3.48Å; R998-M1002 PolarHBondContact O-N 2.71Å
999	K	87.1	Confident	85.4	Confident	149 Å²	149	112.8 Å²	112.8	65%	0.648	54%	0.543	S	S	*	.	H	α-helix	trans	-60.6	-40.4	178	-165.4	171.8	-173.8	174.1	0	111.6	A995 L996 I997 M1002 L1003	A995-K999 WeakPolarHBondContact O-CB 3.46Å; A995-K999 PolarHBondContact O-N 2.87Å; L996-K999 PolarHBondContact O-N 2.92Å; I997-K999 PolarHBondContact O-N 3.37Å; K999-M1002 PolarHBondContact O-N 3.04Å; K999-L1003 WeakPolarHBondContact O-CG 3.33Å; K999-L1003 PolarHBondContact O-N 3.16Å; K999-L1003 VanDerWaalsContact O-N 3.07Å
1000	R	87.5	Confident	85.2	Confident	145 Å²	145	112.9 Å²	112.9	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-71.2	-38.7	177.7	-158.2	152.2	-176.4	152.6	-6.3	112.5	L996 I997 R998 L1003 I1004 D1039	L996-R1000 WeakPolarHBondContact O-CB 3.39Å; L996-R1000 PolarHBondContact O-N 3.4Å; I997-R1000 PolarHBondContact O-N 3.47Å; R998-R1000 VanDerWaalsContact C-N 3.32Å; R998-R1000 PolarHBondContact O-N 2.86Å; R1000-L1003 PolarHBondContact O-N 3.34Å; R1000-I1004 HydrophobicContact CG-CD1 4.44Å; R1000-I1004 WeakPolarHBondContact O-CD1 3.35Å; R1000-I1004 VanDerWaalsContact O-CG1 3.26Å; R1000-I1004 WeakPolarHBondContact O-CG1 3.45Å; R1000-I1004 PolarHBondContact O-N 3.44Å; R1000-D1039 PolarHBondContact NH2-O 3.38Å
1001	Q	86.1	Confident	84.9	Confident	118 Å²	118	114.7 Å²	114.7	55%	0.551	54%	0.542	S	S	*	.	H	α-helix	trans	-61.6	-41.1	171	-73.2	179.2	-3.7	0	0	112.2	I997 R998 I1004 T1005	I997-Q1001 HydrophobicContact CG2-CG 4.48Å; I997-Q1001 WeakPolarHBondContact O-CG 3.37Å; I997-Q1001 PolarHBondContact O-N 3.18Å; R998-Q1001 PolarHBondContact O-N 3.48Å; Q1001-I1004 PolarHBondContact O-N 2.69Å; Q1001-T1005 WeakPolarHBondContact O-CB 3.25Å; Q1001-T1005 PolarHBondContact O-N 3.42Å; Q1001-T1005 PolarHBondContact O-OG1 3.38Å
1002	M	84.9	Confident	84.6	Confident	150 Å²	150	118.6 Å²	118.6	74%	0.739	55%	0.55	S	S	*	.	H	α-helix	trans	-64.2	-43.7	177.7	-160.6	-164.1	-116	0	0	111.5	R998 K999 T1005 K1006	R998-M1002 PolarHBondContact O-N 2.71Å; K999-M1002 PolarHBondContact O-N 3.04Å; M1002-T1005 PolarHBondContact O-N 2.98Å; M1002-K1006 PolarHBondContact O-N 3.43Å
1003	L	87.6	Confident	84	Confident	109 Å²	109	119.6 Å²	119.6	57%	0.571	56%	0.559	S	S	*	*	H	α-helix	trans	-60.6	-47.6	174.3	-74.9	167.7	0	0	0	112.3	K999 R1000 T1005 K1006 E1007	K999-L1003 WeakPolarHBondContact O-CG 3.33Å; K999-L1003 PolarHBondContact O-N 3.16Å; K999-L1003 VanDerWaalsContact O-N 3.07Å; R1000-L1003 PolarHBondContact O-N 3.34Å; L1003-T1005 PolarHBondContact O-N 3.3Å; L1003-K1006 PolarHBondContact O-N 3.18Å; L1003-E1007 PolarHBondContact O-N 2.97Å
1004	I	86.5	Confident	83.1	Confident	105 Å²	105	118.3 Å²	118.3	54%	0.538	56%	0.561	S	S	.	*	H	α-helix	trans	-58	-40	175.7	-70	163.9	0	0	0	111	R1000 Q1001 S1008	R1000-I1004 HydrophobicContact CG-CD1 4.44Å; R1000-I1004 WeakPolarHBondContact O-CD1 3.35Å; R1000-I1004 VanDerWaalsContact O-CG1 3.26Å; R1000-I1004 WeakPolarHBondContact O-CG1 3.45Å; R1000-I1004 PolarHBondContact O-N 3.44Å; Q1001-I1004 PolarHBondContact O-N 2.69Å; I1004-S1008 VanDerWaalsContact O-CB 3.26Å; I1004-S1008 WeakPolarHBondContact O-CB 3.45Å; I1004-S1008 PolarHBondContact O-N 2.93Å
1005	T	84	Confident	82.3	Confident	87 Å²	87	122.7 Å²	122.7	53%	0.534	59%	0.59	S	S	.	*	H	α-helix	trans	-68.7	-41.8	179	-57.3	0	0	0	0	111.8	Q1001 M1002 L1003 S1008 R1009	Q1001-T1005 WeakPolarHBondContact O-CB 3.25Å; Q1001-T1005 PolarHBondContact O-N 3.42Å; Q1001-T1005 PolarHBondContact O-OG1 3.38Å; M1002-T1005 PolarHBondContact O-N 2.98Å; L1003-T1005 PolarHBondContact O-N 3.3Å; T1005-S1008 PolarHBondContact O-N 3.17Å; T1005-R1009 PolarHBondContact O-N 2.77Å
1006	K	84.3	Confident	81.6	Confident	129 Å²	129	129.8 Å²	129.8	56%	0.561	61%	0.605	S	S	*	*	H	α-helix	trans	-61.6	-48.8	174.6	-175.1	177.4	177.2	-177.7	0	111.4	M1002 L1003 S1008 R1009 E1010	M1002-K1006 PolarHBondContact O-N 3.43Å; L1003-K1006 PolarHBondContact O-N 3.18Å; K1006-S1008 VanDerWaalsContact C-N 3.31Å; K1006-S1008 PolarHBondContact O-N 3.46Å; K1006-R1009 WeakPolarHBondContact O-CA 3.28Å; K1006-R1009 VanDerWaalsContact O-CB 3.3Å; K1006-R1009 WeakPolarHBondContact O-CB 3.49Å; K1006-R1009 PolarHBondContact O-N 3.23Å; K1006-E1010 WeakPolarHBondContact CE-OE1 3.41Å; K1006-E1010 PolarHBondContact O-N 2.71Å
1007	E	85.5	Confident	80.9	Confident	78 Å²	78	130.1 Å²	130.1	36%	0.364	61%	0.614	S	S	.	*	H	α-helix	trans	-62.7	-38.2	178	-154.6	-156	166.1	0	0	111.7	L1003 R1009 E1010 R1011	L1003-E1007 PolarHBondContact O-N 2.97Å; E1007-R1009 VanDerWaalsContact C-N 3.33Å; E1007-R1009 PolarHBondContact O-N 3.23Å; E1007-E1010 PolarHBondContact O-N 3.26Å; E1007-R1011 VanDerWaalsContact CD-CZ 3.49Å; E1007-R1011 WeakPolarHBondContact O-CB 3.33Å; E1007-R1011 WeakPolarHBondContact O-CG 3.49Å; E1007-R1011 PolarHBondContact O-N 2.96Å; E1007-R1011 IonicContact OE1-CZ 3.55Å; E1007-R1011 IonicContact OE1-NE 2.71Å; E1007-R1011 PolarHBondContact OE1-NE 3.04Å; E1007-R1011 VanDerWaalsContact OE1-NE 3.08Å; E1007-R1011 IonicContact OE1-NH2 2.66Å; E1007-R1011 PolarHBondContact OE1-NH2 2.72Å; E1007-R1011 IonicContact OE2-CZ 3.09Å; E1007-R1011 IonicContact OE2-NE 2.72Å; E1007-R1011 IonicContact OE2-NH2 2.87Å; E1007-R1011 PolarHBondContact OE2-NH2 2.76Å
1008	S	82.8	Confident	79.9	Confident	41 Å²	41	133.6 Å²	133.6	29%	0.287	62%	0.621	S	S	.	*	H	α-helix	trans	-63	-37	173.3	-173.2	0	0	0	0	112.5	I1004 T1005 K1006 R1012	I1004-S1008 VanDerWaalsContact O-CB 3.26Å; I1004-S1008 WeakPolarHBondContact O-CB 3.45Å; I1004-S1008 PolarHBondContact O-N 2.93Å; T1005-S1008 PolarHBondContact O-N 3.17Å; K1006-S1008 VanDerWaalsContact C-N 3.31Å; K1006-S1008 PolarHBondContact O-N 3.46Å; S1008-R1012 WeakPolarHBondContact O-CB 3.44Å; S1008-R1012 WeakPolarHBondContact O-CD 3.42Å; S1008-R1012 WeakPolarHBondContact O-CG 3.49Å; S1008-R1012 PolarHBondContact O-N 2.78Å
1009	R	81.5	Confident	79.1	Confident	191 Å²	191	130.1 Å²	130.1	72%	0.721	62%	0.615	S	S	*	*	H	α-helix	trans	-64.5	-50.1	172.8	-109.4	-179.5	175.9	179.3	-0.2	111.3	T1005 K1006 E1007 R1011 R1012 M1013	T1005-R1009 PolarHBondContact O-N 2.77Å; K1006-R1009 WeakPolarHBondContact O-CA 3.28Å; K1006-R1009 VanDerWaalsContact O-CB 3.3Å; K1006-R1009 WeakPolarHBondContact O-CB 3.49Å; K1006-R1009 PolarHBondContact O-N 3.23Å; E1007-R1009 VanDerWaalsContact C-N 3.33Å; E1007-R1009 PolarHBondContact O-N 3.23Å; R1009-R1011 PolarHBondContact O-N 2.95Å; R1009-R1012 WeakPolarHBondContact O-CA 3.42Å; R1009-R1012 WeakPolarHBondContact O-CB 3.34Å; R1009-R1012 PolarHBondContact O-N 3.29Å; R1009-M1013 WeakPolarHBondContact O-CG 3.44Å; R1009-M1013 PolarHBondContact O-N 3.21Å
1010	E	81	Confident	78.2	Confident	117 Å²	117	126.9 Å²	126.9	55%	0.547	61%	0.609	S	S	.	*	H	α-helix	trans	-58.1	-46.4	178.1	-70.8	169.6	-167.6	0	0	111.5	K1006 E1007 R1012 M1013	K1006-E1010 WeakPolarHBondContact CE-OE1 3.41Å; K1006-E1010 PolarHBondContact O-N 2.71Å; E1007-E1010 PolarHBondContact O-N 3.26Å; E1010-R1012 PolarHBondContact O-N 3.14Å; E1010-R1012 VanDerWaalsContact O-N 3.15Å; E1010-M1013 PolarHBondContact O-N 2.8Å
1011	R	74.5	Confident	77.1	Confident	147 Å²	147	130.5 Å²	130.5	56%	0.555	62%	0.623	S	S	*	*	H	α-helix	trans	-62.9	-17.6	173.9	-67	171.4	-173.1	-179.7	2.8	114	E1007 R1009 R1018	E1007-R1011 VanDerWaalsContact CD-CZ 3.49Å; E1007-R1011 WeakPolarHBondContact O-CB 3.33Å; E1007-R1011 WeakPolarHBondContact O-CG 3.49Å; E1007-R1011 PolarHBondContact O-N 2.96Å; E1007-R1011 IonicContact OE1-CZ 3.55Å; E1007-R1011 IonicContact OE1-NE 2.71Å; E1007-R1011 PolarHBondContact OE1-NE 3.04Å; E1007-R1011 VanDerWaalsContact OE1-NE 3.08Å; E1007-R1011 IonicContact OE1-NH2 2.66Å; E1007-R1011 PolarHBondContact OE1-NH2 2.72Å; E1007-R1011 IonicContact OE2-CZ 3.09Å; E1007-R1011 IonicContact OE2-NE 2.72Å; E1007-R1011 IonicContact OE2-NH2 2.87Å; E1007-R1011 PolarHBondContact OE2-NH2 2.76Å; R1009-R1011 PolarHBondContact O-N 2.95Å; R1011-R1018 PolarHBondContact O-NE 3.05Å; R1011-R1018 PolarHBondContact O-NH2 2.92Å
1012	R	75.7	Confident	76	Confident	186 Å²	186	132.9 Å²	132.9	70%	0.702	63%	0.634	S	S	*	*	H	α-helix	trans	-95.3	-23.8	177.3	-74.4	171.2	-169.1	-150.4	1	113.3	S1008 R1009 E1010 S1014	S1008-R1012 WeakPolarHBondContact O-CB 3.44Å; S1008-R1012 WeakPolarHBondContact O-CD 3.42Å; S1008-R1012 WeakPolarHBondContact O-CG 3.49Å; S1008-R1012 PolarHBondContact O-N 2.78Å; R1009-R1012 WeakPolarHBondContact O-CA 3.42Å; R1009-R1012 WeakPolarHBondContact O-CB 3.34Å; R1009-R1012 PolarHBondContact O-N 3.29Å; E1010-R1012 PolarHBondContact O-N 3.14Å; E1010-R1012 VanDerWaalsContact O-N 3.15Å; R1012-S1014 VanDerWaalsContact C-N 3.32Å; R1012-S1014 PolarHBondContact O-N 3.13Å
1013	M	72.6	Confident	75	Confident	162 Å²	162	128 Å²	128	80%	0.798	62%	0.622	S	S	*	*	H	α-helix	trans	-70	-22	-177.8	-75.9	-74	-77.5	0	0	114.3	R1009 E1010 S1015	R1009-M1013 WeakPolarHBondContact O-CG 3.44Å; R1009-M1013 PolarHBondContact O-N 3.21Å; E1010-M1013 PolarHBondContact O-N 2.8Å; M1013-S1015 PolarHBondContact O-N 3.29Å
1014	S	67.9	Low	73.8	Confident	79 Å²	79	127.1 Å²	127.1	55%	0.552	61%	0.611	S	S	*	*			trans	-71.8	117.2	179	-175.8	0	0	0	0	112.3	R1012 R1016	R1012-S1014 VanDerWaalsContact C-N 3.32Å; R1012-S1014 PolarHBondContact O-N 3.13Å; S1014-R1016 PolarHBondContact O-N 3.38Å
1015	S	68.1	Low	72.4	Confident	127 Å²	127	127.7 Å²	127.7	89%	0.888	62%	0.619	S	S	*	*			trans	-67.9	-7.9	174.8	178.2	0	0	0	0	114.4	M1013	M1013-S1015 PolarHBondContact O-N 3.29Å
1016	R	73	Confident	71.2	Confident	206 Å²	206	127.4 Å²	127.4	78%	0.777	63%	0.633	S	S	*	*	S	Bend	trans	-84.5	145.1	-177	-65	-178.2	-179	174.3	1.4	110.8	S1014 R1018	S1014-R1016 PolarHBondContact O-N 3.38Å; R1016-R1018 PolarHBondContact O-N 2.92Å
1017	P	72.8	Confident	70	Confident	126 Å²	126	126.3 Å²	126.3	82%	0.818	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-57.9	134.2	175.6	24.5	-33.7	0	0	0	110.8	L1019	P1017-L1019 PolarHBondContact O-N 2.93Å
1018	R	67.6	Low	68.6	Low	171 Å²	171	130.7 Å²	130.7	65%	0.645	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-70.7	123	-177	-70.4	177.6	171.1	174.4	-3.5	110.7	R1011 R1016	R1011-R1018 PolarHBondContact O-NE 3.05Å; R1011-R1018 PolarHBondContact O-NH2 2.92Å; R1016-R1018 PolarHBondContact O-N 2.92Å
1019	L	69.6	Low	67.6	Low	109 Å²	109	133.4 Å²	133.4	57%	0.571	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-59.3	127.3	170.7	-78	163	0	0	0	110.6	P1017 R1024	P1017-L1019 PolarHBondContact O-N 2.93Å; L1019-R1024 HydrophobicContact CB-CG 4.04Å; L1019-R1024 PolarHBondContact O-NE 3.44Å
1020	P	68.8	Low	66.9	Low	81 Å²	81	125.9 Å²	125.9	53%	0.526	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-65.5	152.4	178.4	27.6	-34.6	0	0	0	111.3	Q1022 G1023	P1020-Q1022 PolarHBondContact O-N 3.04Å; P1020-G1023 PolarHBondContact O-N 3.08Å
1021	R	64.3	Low	66.4	Low	222 Å²	222	125 Å²	125	84%	0.838	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-20.5	-178.2	-109.5	-179.1	174.2	178.8	-3.4	114.7	R1028	R1021-R1028 PolarHBondContact O-NH2 3.48Å
1022	Q	64.1	Low	66.3	Low	167 Å²	167	124.4 Å²	124.4	78%	0.78	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-30.1	173.7	-70.5	166.8	-21.8	0	0	112.8	P1020 V1025	P1020-Q1022 PolarHBondContact O-N 3.04Å; Q1022-V1025 WeakPolarHBondContact O-CG2 3.36Å
1023	G	62.9	Low	66.1	Low	47 Å²	47	119.8 Å²	119.8	49%	0.485	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-10.5	-179.7	0	0	0	0	0	114.7	P1020 V1025	P1020-G1023 PolarHBondContact O-N 3.08Å; G1023-V1025 VanDerWaalsContact C-N 3.27Å; G1023-V1025 PolarHBondContact O-N 2.99Å
1024	R	62.6	Low	66.2	Low	92 Å²	92	116.7 Å²	116.7	35%	0.347	60%	0.595	S	S	.	*			trans	-90.3	48.5	-179.4	-56.9	-169.3	-175.8	-148.9	2	112.8	L1019 G1026 E1027	L1019-R1024 HydrophobicContact CB-CG 4.04Å; L1019-R1024 PolarHBondContact O-NE 3.44Å; R1024-G1026 PolarHBondContact O-N 2.94Å; R1024-G1026 VanDerWaalsContact O-N 3.17Å; R1024-E1027 HydrophobicContact CB-CB 4.33Å; R1024-E1027 HydrophobicContact CB-CG 4.49Å; R1024-E1027 VanDerWaalsContact CD-OE2 3.24Å; R1024-E1027 WeakPolarHBondContact CD-OE2 3.42Å; R1024-E1027 IonicContact CZ-OE2 3.39Å; R1024-E1027 IonicContact NE-OE2 2.77Å; R1024-E1027 IonicContact NH1-OE1 3.47Å; R1024-E1027 PolarHBondContact NH1-OE1 3.31Å; R1024-E1027 IonicContact NH1-OE2 3.55Å; R1024-E1027 PolarHBondContact NH1-OE2 2.88Å; R1024-E1027 PolarHBondContact O-N 3.39Å; R1024-E1027 VanDerWaalsContact O-N 3.14Å
1025	V	56.1	Low	66.7	Low	116 Å²	116	120.1 Å²	120.1	70%	0.703	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-26	-170.3	-176.5	0	0	0	0	112.5	Q1022 G1023	Q1022-V1025 WeakPolarHBondContact O-CG2 3.36Å; G1023-V1025 VanDerWaalsContact C-N 3.27Å; G1023-V1025 PolarHBondContact O-N 2.99Å
1026	G	60.5	Low	67.1	Low	81 Å²	81	117.4 Å²	117.4	84%	0.835	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-11.4	176	0	0	0	0	0	117.1	R1024	R1024-G1026 PolarHBondContact O-N 2.94Å; R1024-G1026 VanDerWaalsContact O-N 3.17Å
1027	E	57.4	Low	67.4	Low	106 Å²	106	109.5 Å²	109.5	50%	0.495	55%	0.546	S	S	.	.	S	Bend	trans	-86.5	-7.3	-178.6	-73.9	-179.5	-156.9	0	0	113.2	R1024 N1029	R1024-E1027 HydrophobicContact CB-CB 4.33Å; R1024-E1027 HydrophobicContact CB-CG 4.49Å; R1024-E1027 VanDerWaalsContact CD-OE2 3.24Å; R1024-E1027 WeakPolarHBondContact CD-OE2 3.42Å; R1024-E1027 IonicContact CZ-OE2 3.39Å; R1024-E1027 IonicContact NE-OE2 2.77Å; R1024-E1027 IonicContact NH1-OE1 3.47Å; R1024-E1027 PolarHBondContact NH1-OE1 3.31Å; R1024-E1027 IonicContact NH1-OE2 3.55Å; R1024-E1027 PolarHBondContact NH1-OE2 2.88Å; R1024-E1027 PolarHBondContact O-N 3.39Å; R1024-E1027 VanDerWaalsContact O-N 3.14Å; E1027-N1029 PolarHBondContact O-N 3.36Å
1028	R	57.9	Low	67.8	Low	171 Å²	171	105.9 Å²	105.9	65%	0.645	53%	0.527	S	S	*	.			trans	-84.2	58.8	-177.2	-60.1	-174.8	-172.6	-177.6	3.1	111.8	R1021 V1030	R1021-R1028 PolarHBondContact O-NH2 3.48Å; R1028-V1030 PolarHBondContact O-N 3.16Å
1029	N	61.1	Low	68.2	Low	97 Å²	97	102.6 Å²	102.6	52%	0.519	52%	0.522	S	S	.	.			trans	-72.5	126.7	174.4	-164.4	-0.9	0	0	0	110.2	E1027 D1031 R1032 L1033	E1027-N1029 PolarHBondContact O-N 3.36Å; N1029-D1031 PolarHBondContact O-N 2.93Å; N1029-R1032 HydrophobicContact CB-CB 4.44Å; N1029-R1032 WeakPolarHBondContact O-CB 3.45Å; N1029-R1032 PolarHBondContact O-N 3.44Å; N1029-L1033 PolarHBondContact O-N 3.34Å
1030	V	66.4	Low	68.6	Low	33 Å²	33	106 Å²	106	20%	0.2	53%	0.527	C	S	.	.	H	α-helix	trans	-59	-39.6	-176	-172.5	0	0	0	0	110.6	R1028 R1032 L1033 R1034 L1049 L1052	R1028-V1030 PolarHBondContact O-N 3.16Å; V1030-R1032 VanDerWaalsContact C-N 3.31Å; V1030-R1032 PolarHBondContact O-N 2.88Å; V1030-L1033 PolarHBondContact O-N 3.49Å; V1030-R1034 VanDerWaalsContact O-CB 3.3Å; V1030-R1034 WeakPolarHBondContact O-CB 3.17Å; V1030-R1034 PolarHBondContact O-N 3.44Å; V1030-L1049 HydrophobicContact CG1-CD2 4.3Å; V1030-L1052 HydrophobicContact CG1-CB 3.98Å; V1030-L1052 HydrophobicContact CG2-CB 3.92Å; V1030-L1052 HydrophobicContact CG2-CD2 4.35Å
1031	D	70.9	Confident	68.8	Low	98 Å²	98	105.3 Å²	105.3	52%	0.524	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-34.8	177.8	-68.1	-44.3	0	0	0	113	N1029 K1035	N1029-D1031 PolarHBondContact O-N 2.93Å; D1031-K1035 WeakPolarHBondContact O-CB 3.47Å; D1031-K1035 PolarHBondContact O-N 3.34Å
1032	R	72.3	Confident	69.1	Low	136 Å²	136	99.3 Å²	99.3	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-68.5	-45.6	175.9	-179.6	-177.8	170.6	153.9	9.4	111	N1029 V1030 R1034 K1035 E1036	N1029-R1032 HydrophobicContact CB-CB 4.44Å; N1029-R1032 WeakPolarHBondContact O-CB 3.45Å; N1029-R1032 PolarHBondContact O-N 3.44Å; V1030-R1032 VanDerWaalsContact C-N 3.31Å; V1030-R1032 PolarHBondContact O-N 2.88Å; R1032-R1034 VanDerWaalsContact C-N 3.31Å; R1032-R1034 PolarHBondContact O-N 3.35Å; R1032-K1035 PolarHBondContact O-N 3.48Å; R1032-E1036 IonicContact CZ-OE1 3.26Å; R1032-E1036 VanDerWaalsContact CZ-OE1 3.26Å; R1032-E1036 IonicContact NE-OE1 2.76Å; R1032-E1036 PolarHBondContact NE-OE1 3.24Å; R1032-E1036 IonicContact NH2-OE1 2.86Å; R1032-E1036 PolarHBondContact NH2-OE1 3.26Å; R1032-E1036 PolarHBondContact O-N 3.27Å
1033	L	71.4	Confident	69.1	Low	88 Å²	88	100.2 Å²	100.2	46%	0.461	52%	0.523	S	S	.	.	H	α-helix	trans	-63.8	-41.1	178.1	-161.9	84	0	0	0	110.7	N1029 V1030 K1035 E1036 L1037	N1029-L1033 PolarHBondContact O-N 3.34Å; V1030-L1033 PolarHBondContact O-N 3.49Å; L1033-K1035 VanDerWaalsContact C-N 3.33Å; L1033-K1035 PolarHBondContact O-N 2.71Å; L1033-E1036 PolarHBondContact O-N 2.67Å; L1033-L1037 HydrophobicContact CD2-CD1 4.09Å; L1033-L1037 HydrophobicContact CG-CD1 3.9Å; L1033-L1037 WeakPolarHBondContact O-CB 3.18Å; L1033-L1037 WeakPolarHBondContact O-CD1 3.25Å; L1033-L1037 VanDerWaalsContact O-CG 3.26Å; L1033-L1037 WeakPolarHBondContact O-CG 3.39Å; L1033-L1037 PolarHBondContact O-N 3.1Å
1034	R	75.2	Confident	69.1	Low	98 Å²	98	100.6 Å²	100.6	37%	0.37	51%	0.513	S	S	.	.	H	α-helix	trans	-59.1	-42.2	173.5	-174.6	179.7	175.4	-147.1	-7.3	111.6	V1030 R1032 A1038 L1049	V1030-R1034 VanDerWaalsContact O-CB 3.3Å; V1030-R1034 WeakPolarHBondContact O-CB 3.17Å; V1030-R1034 PolarHBondContact O-N 3.44Å; R1032-R1034 VanDerWaalsContact C-N 3.31Å; R1032-R1034 PolarHBondContact O-N 3.35Å; R1034-A1038 WeakPolarHBondContact O-CB 3.49Å; R1034-A1038 PolarHBondContact O-N 3.36Å; R1034-L1049 HydrophobicContact CB-CD1 4.28Å; R1034-L1049 HydrophobicContact CG-CD1 4.12Å
1035	K	77.4	Confident	69	Low	150 Å²	150	98.2 Å²	98.2	65%	0.652	52%	0.518	S	S	*	.	H	α-helix	trans	-64.3	-50.4	174.7	-128	176.3	-178.5	-179.9	0	112.2	D1031 R1032 L1033 L1037 A1038 D1039	D1031-K1035 WeakPolarHBondContact O-CB 3.47Å; D1031-K1035 PolarHBondContact O-N 3.34Å; R1032-K1035 PolarHBondContact O-N 3.48Å; L1033-K1035 VanDerWaalsContact C-N 3.33Å; L1033-K1035 PolarHBondContact O-N 2.71Å; K1035-L1037 PolarHBondContact O-N 2.92Å; K1035-L1037 VanDerWaalsContact O-N 3.17Å; K1035-A1038 PolarHBondContact O-N 2.84Å; K1035-D1039 WeakPolarHBondContact O-CB 3.36Å; K1035-D1039 PolarHBondContact O-N 3.19Å
1036	E	77.8	Confident	69.1	Low	71 Å²	71	101.4 Å²	101.4	33%	0.332	52%	0.517	S	S	.	.	H	α-helix	trans	-66.1	-17.2	-180	-71.2	-176.8	-162.9	0	0	114.3	R1032 L1033 R1040	R1032-E1036 IonicContact CZ-OE1 3.26Å; R1032-E1036 VanDerWaalsContact CZ-OE1 3.26Å; R1032-E1036 IonicContact NE-OE1 2.76Å; R1032-E1036 PolarHBondContact NE-OE1 3.24Å; R1032-E1036 IonicContact NH2-OE1 2.86Å; R1032-E1036 PolarHBondContact NH2-OE1 3.26Å; R1032-E1036 PolarHBondContact O-N 3.27Å; L1033-E1036 PolarHBondContact O-N 2.67Å; E1036-R1040 PolarHBondContact O-NH1 3Å
1037	L	79.3	Confident	69	Low	40 Å²	40	105.7 Å²	105.7	21%	0.209	51%	0.513	C	S	.	.	H	α-helix	trans	-91.5	-39.5	173.3	-71.1	165.6	0	0	0	112	L1033 K1035 D1039 R1040 G1041 L1042 I1044	L1033-L1037 HydrophobicContact CD2-CD1 4.09Å; L1033-L1037 HydrophobicContact CG-CD1 3.9Å; L1033-L1037 WeakPolarHBondContact O-CB 3.18Å; L1033-L1037 WeakPolarHBondContact O-CD1 3.25Å; L1033-L1037 VanDerWaalsContact O-CG 3.26Å; L1033-L1037 WeakPolarHBondContact O-CG 3.39Å; L1033-L1037 PolarHBondContact O-N 3.1Å; K1035-L1037 PolarHBondContact O-N 2.92Å; K1035-L1037 VanDerWaalsContact O-N 3.17Å; L1037-D1039 VanDerWaalsContact C-N 3.32Å; L1037-D1039 PolarHBondContact O-N 2.91Å; L1037-R1040 CarbonylContact O-C 3.53Å; L1037-R1040 WeakPolarHBondContact O-CA 3.4Å; L1037-R1040 PolarHBondContact O-N 3.12Å; L1037-G1041 PolarHBondContact O-N 3.34Å; L1037-L1042 CarbonylContact C-O 3.54Å; L1037-L1042 HydrophobicContact CB-CB 4.3Å; L1037-L1042 HydrophobicContact CD2-CD1 4.01Å; L1037-L1042 PolarHBondContact O-N 3.27Å; L1037-I1044 HydrophobicContact CD1-CD1 3.76Å
1038	A	79.9	Confident	69.1	Low	50 Å²	50	111.2 Å²	111.2	41%	0.413	53%	0.529	S	S	.	.	H	α-helix	trans	-58.9	-43.1	168.8	0	0	0	0	0	111.3	R1034 K1035 R1040 G1041	R1034-A1038 WeakPolarHBondContact O-CB 3.49Å; R1034-A1038 PolarHBondContact O-N 3.36Å; K1035-A1038 PolarHBondContact O-N 2.84Å; A1038-R1040 PolarHBondContact O-N 2.81Å; A1038-G1041 PolarHBondContact O-N 2.9Å
1039	D	77.5	Confident	69	Low	101 Å²	101	103.8 Å²	103.8	54%	0.54	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-3.2	173.4	-68.8	-14.3	0	0	0	114.4	R1000 K1035 L1037	R1000-D1039 PolarHBondContact NH2-O 3.38Å; K1035-D1039 WeakPolarHBondContact O-CB 3.36Å; K1035-D1039 PolarHBondContact O-N 3.19Å; L1037-D1039 VanDerWaalsContact C-N 3.32Å; L1037-D1039 PolarHBondContact O-N 2.91Å
1040	R	76.3	Confident	68.5	Low	180 Å²	180	106.9 Å²	106.9	68%	0.679	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	11.9	175.1	-76.5	-167.7	172	92.2	-4.3	113.4	E1036 L1037 A1038 L1042	E1036-R1040 PolarHBondContact O-NH1 3Å; L1037-R1040 CarbonylContact O-C 3.53Å; L1037-R1040 WeakPolarHBondContact O-CA 3.4Å; L1037-R1040 PolarHBondContact O-N 3.12Å; A1038-R1040 PolarHBondContact O-N 2.81Å; R1040-L1042 PolarHBondContact O-N 2.89Å
1041	G	72.9	Confident	68	Low	67 Å²	67	113.9 Å²	113.9	69%	0.691	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	6.8	-178.6	0	0	0	0	0	114.7	L1037 A1038 E1043	L1037-G1041 PolarHBondContact O-N 3.34Å; A1038-G1041 PolarHBondContact O-N 2.9Å; G1041-E1043 PolarHBondContact O-N 3.49Å
1042	L	72.2	Confident	67.2	Low	97 Å²	97	113.9 Å²	113.9	51%	0.508	54%	0.536	S	S	.	.			trans	-90.4	83.1	174.1	-77.1	161.9	0	0	0	109.4	L1037 R1040 I1044	L1037-L1042 CarbonylContact C-O 3.54Å; L1037-L1042 HydrophobicContact CB-CB 4.3Å; L1037-L1042 HydrophobicContact CD2-CD1 4.01Å; L1037-L1042 PolarHBondContact O-N 3.27Å; R1040-L1042 PolarHBondContact O-N 2.89Å; L1042-I1044 HydrophobicContact CB-CG1 4.46Å; L1042-I1044 PolarHBondContact O-N 3.37Å
1043	E	63.6	Low	66	Low	186 Å²	186	111.2 Å²	111.2	87%	0.869	54%	0.535	S	S	*	.			trans	-67.6	81.6	169.6	-73	-138.6	135	0	0	111.3	G1041 G1045	G1041-E1043 PolarHBondContact O-N 3.49Å; E1043-G1045 PolarHBondContact O-N 2.92Å
1044	I	62.1	Low	64.8	Low	54 Å²	54	115.2 Å²	115.2	28%	0.277	55%	0.552	S	S	.	*			trans	-80	92.4	170.5	-46	-172.6	0	0	0	108.1	L1037 L1042 R1048 L1049	L1037-I1044 HydrophobicContact CD1-CD1 3.76Å; L1042-I1044 HydrophobicContact CB-CG1 4.46Å; L1042-I1044 PolarHBondContact O-N 3.37Å; I1044-R1048 HydrophobicContact CG2-CB 3.57Å; I1044-L1049 HydrophobicContact CB-CD1 4.06Å; I1044-L1049 HydrophobicContact CB-CG 4.32Å; I1044-L1049 HydrophobicContact CG2-CD1 3.97Å; I1044-L1049 HydrophobicContact CG2-CG 3.72Å
1045	G	61.2	Low	63.3	Low	43 Å²	43	115.7 Å²	115.7	44%	0.443	57%	0.57	S	S	.	*			trans	-52.3	147.1	173.1	0	0	0	0	0	111.5	E1043 K1047 R1048	E1043-G1045 PolarHBondContact O-N 2.92Å; G1045-K1047 PolarHBondContact O-N 3.12Å; G1045-R1048 PolarHBondContact O-N 2.99Å
1046	R	57.5	Low	61.6	Low	183 Å²	183	117.4 Å²	117.4	69%	0.691	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.6	-28.4	-178.5	-84.8	178.9	164.1	166.3	-6.4	113.6
1047	K	59.2	Low	59.8	Low	170 Å²	170	120.6 Å²	120.6	74%	0.739	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-26.2	176.9	-64.9	-179.6	179.8	177.3	0	114.9	G1045 R1050	G1045-K1047 PolarHBondContact O-N 3.12Å; K1047-R1050 VanDerWaalsContact O-CD 3.3Å; K1047-R1050 WeakPolarHBondContact O-CD 3.34Å; K1047-R1050 WeakPolarHBondContact O-CG 3.45Å
1048	R	59	Low	57.8	Low	222 Å²	222	123.8 Å²	123.8	84%	0.838	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-21.8	173.8	-87.3	-175.6	169.2	177.9	-3.4	113.4	I1044 G1045 R1050	I1044-R1048 HydrophobicContact CG2-CB 3.57Å; G1045-R1048 PolarHBondContact O-N 2.99Å; R1048-R1050 PolarHBondContact O-N 3.4Å
1049	L	55.5	Low	55.6	Low	15 Å²	15	133 Å²	133	8%	0.079	65%	0.654	C	S	.	*			trans	-81.7	11.6	173.6	-86.7	157.5	0	0	0	114.1	V1030 R1034 I1044 H1051 L1052 T1053	V1030-L1049 HydrophobicContact CG1-CD2 4.3Å; R1034-L1049 HydrophobicContact CB-CD1 4.28Å; R1034-L1049 HydrophobicContact CG-CD1 4.12Å; I1044-L1049 HydrophobicContact CB-CD1 4.06Å; I1044-L1049 HydrophobicContact CB-CG 4.32Å; I1044-L1049 HydrophobicContact CG2-CD1 3.97Å; I1044-L1049 HydrophobicContact CG2-CG 3.72Å; L1049-H1051 PolarHBondContact O-N 3.05Å; L1049-H1051 VanDerWaalsContact O-N 3.12Å; L1049-L1052 HydrophobicContact CD2-CD1 3.93Å; L1049-L1052 PolarHBondContact O-N 2.96Å; L1049-T1053 PolarHBondContact O-OG1 2.91Å
1050	R	51.9	Low	53.6	Low	162 Å²	162	134.1 Å²	134.1	61%	0.611	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-55.9	-29.8	-176.1	-80.6	178	170.2	-179	-7	114.5	K1047 R1048 L1052 T1053	K1047-R1050 VanDerWaalsContact O-CD 3.3Å; K1047-R1050 WeakPolarHBondContact O-CD 3.34Å; K1047-R1050 WeakPolarHBondContact O-CG 3.45Å; R1048-R1050 PolarHBondContact O-N 3.4Å; R1050-L1052 PolarHBondContact O-N 3.49Å; R1050-T1053 PolarHBondContact O-N 3.48Å
1051	H	55.8	Low	51.6	Low	180 Å²	180	130.8 Å²	130.8	83%	0.833	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-67.2	-0.9	173.1	-69	-56.5	0	0	0	115.4	L1049	L1049-H1051 PolarHBondContact O-N 3.05Å; L1049-H1051 VanDerWaalsContact O-N 3.12Å
1052	L	52.5	Low	49.7	Very low	98 Å²	98	132.3 Å²	132.3	51%	0.513	67%	0.671	S	S	.	*	G	3₁₀ helix	trans	-129.2	1.3	178.9	-77.3	157.8	0	0	0	112.9	V1030 L1049 R1050	V1030-L1052 HydrophobicContact CG1-CB 3.98Å; V1030-L1052 HydrophobicContact CG2-CB 3.92Å; V1030-L1052 HydrophobicContact CG2-CD2 4.35Å; L1049-L1052 HydrophobicContact CD2-CD1 3.93Å; L1049-L1052 PolarHBondContact O-N 2.96Å; R1050-L1052 PolarHBondContact O-N 3.49Å
1053	T	48.5	Very low	48	Very low	81 Å²	81	135.9 Å²	135.9	50%	0.497	69%	0.685	S	S	.	*			trans	-121.6	19.2	-178.6	43.4	0	0	0	0	113.9	L1049 R1050 S1055	L1049-T1053 PolarHBondContact O-OG1 2.91Å; R1050-T1053 PolarHBondContact O-N 3.48Å; T1053-S1055 PolarHBondContact O-N 3.07Å; T1053-S1055 VanDerWaalsContact O-N 3.13Å
1054	E	46.4	Very low	46.6	Very low	171 Å²	171	134.4 Å²	134.4	80%	0.799	68%	0.676	S	S	*	*			trans	-75.2	95.2	168.7	-77.4	-179.3	162.8	0	0	111.2
1055	S	42.8	Very low	45.2	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	70%	0.704	S	S	*	*			trans	-133.5	42.1	158.5	68.2	0	0	0	0	111.7	T1053	T1053-S1055 PolarHBondContact O-N 3.07Å; T1053-S1055 VanDerWaalsContact O-N 3.13Å
1056	E	42	Very low	44	Very low	186 Å²	186	145.4 Å²	145.4	87%	0.869	71%	0.712	S	S	*	*			trans	-167.3	103.5	173.8	-110.5	160.5	-130.4	0	0	111.5
1057	V	39.1	Very low	42.9	Very low	138 Å²	138	145.1 Å²	145.1	84%	0.836	71%	0.711	S	S	*	*			trans	164.4	141.8	151.4	155.1	0	0	0	0	108.6
1058	S	37.3	Very low	41.6	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	71%	0.712	S	S	*	*			trans	56.8	92.3	-177.1	61.1	0	0	0	0	114.6
1059	R	34.1	Very low	40.3	Very low	244 Å²	244	138.4 Å²	138.4	92%	0.921	70%	0.697	S	S	*	*				56.9	138	50.6	-74.7	-169.5	177.7	-172.4	0.8	115.1
1060	P	35.5	Very low	39.1	Very low	125 Å²	125	141.2 Å²	141.2	81%	0.812	72%	0.718	S	S	*	*			trans	-90.2	141	-167.9	35.4	-34.6	0	0	0	113.2
1061	S	34.3	Very low	38	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	72%	0.719	S	S	*	*			trans	-156.3	122.9	156.6	55.1	0	0	0	0	113.3
1062	S	33.2	Very low	36.7	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	71%	0.713	S	S	*	*			trans	19	141.6	138.3	58.5	0	0	0	0	122.2
1063	Q	36.7	Very low	36.5	Very low	172 Å²	172	134 Å²	134	80%	0.804	71%	0.709	S	S	*	*			trans	76.7	107.4	157.4	-63.3	170.4	9.5	0	0	115.9	R1065	Q1063-R1065 PolarHBondContact O-N 3Å
1064	K	34.2	Very low	35.7	Very low	156 Å²	156	141.7 Å²	141.7	68%	0.678	73%	0.729	S	S	*	*				54.2	60.8	86.3	-65.4	-179.5	-176.7	168.4	0	113.4
1065	R	33.1	Very low	35.2	Very low	227 Å²	227	138.3 Å²	138.3	86%	0.857	72%	0.724	S	S	*	*				-70.2	126.3	125.9	-113.3	-175.4	177.8	177	0.4	108.2	Q1063	Q1063-R1065 PolarHBondContact O-N 3Å
1066	V	36.1	Very low	35.1	Very low	101 Å²	101	144 Å²	144	61%	0.612	73%	0.729	S	S	*	*				38.5	98.5	123.7	-178	0	0	0	0	112.9	F1068	V1066-F1068 HydrophobicContact CG1-CB 4.31Å; V1066-F1068 HydrophobicContact CG1-CD2 4.43Å
1067	R	34.2	Very low	35	Very low	177 Å²	177	139.8 Å²	139.8	67%	0.668	72%	0.72	S	S	*	*			cis	51.6	36.1	20	-71.6	-176	170.4	-155.8	-6.6	113.3	S1069	R1067-S1069 WeakPolarHBondContact O-CB 3.37Å; R1067-S1069 PolarHBondContact O-OG 3.17Å
1068	F	31.5	Very low	35.1	Very low	177 Å²	177	137.3 Å²	137.3	78%	0.776	71%	0.71	S	S	*	*				-91.8	91.9	109.9	-97.4	-79.8	0	0	0	103.8	V1066 S1070	V1066-F1068 HydrophobicContact CG1-CB 4.31Å; V1066-F1068 HydrophobicContact CG1-CD2 4.43Å; F1068-S1070 WeakPolarHBondContact CD1-OG 3.49Å; F1068-S1070 WeakPolarHBondContact CE1-OG 3.38Å
1069	S	32	Very low	35.5	Very low	74 Å²	74	138.5 Å²	138.5	52%	0.517	72%	0.718	S	S	.	*			cis	63.4	162.2	33.6	97.2	0	0	0	0	114.1	R1067	R1067-S1069 WeakPolarHBondContact O-CB 3.37Å; R1067-S1069 PolarHBondContact O-OG 3.17Å
1070	S	31	Very low	36	Very low	74 Å²	74	136.9 Å²	136.9	52%	0.517	72%	0.717	S	S	.	*			trans	56.7	114	170	58	0	0	0	0	116.2	F1068	F1068-S1070 WeakPolarHBondContact CD1-OG 3.49Å; F1068-S1070 WeakPolarHBondContact CE1-OG 3.38Å
1071	S	27.3	Very low	37.1	Very low	89 Å²	89	136.8 Å²	136.8	62%	0.622	71%	0.714	S	S	*	*			trans	58.4	116.5	141.4	62	0	0	0	0	118.5
1072	T	28.8	Very low	38.3	Very low	117 Å²	117	135.3 Å²	135.3	72%	0.718	70%	0.702	S	S	*	*			trans	65.2	172.4	140.1	54.4	0	0	0	0	117.1
1073	D	49.6	Very low	39.6	Very low	81 Å²	81	134 Å²	134	43%	0.433	69%	0.692	S	S	.	*				15.9	138.7	120.3	-39.9	-36.3	0	0	0	115.9	S1078	D1073-S1078 PolarHBondContact OD2-N 3.49Å
1074	R	29.7	Very low	41.3	Very low	244 Å²	244	136.5 Å²	136.5	92%	0.921	69%	0.694	S	S	*	*	S	Bend		-134.5	136.6	71.5	-65.8	130	-172.3	-144.4	2.4	110.3
1075	S	36.7	Very low	42.8	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	69%	0.691	S	S	*	*	S	Bend	cis	-158.4	150.1	1.6	55.2	0	0	0	0	107.5
1076	R	41.2	Very low	44.5	Very low	227 Å²	227	128 Å²	128	86%	0.857	67%	0.67	S	S	*	*	S	Bend	cis	-141.8	129.2	33.4	-62.5	167.5	171.1	167.9	-5.9	111.8
1077	S	39.7	Very low	46.1	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	67%	0.666	S	S	*	*			trans	94.6	77.5	152.4	-42.3	0	0	0	0	123.2
1078	S	40.7	Very low	48	Very low	87 Å²	87	124.3 Å²	124.3	61%	0.608	68%	0.677	S	S	*	*				38.9	126.9	124.1	67	0	0	0	0	124.3	D1073	D1073-S1078 PolarHBondContact OD2-N 3.49Å
1079	S	45.4	Very low	49.8	Very low	132 Å²	132	117.8 Å²	117.8	92%	0.923	65%	0.651	S	S	*	*				179.1	160.5	121.6	49.3	0	0	0	0	113.6
1080	K	46.2	Very low	51.8	Low	209 Å²	209	120 Å²	120	91%	0.909	66%	0.658	S	S	*	*			trans	-87.6	129.9	-165.8	-60.5	166	179.4	171.6	0	113.6
1081	V	57.9	Low	53.5	Low	123 Å²	123	124.5 Å²	124.5	75%	0.745	67%	0.67	S	S	*	*			trans	167.7	132.7	143.8	148.2	0	0	0	0	108.7
1082	P	59.8	Low	55.5	Low	79 Å²	79	129.6 Å²	129.6	51%	0.513	68%	0.681	S	S	.	*			trans	-70.6	140.7	171.9	29.4	-32.6	0	0	0	110.3	Q1087	P1082-Q1087 HydrophobicContact CG-CG 4.38Å; P1082-Q1087 PolarHBondContact O-NE2 3.32Å
1083	P	60.2	Low	57.8	Low	72 Å²	72	127 Å²	127	47%	0.468	67%	0.665	S	S	.	*			trans	-63.6	141.5	-174.9	28.2	-35.1	0	0	0	111.4	D1085 E1086	P1083-D1085 WeakPolarHBondContact CB-OD1 3.3Å; P1083-D1085 PolarHBondContact O-N 3.5Å; P1083-D1085 VanDerWaalsContact O-N 3.11Å; P1083-E1086 HydrophobicContact CG-CG 4.15Å; P1083-E1086 PolarHBondContact O-N 2.94Å
1084	R	72.3	Confident	59	Low	224 Å²	224	126.6 Å²	126.6	85%	0.845	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-26.1	-164.7	-175.2	179.3	178.2	-176.2	1.6	114.1	E1086 Q1087	R1084-E1086 PolarHBondContact O-N 3.26Å; R1084-Q1087 PolarHBondContact O-N 3.08Å
1085	D	65.8	Low	61.2	Low	117 Å²	117	123.7 Å²	123.7	63%	0.626	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-12.3	177.4	60.5	-48.7	0	0	0	114	P1083	P1083-D1085 WeakPolarHBondContact CB-OD1 3.3Å; P1083-D1085 PolarHBondContact O-N 3.5Å; P1083-D1085 VanDerWaalsContact O-N 3.11Å
1086	E	68.1	Low	63.3	Low	87 Å²	87	125.8 Å²	125.8	41%	0.407	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	-16.8	174.9	-53.5	-158.4	165.6	0	0	113.3	P1083 R1084 G1088 K1094	P1083-E1086 HydrophobicContact CG-CG 4.15Å; P1083-E1086 PolarHBondContact O-N 2.94Å; R1084-E1086 PolarHBondContact O-N 3.26Å; E1086-G1088 PolarHBondContact O-N 2.88Å; E1086-K1094 VanDerWaalsContact CD-CE 3.5Å; E1086-K1094 VanDerWaalsContact OE1-CE 3.23Å; E1086-K1094 WeakPolarHBondContact OE1-CE 3.24Å; E1086-K1094 IonicContact OE1-NZ 3.22Å; E1086-K1094 PolarHBondContact OE1-NZ 3.24Å; E1086-K1094 IonicContact OE2-NZ 3.84Å; E1086-K1094 PolarHBondContact OE2-NZ 3.33Å
1087	Q	69.8	Low	65.2	Low	113 Å²	113	117.6 Å²	117.6	53%	0.528	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.7	121.3	176.4	-66	-176.8	-9	0	0	110.6	P1082 R1084	P1082-Q1087 HydrophobicContact CG-CG 4.38Å; P1082-Q1087 PolarHBondContact O-NE2 3.32Å; R1084-Q1087 PolarHBondContact O-N 3.08Å
1088	G	75.1	Confident	67.2	Low	87 Å²	87	116.3 Å²	116.3	90%	0.897	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.2	6.3	175.8	0	0	0	0	0	116.3	E1086	E1086-G1088 PolarHBondContact O-N 2.88Å
1089	V	69.2	Low	69.2	Low	41 Å²	41	115 Å²	115	25%	0.248	60%	0.604	C	S	.	*			trans	-113.4	115.5	-178	-173	0	0	0	0	112.3	V1093 K1094 V1097	V1089-V1093 HydrophobicContact CG1-CB 4.33Å; V1089-K1094 HydrophobicContact CG1-CB 4.15Å; V1089-V1097 HydrophobicContact CG1-CB 4.01Å; V1089-V1097 HydrophobicContact CG1-CG2 3.51Å; V1089-V1097 HydrophobicContact CG2-CG1 4.32Å; V1089-V1097 HydrophobicContact CG2-CG2 4.18Å
1090	N	72.7	Confident	71.1	Confident	121 Å²	121	114.1 Å²	114.1	65%	0.647	59%	0.586	S	S	*	*			trans	-64.5	142.6	176.4	-168.3	-17.4	0	0	0	111.5	K1092 V1093 K1094	N1090-K1092 PolarHBondContact O-N 2.99Å; N1090-V1093 HydrophobicContact CB-CG2 4.01Å; N1090-V1093 CarbonylContact O-C 3.52Å; N1090-V1093 VanDerWaalsContact O-CA 3.24Å; N1090-V1093 WeakPolarHBondContact O-CA 3.47Å; N1090-V1093 VanDerWaalsContact O-CB 3.3Å; N1090-V1093 WeakPolarHBondContact O-CB 3.28Å; N1090-V1093 PolarHBondContact O-N 3.16Å; N1090-K1094 PolarHBondContact O-N 3.41Å
1091	E	67.8	Low	72.9	Confident	168 Å²	168	105.7 Å²	105.7	79%	0.785	56%	0.559	S	S	*	*	H	α-helix	trans	-57.6	-45.1	-163.2	-128.3	-169.2	-178.9	0	0	114.3	V1093 K1094	E1091-V1093 PolarHBondContact O-N 3.02Å; E1091-K1094 VanDerWaalsContact O-CB 3.32Å; E1091-K1094 WeakPolarHBondContact O-CB 3.37Å; E1091-K1094 PolarHBondContact O-N 3.4Å; E1091-K1094 VanDerWaalsContact O-N 3.13Å
1092	K	68	Low	74.2	Confident	195 Å²	195	108.3 Å²	108.3	85%	0.848	56%	0.556	S	S	*	*	H	α-helix	trans	-60.5	-30.9	174.2	-67.2	179.6	179.6	176.4	0	111.9	N1090	N1090-K1092 PolarHBondContact O-N 2.99Å
1093	V	77.3	Confident	75.4	Confident	63 Å²	63	111.1 Å²	111.1	38%	0.382	56%	0.559	S	S	.	*	H	α-helix	trans	-86.8	-21.7	-180	-156	0	0	0	0	111	V1089 N1090 E1091 K1095 K1096 V1097	V1089-V1093 HydrophobicContact CG1-CB 4.33Å; N1090-V1093 HydrophobicContact CB-CG2 4.01Å; N1090-V1093 CarbonylContact O-C 3.52Å; N1090-V1093 VanDerWaalsContact O-CA 3.24Å; N1090-V1093 WeakPolarHBondContact O-CA 3.47Å; N1090-V1093 VanDerWaalsContact O-CB 3.3Å; N1090-V1093 WeakPolarHBondContact O-CB 3.28Å; N1090-V1093 PolarHBondContact O-N 3.16Å; E1091-V1093 PolarHBondContact O-N 3.02Å; V1093-K1095 PolarHBondContact O-N 3.47Å; V1093-K1096 HydrophobicContact CG1-CB 4.27Å; V1093-K1096 CarbonylContact O-C 3.57Å; V1093-K1096 VanDerWaalsContact O-CA 3.25Å; V1093-K1096 WeakPolarHBondContact O-CA 3.34Å; V1093-K1096 VanDerWaalsContact O-CB 3.28Å; V1093-K1096 WeakPolarHBondContact O-CB 3.09Å; V1093-K1096 PolarHBondContact O-N 3.18Å; V1093-V1097 HydrophobicContact CG1-CG2 4.04Å; V1093-V1097 PolarHBondContact O-N 2.9Å
1094	K	75.3	Confident	76.7	Confident	73 Å²	73	110.8 Å²	110.8	32%	0.317	56%	0.563	S	S	.	*	H	α-helix	trans	-52.6	-49.8	178.9	-169	173.5	178.5	178.5	0	112.8	E1086 V1089 N1090 E1091 K1096 V1097 V1098	E1086-K1094 VanDerWaalsContact CD-CE 3.5Å; E1086-K1094 VanDerWaalsContact OE1-CE 3.23Å; E1086-K1094 WeakPolarHBondContact OE1-CE 3.24Å; E1086-K1094 IonicContact OE1-NZ 3.22Å; E1086-K1094 PolarHBondContact OE1-NZ 3.24Å; E1086-K1094 IonicContact OE2-NZ 3.84Å; E1086-K1094 PolarHBondContact OE2-NZ 3.33Å; V1089-K1094 HydrophobicContact CG1-CB 4.15Å; N1090-K1094 PolarHBondContact O-N 3.41Å; E1091-K1094 VanDerWaalsContact O-CB 3.32Å; E1091-K1094 WeakPolarHBondContact O-CB 3.37Å; E1091-K1094 PolarHBondContact O-N 3.4Å; E1091-K1094 VanDerWaalsContact O-N 3.13Å; K1094-K1096 VanDerWaalsContact C-N 3.26Å; K1094-K1096 PolarHBondContact O-N 3.12Å; K1094-V1097 PolarHBondContact O-N 3.3Å; K1094-V1098 WeakPolarHBondContact O-CG2 3.29Å; K1094-V1098 PolarHBondContact O-N 2.85Å
1095	K	76.3	Confident	77.3	Confident	182 Å²	182	104.8 Å²	104.8	79%	0.791	55%	0.545	S	S	*	.	H	α-helix	trans	-60.5	-34.1	172.4	-75.5	-178.8	179.1	174.3	0	112.7	V1093 S1099	V1093-K1095 PolarHBondContact O-N 3.47Å; K1095-S1099 VanDerWaalsContact O-CB 3.27Å; K1095-S1099 WeakPolarHBondContact O-CB 3.17Å; K1095-S1099 PolarHBondContact O-N 3.34Å
1096	K	80.2	Confident	78.3	Confident	143 Å²	143	105.7 Å²	105.7	62%	0.622	54%	0.543	S	S	*	.	H	α-helix	trans	-74.2	-41.5	178.2	-156	169.8	-177	178.5	0	111.6	V1093 K1094 S1099 M1100	V1093-K1096 HydrophobicContact CG1-CB 4.27Å; V1093-K1096 CarbonylContact O-C 3.57Å; V1093-K1096 VanDerWaalsContact O-CA 3.25Å; V1093-K1096 WeakPolarHBondContact O-CA 3.34Å; V1093-K1096 VanDerWaalsContact O-CB 3.28Å; V1093-K1096 WeakPolarHBondContact O-CB 3.09Å; V1093-K1096 PolarHBondContact O-N 3.18Å; K1094-K1096 VanDerWaalsContact C-N 3.26Å; K1094-K1096 PolarHBondContact O-N 3.12Å; K1096-S1099 CarbonylContact O-C 3.58Å; K1096-S1099 WeakPolarHBondContact O-CB 3.23Å; K1096-S1099 PolarHBondContact O-N 2.98Å; K1096-M1100 WeakPolarHBondContact O-CB 3.26Å; K1096-M1100 VanDerWaalsContact O-CG 3.26Å; K1096-M1100 WeakPolarHBondContact O-CG 3.35Å; K1096-M1100 PolarHBondContact O-N 3.4Å
1097	V	81.2	Confident	79.2	Confident	55 Å²	55	104.9 Å²	104.9	33%	0.333	55%	0.545	S	S	.	.	H	α-helix	trans	-64.3	-46	174	175.7	0	0	0	0	110.9	V1089 V1093 K1094 S1099 M1100 G1101	V1089-V1097 HydrophobicContact CG1-CB 4.01Å; V1089-V1097 HydrophobicContact CG1-CG2 3.51Å; V1089-V1097 HydrophobicContact CG2-CG1 4.32Å; V1089-V1097 HydrophobicContact CG2-CG2 4.18Å; V1093-V1097 HydrophobicContact CG1-CG2 4.04Å; V1093-V1097 PolarHBondContact O-N 2.9Å; K1094-V1097 PolarHBondContact O-N 3.3Å; V1097-S1099 VanDerWaalsContact C-N 3.28Å; V1097-S1099 PolarHBondContact O-N 3.41Å; V1097-M1100 CarbonylContact O-C 3.45Å; V1097-M1100 PolarHBondContact O-N 3.31Å; V1097-M1100 VanDerWaalsContact O-N 3.11Å; V1097-G1101 PolarHBondContact O-N 2.85Å
1098	V	81.7	Confident	80	Confident	72 Å²	72	102.1 Å²	102.1	44%	0.436	53%	0.534	S	S	.	.	H	α-helix	trans	-60.6	-39	174.1	174	0	0	0	0	111.2	K1094 R1102	K1094-V1098 WeakPolarHBondContact O-CG2 3.29Å; K1094-V1098 PolarHBondContact O-N 2.85Å; V1098-R1102 WeakPolarHBondContact O-CB 3.33Å; V1098-R1102 WeakPolarHBondContact O-CG 3.49Å; V1098-R1102 PolarHBondContact O-N 3.23Å
1099	S	83.3	Confident	80.5	Confident	58 Å²	58	103.6 Å²	103.6	41%	0.406	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-40.4	173.4	-173.2	0	0	0	0	112.6	K1095 K1096 V1097 R1102 K1103	K1095-S1099 VanDerWaalsContact O-CB 3.27Å; K1095-S1099 WeakPolarHBondContact O-CB 3.17Å; K1095-S1099 PolarHBondContact O-N 3.34Å; K1096-S1099 CarbonylContact O-C 3.58Å; K1096-S1099 WeakPolarHBondContact O-CB 3.23Å; K1096-S1099 PolarHBondContact O-N 2.98Å; V1097-S1099 VanDerWaalsContact C-N 3.28Å; V1097-S1099 PolarHBondContact O-N 3.41Å; S1099-R1102 PolarHBondContact O-N 3.07Å; S1099-K1103 WeakPolarHBondContact O-CG 3.29Å; S1099-K1103 PolarHBondContact O-N 3.39Å
1100	M	84.7	Confident	81.3	Confident	114 Å²	114	112.3 Å²	112.3	56%	0.562	55%	0.546	S	S	*	.	H	α-helix	trans	-67.6	-41.4	175	-69.2	-149.1	-56.3	0	0	112	K1096 V1097 K1103 A1104	K1096-M1100 WeakPolarHBondContact O-CB 3.26Å; K1096-M1100 VanDerWaalsContact O-CG 3.26Å; K1096-M1100 WeakPolarHBondContact O-CG 3.35Å; K1096-M1100 PolarHBondContact O-N 3.4Å; V1097-M1100 CarbonylContact O-C 3.45Å; V1097-M1100 PolarHBondContact O-N 3.31Å; V1097-M1100 VanDerWaalsContact O-N 3.11Å; M1100-K1103 CarbonylContact O-C 3.57Å; M1100-K1103 WeakPolarHBondContact O-CA 3.32Å; M1100-K1103 WeakPolarHBondContact O-CB 3.29Å; M1100-K1103 PolarHBondContact O-N 3.21Å; M1100-K1103 VanDerWaalsContact O-N 3.13Å; M1100-A1104 WeakPolarHBondContact O-CB 3.36Å; M1100-A1104 PolarHBondContact O-N 2.95Å
1101	G	84.3	Confident	81.9	Confident	32 Å²	32	113.5 Å²	113.5	33%	0.33	55%	0.545	S	S	.	.	H	α-helix	trans	-60.2	-45.8	173.2	0	0	0	0	0	111.7	V1097 K1103 A1104 Q1105	V1097-G1101 PolarHBondContact O-N 2.85Å; G1101-K1103 VanDerWaalsContact C-N 3.32Å; G1101-K1103 PolarHBondContact O-N 3.02Å; G1101-A1104 PolarHBondContact O-N 3.06Å; G1101-Q1105 WeakPolarHBondContact O-CG 3.5Å; G1101-Q1105 PolarHBondContact O-N 3.28Å
1102	R	84.4	Confident	82.7	Confident	179 Å²	179	109.8 Å²	109.8	68%	0.675	54%	0.543	S	S	*	.	H	α-helix	trans	-62	-35.5	172.5	-72.5	178.3	-178.1	-166.8	1.1	112.8	V1098 S1099 K1106	V1098-R1102 WeakPolarHBondContact O-CB 3.33Å; V1098-R1102 WeakPolarHBondContact O-CG 3.49Å; V1098-R1102 PolarHBondContact O-N 3.23Å; S1099-R1102 PolarHBondContact O-N 3.07Å; R1102-K1106 PolarHBondContact O-N 2.92Å
1103	K	86.6	Confident	83.6	Confident	137 Å²	137	103.9 Å²	103.9	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-68.5	-43.2	172.3	-77.5	-178.9	178.7	-175.8	0	112	S1099 M1100 G1101 Q1105 K1106	S1099-K1103 WeakPolarHBondContact O-CG 3.29Å; S1099-K1103 PolarHBondContact O-N 3.39Å; M1100-K1103 CarbonylContact O-C 3.57Å; M1100-K1103 WeakPolarHBondContact O-CA 3.32Å; M1100-K1103 WeakPolarHBondContact O-CB 3.29Å; M1100-K1103 PolarHBondContact O-N 3.21Å; M1100-K1103 VanDerWaalsContact O-N 3.13Å; G1101-K1103 VanDerWaalsContact C-N 3.32Å; G1101-K1103 PolarHBondContact O-N 3.02Å; K1103-Q1105 VanDerWaalsContact C-N 3.29Å; K1103-Q1105 PolarHBondContact O-N 3.34Å; K1103-K1106 WeakPolarHBondContact O-CB 3.33Å; K1103-K1106 PolarHBondContact O-N 3.27Å; K1103-K1106 VanDerWaalsContact O-N 3.13Å
1104	A	85.6	Confident	83.9	Confident	66 Å²	66	108.7 Å²	108.7	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-30.6	178.3	0	0	0	0	0	112.6	M1100 G1101 P1107	M1100-A1104 WeakPolarHBondContact O-CB 3.36Å; M1100-A1104 PolarHBondContact O-N 2.95Å; G1101-A1104 PolarHBondContact O-N 3.06Å; A1104-P1107 VanDerWaalsContact O-CD 3.24Å; A1104-P1107 WeakPolarHBondContact O-CD 3.38Å; A1104-P1107 VanDerWaalsContact O-CG 3.27Å; A1104-P1107 WeakPolarHBondContact O-CG 3.36Å
1105	Q	85.6	Confident	84.4	Confident	98 Å²	98	106.4 Å²	106.4	46%	0.458	53%	0.534	S	S	.	.	H	α-helix	trans	-74.3	-20.6	173	-72.7	178.5	-0.5	0	0	113.9	G1101 K1103 L1108 Q1109	G1101-Q1105 WeakPolarHBondContact O-CG 3.5Å; G1101-Q1105 PolarHBondContact O-N 3.28Å; K1103-Q1105 VanDerWaalsContact C-N 3.29Å; K1103-Q1105 PolarHBondContact O-N 3.34Å; Q1105-L1108 WeakPolarHBondContact O-CB 3.32Å; Q1105-L1108 PolarHBondContact O-N 2.92Å; Q1105-Q1109 WeakPolarHBondContact O-CG 3.5Å; Q1105-Q1109 PolarHBondContact O-N 3.47Å
1106	K	86.7	Confident	84.8	Confident	135 Å²	135	105.2 Å²	105.2	59%	0.587	53%	0.531	S	S	*	.	H	α-helix	trans	-52.6	-46.3	179.2	-72.6	-167.9	174.8	-170.4	0	114.6	R1102 K1103 L1108 Q1109 R1110	R1102-K1106 PolarHBondContact O-N 2.92Å; K1103-K1106 WeakPolarHBondContact O-CB 3.33Å; K1103-K1106 PolarHBondContact O-N 3.27Å; K1103-K1106 VanDerWaalsContact O-N 3.13Å; K1106-L1108 VanDerWaalsContact C-N 3.31Å; K1106-L1108 PolarHBondContact O-N 3.23Å; K1106-Q1109 PolarHBondContact O-N 3.14Å; K1106-R1110 VanDerWaalsContact O-CB 3.3Å; K1106-R1110 WeakPolarHBondContact O-CB 3.48Å; K1106-R1110 PolarHBondContact O-N 3.47Å
1107	P	87.2	Confident	85	Confident	70 Å²	70	103.3 Å²	103.3	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-28.6	175.8	23.2	-35.3	0	0	0	114.3	A1104 K1111	A1104-P1107 VanDerWaalsContact O-CD 3.24Å; A1104-P1107 WeakPolarHBondContact O-CD 3.38Å; A1104-P1107 VanDerWaalsContact O-CG 3.27Å; A1104-P1107 WeakPolarHBondContact O-CG 3.36Å; P1107-K1111 WeakPolarHBondContact O-CG 3.34Å; P1107-K1111 PolarHBondContact O-N 2.98Å
1108	L	86.2	Confident	85.3	Confident	56 Å²	56	102.3 Å²	102.3	29%	0.293	53%	0.529	S	S	.	.	H	α-helix	trans	-72.3	-48	173.3	-66.8	169.9	0	0	0	110.6	Q1105 K1106 R1110 K1111 A1112 R1113 E1116	Q1105-L1108 WeakPolarHBondContact O-CB 3.32Å; Q1105-L1108 PolarHBondContact O-N 2.92Å; K1106-L1108 VanDerWaalsContact C-N 3.31Å; K1106-L1108 PolarHBondContact O-N 3.23Å; L1108-R1110 PolarHBondContact O-N 2.89Å; L1108-K1111 CarbonylContact O-C 3.36Å; L1108-K1111 WeakPolarHBondContact O-CA 3.33Å; L1108-K1111 PolarHBondContact O-N 2.82Å; L1108-A1112 PolarHBondContact O-N 3.4Å; L1108-R1113 HydrophobicContact CB-CB 4.31Å; L1108-R1113 HydrophobicContact CD2-CB 4.34Å; L1108-R1113 HydrophobicContact CD2-CG 4.3Å; L1108-R1113 PolarHBondContact O-N 3.49Å; L1108-E1116 HydrophobicContact CD1-CB 4.17Å
1109	Q	85.5	Confident	85.5	Confident	118 Å²	118	108.8 Å²	108.8	55%	0.551	55%	0.546	S	S	*	.	H	α-helix	trans	-60.8	-40.9	175.7	-67.8	171.5	4.7	0	0	111.9	Q1105 K1106 K1111 A1112	Q1105-Q1109 WeakPolarHBondContact O-CG 3.5Å; Q1105-Q1109 PolarHBondContact O-N 3.47Å; K1106-Q1109 PolarHBondContact O-N 3.14Å; Q1109-K1111 PolarHBondContact O-N 3.09Å; Q1109-A1112 WeakPolarHBondContact O-CA 3.44Å; Q1109-A1112 PolarHBondContact O-N 2.84Å
1110	R	87.1	Confident	85.6	Confident	223 Å²	223	115.7 Å²	115.7	84%	0.842	56%	0.563	S	S	*	*	H	α-helix	trans	-63.6	-25	174.4	-164.4	-180	81.5	166.5	3.7	112.8	K1106 L1108	K1106-R1110 VanDerWaalsContact O-CB 3.3Å; K1106-R1110 WeakPolarHBondContact O-CB 3.48Å; K1106-R1110 PolarHBondContact O-N 3.47Å; L1108-R1110 PolarHBondContact O-N 2.89Å
1111	K	84.8	Confident	85.6	Confident	147 Å²	147	117.6 Å²	117.6	64%	0.639	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	6.6	173.3	-71.1	175.4	-179.6	176.2	0	112.8	P1107 L1108 Q1109 R1113	P1107-K1111 WeakPolarHBondContact O-CG 3.34Å; P1107-K1111 PolarHBondContact O-N 2.98Å; L1108-K1111 CarbonylContact O-C 3.36Å; L1108-K1111 WeakPolarHBondContact O-CA 3.33Å; L1108-K1111 PolarHBondContact O-N 2.82Å; Q1109-K1111 PolarHBondContact O-N 3.09Å; K1111-R1113 HydrophobicContact CB-CG 3.93Å; K1111-R1113 PolarHBondContact O-N 3.18Å
1112	A	85.4	Confident	85.6	Confident	89 Å²	89	120 Å²	120	74%	0.736	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.8	35.7	-175.4	0	0	0	0	0	114.1	L1108 Q1109	L1108-A1112 PolarHBondContact O-N 3.4Å; Q1109-A1112 WeakPolarHBondContact O-CA 3.44Å; Q1109-A1112 PolarHBondContact O-N 2.84Å
1113	R	85.6	Confident	85.7	Confident	71 Å²	71	116 Å²	116	27%	0.268	58%	0.582	S	S	.	*			trans	-75.6	140.2	176.8	-63.6	-57.7	-169	159.8	1.7	110.9	L1108 K1111 G1115 D1118 R1120	L1108-R1113 HydrophobicContact CB-CB 4.31Å; L1108-R1113 HydrophobicContact CD2-CB 4.34Å; L1108-R1113 HydrophobicContact CD2-CG 4.3Å; L1108-R1113 PolarHBondContact O-N 3.49Å; K1111-R1113 HydrophobicContact CB-CG 3.93Å; K1111-R1113 PolarHBondContact O-N 3.18Å; R1113-G1115 VanDerWaalsContact C-N 3.27Å; R1113-G1115 PolarHBondContact O-N 3.17Å; R1113-D1118 WeakPolarHBondContact CA-OD2 3.19Å; R1113-D1118 HydrophobicContact CB-CB 4.34Å; R1113-D1118 WeakPolarHBondContact CD-O 3.42Å; R1113-D1118 WeakPolarHBondContact CD-OD2 3.3Å; R1113-D1118 IonicContact CZ-OD1 3.88Å; R1113-D1118 PolarHBondContact NH1-O 2.91Å; R1113-D1118 IonicContact NH1-OD1 3.84Å; R1113-D1118 PolarHBondContact NH1-OD1 3.1Å; R1113-D1118 IonicContact NH1-OD2 2.72Å; R1113-D1118 PolarHBondContact NH1-OD2 3.08Å; R1113-R1120 VanDerWaalsContact CZ-O 3.28Å; R1113-R1120 PolarHBondContact NH1-O 2.9Å; R1113-R1120 PolarHBondContact NH2-O 3.1Å
1114	I	84.9	Confident	85.6	Confident	165 Å²	165	118.6 Å²	118.6	85%	0.846	59%	0.593	S	S	*	*	S	Bend	trans	-64.6	-35.4	-179.5	-58.5	174.5	0	0	0	110.9	D1118	I1114-D1118 HydrophobicContact CB-CB 4.26Å; I1114-D1118 PolarHBondContact N-OD2 3.4Å
1115	G	84.6	Confident	85.7	Confident	24 Å²	24	123.1 Å²	123.1	25%	0.247	60%	0.601	C	S	.	*	S	Bend	trans	-171.7	-172.4	176.1	0	0	0	0	0	111	R1113 S1117 D1118	R1113-G1115 VanDerWaalsContact C-N 3.27Å; R1113-G1115 PolarHBondContact O-N 3.17Å; G1115-S1117 PolarHBondContact O-N 2.86Å; G1115-D1118 PolarHBondContact O-N 3.39Å; G1115-D1118 VanDerWaalsContact O-N 3.13Å
1116	E	86	Confident	85.8	Confident	157 Å²	157	119.9 Å²	119.9	73%	0.734	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-22.5	175.5	62.9	-171.9	-177.5	0	0	113.8	L1108	L1108-E1116 HydrophobicContact CD1-CB 4.17Å
1117	S	84	Confident	86	Confident	103 Å²	103	121.9 Å²	121.9	72%	0.72	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-21.1	172.3	43.8	0	0	0	0	113.4	G1115 R1119	G1115-S1117 PolarHBondContact O-N 2.86Å; S1117-R1119 VanDerWaalsContact C-N 3.26Å; S1117-R1119 PolarHBondContact O-N 3.41Å
1118	D	87.5	Confident	86	Confident	35 Å²	35	124.8 Å²	124.8	19%	0.187	60%	0.604	C	S	.	*			trans	-79.5	72.9	176.9	178.8	17.3	0	0	0	111.7	R1113 I1114 G1115	R1113-D1118 WeakPolarHBondContact CA-OD2 3.19Å; R1113-D1118 HydrophobicContact CB-CB 4.34Å; R1113-D1118 WeakPolarHBondContact CD-O 3.42Å; R1113-D1118 WeakPolarHBondContact CD-OD2 3.3Å; R1113-D1118 IonicContact CZ-OD1 3.88Å; R1113-D1118 PolarHBondContact NH1-O 2.91Å; R1113-D1118 IonicContact NH1-OD1 3.84Å; R1113-D1118 PolarHBondContact NH1-OD1 3.1Å; R1113-D1118 IonicContact NH1-OD2 2.72Å; R1113-D1118 PolarHBondContact NH1-OD2 3.08Å; I1114-D1118 HydrophobicContact CB-CB 4.26Å; I1114-D1118 PolarHBondContact N-OD2 3.4Å; G1115-D1118 PolarHBondContact O-N 3.39Å; G1115-D1118 VanDerWaalsContact O-N 3.13Å
1119	R	86.1	Confident	86	Confident	208 Å²	208	126.4 Å²	126.4	79%	0.785	61%	0.612	S	S	*	*			trans	-92.7	10.6	173.6	-72.2	-177.6	-96.8	174.8	-3.2	113.3	S1117 I1121	S1117-R1119 VanDerWaalsContact C-N 3.26Å; S1117-R1119 PolarHBondContact O-N 3.41Å; R1119-I1121 PolarHBondContact O-N 3.29Å
1120	R	84.6	Confident	86.1	Confident	202 Å²	202	127.3 Å²	127.3	76%	0.762	62%	0.615	S	S	*	*			trans	-59.9	120.4	-176.3	-172.2	179.5	-176.3	-170.3	3.3	111	R1113 P1122	R1113-R1120 VanDerWaalsContact CZ-O 3.28Å; R1113-R1120 PolarHBondContact NH1-O 2.9Å; R1113-R1120 PolarHBondContact NH2-O 3.1Å; R1120-P1122 VanDerWaalsContact O-CD 3.27Å; R1120-P1122 WeakPolarHBondContact O-CD 3.34Å
1121	I	85.5	Confident	86	Confident	154 Å²	154	119 Å²	119	79%	0.79	59%	0.593	S	S	*	*			trans	-87.4	110.2	171.8	-57.8	177.7	0	0	0	107.6	R1119 C1123	R1119-I1121 PolarHBondContact O-N 3.29Å; I1121-C1123 PolarHBondContact O-N 2.87Å
1122	P	82.8	Confident	85.9	Confident	83 Å²	83	115.2 Å²	115.2	54%	0.539	60%	0.597	S	S	.	*			trans	-68.1	127.9	173.6	28.3	-33.3	0	0	0	109.2	R1120 K1124	R1120-P1122 VanDerWaalsContact O-CD 3.27Å; R1120-P1122 WeakPolarHBondContact O-CD 3.34Å; P1122-K1124 PolarHBondContact O-N 3.06Å
1123	C	87.1	Confident	85.7	Confident	94 Å²	94	121 Å²	121	64%	0.635	61%	0.605	S	S	*	*			trans	-64.6	108.4	173.2	-175.3	0	0	0	0	108.9	I1121 K1125 P1126	I1121-C1123 PolarHBondContact O-N 2.87Å; C1123-K1125 VanDerWaalsContact C-N 3.28Å; C1123-K1125 PolarHBondContact O-N 3.17Å; C1123-P1126 WeakPolarHBondContact O-CD 3.16Å
1124	K	84.7	Confident	85.4	Confident	193 Å²	193	125 Å²	125	84%	0.839	62%	0.62	S	S	*	*	S	Bend	trans	-68.9	-25.8	-176.8	-67.4	-177.1	178.9	178.1	0	113.3	P1122	P1122-K1124 PolarHBondContact O-N 3.06Å
1125	K	88.2	Confident	85.3	Confident	161 Å²	161	120 Å²	120	70%	0.7	61%	0.61	S	S	*	*	S	Bend	trans	-136.3	71.8	-179.2	-69	-173.8	177.8	-178.4	0	110.6	C1123 K1127 F1130	C1123-K1125 VanDerWaalsContact C-N 3.28Å; C1123-K1125 PolarHBondContact O-N 3.17Å; K1125-K1127 PolarHBondContact O-N 3.08Å; K1125-F1130 HydrophobicContact CB-CD2 3.92Å; K1125-F1130 HydrophobicContact CB-CE2 4.18Å; K1125-F1130 HydrophobicContact CG-CD2 4.31Å; K1125-F1130 HydrophobicContact CG-CE2 4.25Å
1126	P	88.1	Confident	85.4	Confident	30 Å²	30	127.9 Å²	127.9	20%	0.195	64%	0.644	C	S	.	*			trans	-59.6	128.3	176.1	25	-35.6	0	0	0	110.9	C1123 H1128 L1129	C1123-P1126 WeakPolarHBondContact O-CD 3.16Å; P1126-H1128 VanDerWaalsContact C-N 3.26Å; P1126-H1128 PolarHBondContact O-N 3.44Å; P1126-H1128 VanDerWaalsContact O-N 3.12Å; P1126-L1129 HydrophobicContact CG-CB 4.18Å; P1126-L1129 HydrophobicContact CG-CD1 3.66Å; P1126-L1129 HydrophobicContact CG-CG 3.87Å; P1126-L1129 PolarHBondContact O-N 3.09Å
1127	K	89.3	Confident	85.3	Confident	177 Å²	177	123 Å²	123	77%	0.77	64%	0.636	S	S	*	*	H	α-helix	trans	-51.2	-41.5	-172	-171.5	175.8	178.5	-179.9	0	112.9	K1125 L1129 F1130 A1131	K1125-K1127 PolarHBondContact O-N 3.08Å; K1127-L1129 PolarHBondContact O-N 3.11Å; K1127-F1130 PolarHBondContact O-N 2.83Å; K1127-A1131 HydrophobicContact CG-CB 3.88Å; K1127-A1131 VanDerWaalsContact O-CB 3.29Å; K1127-A1131 WeakPolarHBondContact O-CB 3.13Å; K1127-A1131 PolarHBondContact O-N 3.29Å
1128	H	87.7	Confident	85.1	Confident	131 Å²	131	128.7 Å²	128.7	61%	0.606	65%	0.648	S	S	*	*	H	α-helix	trans	-68.6	-11.1	-179.9	67.5	-103.8	0	0	0	115.5	P1126	P1126-H1128 VanDerWaalsContact C-N 3.26Å; P1126-H1128 PolarHBondContact O-N 3.44Å; P1126-H1128 VanDerWaalsContact O-N 3.12Å
1129	L	85.5	Confident	84.9	Confident	89 Å²	89	130.8 Å²	130.8	47%	0.466	66%	0.659	S	S	.	*	H	α-helix	trans	-96.4	-24.4	172	-64.9	-172.9	0	0	0	113.2	P1126 K1127	P1126-L1129 HydrophobicContact CG-CB 4.18Å; P1126-L1129 HydrophobicContact CG-CD1 3.66Å; P1126-L1129 HydrophobicContact CG-CG 3.87Å; P1126-L1129 PolarHBondContact O-N 3.09Å; K1127-L1129 PolarHBondContact O-N 3.11Å
1130	F	87.8	Confident	84.7	Confident	138 Å²	138	129 Å²	129	61%	0.605	66%	0.659	S	S	*	*	H	α-helix	trans	-120	-9.3	-169	-66.6	-78.9	0	0	0	114.6	K1125 K1127	K1125-F1130 HydrophobicContact CB-CD2 3.92Å; K1125-F1130 HydrophobicContact CB-CE2 4.18Å; K1125-F1130 HydrophobicContact CG-CD2 4.31Å; K1125-F1130 HydrophobicContact CG-CE2 4.25Å; K1127-F1130 PolarHBondContact O-N 2.83Å
1131	A	86.3	Confident	84.5	Confident	47 Å²	47	125.8 Å²	125.8	39%	0.388	65%	0.648	S	S	.	*	S	Bend	trans	-114.2	146.4	174.5	0	0	0	0	0	110.9	K1127	K1127-A1131 HydrophobicContact CG-CB 3.88Å; K1127-A1131 VanDerWaalsContact O-CB 3.29Å; K1127-A1131 WeakPolarHBondContact O-CB 3.13Å; K1127-A1131 PolarHBondContact O-N 3.29Å
1132	G	82.7	Confident	84.4	Confident	69 Å²	69	133.2 Å²	133.2	71%	0.711	67%	0.665	S	S	*	*	S	Bend	trans	84.4	160	-173.2	0	0	0	0	0	113.4
1133	K	81.1	Confident	84.4	Confident	211 Å²	211	135.7 Å²	135.7	92%	0.917	67%	0.672	S	S	*	*			trans	-117.6	148.1	172.3	-66.3	179.4	-179	175.9	0	108.4	G1135	K1133-G1135 PolarHBondContact O-N 2.69Å
1134	R	79.9	Confident	84.3	Confident	154 Å²	154	137.9 Å²	137.9	58%	0.581	67%	0.674	S	S	*	*			trans	-69.4	112.4	171	-83.6	-176.8	139.1	160.7	-2.4	109	N1139	R1134-N1139 PolarHBondContact NE-OD1 3.19Å
1135	G	82.5	Confident	84.3	Confident	61 Å²	61	134.8 Å²	134.8	63%	0.629	67%	0.665	S	S	*	*			trans	-83.1	179.1	167.4	0	0	0	0	0	112.1	K1133	K1133-G1135 PolarHBondContact O-N 2.69Å
1136	I	86.2	Confident	84.1	Confident	188 Å²	188	133.3 Å²	133.3	96%	0.964	66%	0.662	S	S	*	*	S	Bend	trans	-80.9	120.5	167.3	-61	171.1	0	0	0	107.3
1137	G	83.3	Confident	83.8	Confident	55 Å²	55	139.8 Å²	139.8	57%	0.567	69%	0.692	S	S	*	*	S	Bend	trans	135.6	-149.6	-179.1	0	0	0	0	0	113.6	N1139	G1137-N1139 PolarHBondContact O-N 2.92Å
1138	K	81.2	Confident	83.4	Confident	223 Å²	223	137.3 Å²	137.3	97%	0.97	69%	0.686	S	S	*	*			trans	-62.4	124.6	178.3	-72.7	-176.3	178.5	178	0	110.6
1139	N	82.9	Confident	83.1	Confident	79 Å²	79	137.7 Å²	137.7	42%	0.422	69%	0.692	S	S	.	*			trans	-86.8	144.4	176	-77.5	-70.2	0	0	0	111.3	R1134 G1137 R1141	R1134-N1139 PolarHBondContact NE-OD1 3.19Å; G1137-N1139 PolarHBondContact O-N 2.92Å; N1139-R1141 WeakPolarHBondContact CB-O 3.46Å; N1139-R1141 PolarHBondContact O-N 3.05Å; N1139-R1141 VanDerWaalsContact O-N 3.11Å
1140	Q	81.9	Confident	83	Confident	169 Å²	169	141.5 Å²	141.5	79%	0.79	71%	0.71	S	S	*	*	S	Bend	trans	-68.3	-2.9	173	-66.3	-179.7	-11.3	0	0	114.3
1141	R	80.8	Confident	82.6	Confident	136 Å²	136	141.8 Å²	141.8	51%	0.513	72%	0.718	S	S	.	*			trans	-147.8	140.7	178.4	52	-179.5	167.3	-176.8	-6.3	108.3	N1139	N1139-R1141 WeakPolarHBondContact CB-O 3.46Å; N1139-R1141 PolarHBondContact O-N 3.05Å; N1139-R1141 VanDerWaalsContact O-N 3.11Å
1142	R	81.8	Confident	82.2	Confident	309 Å²	309	150.4 Å²	150.4	100%	1.166	75%	0.748	S	S	*	*			trans	-59.5	0	177.6	-166.4	171.7	178.5	171.3	-1.2	111.4

Retrieved 1,142 of 1,142 residues in 380.7 ms (Link to these results)

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